smiles zinc_id inchikey mwt logp reactive purchasable tranche_name features O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 9931195 KQDQGTYCALISCZ-ZDUSSCGKSA-N 455.489 0.822 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccnc1)c(=O)n2Cc1ccccc1 10161520 YMYNEVUPNMAIDX-UHFFFAOYSA-N 475.509 0.920 50 20 JCGD C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)C2=O 10693123 PPXAWWSVXZKQHB-JFUMZLFPSA-N 474.470 0.018 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cc1C 726710836 UTPLPPCSBLGRNP-UHFFFAOYSA-N 468.518 0.101 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccccn3)CC2)o1 729396149 YNXDBLZQQDRZES-UHFFFAOYSA-N 464.500 0.642 50 20 JCGD CC(=NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1 730576793 KZTUXRNXDZHRMR-INIZCTEOSA-N 471.557 0.447 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12 788867110 SCLVINCLXKOYDM-YDHLFZDLSA-N 468.605 0.775 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)ccc1Cl 915789149 RYKVITMJEUYAKV-RYUDHWBXSA-N 456.908 0.314 50 20 JCGD Cc1cc(C)cc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)c1 916391588 FWRLEEMGVMGKBL-UHFFFAOYSA-N 453.499 0.785 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916517254 ZICKMSKSBDOXAQ-UHFFFAOYSA-N 486.558 0.134 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CSc1nncs1 916720259 PKBMBEMIDSHGAL-UHFFFAOYSA-N 471.586 0.431 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNC(=O)c2ccc(F)c(F)c2)cc1 918292999 SSGWLXGWSIAXOC-UHFFFAOYSA-N 454.455 0.471 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)cc1OC 919692657 OLFFLOWQHZOWGM-UHFFFAOYSA-N 457.487 0.838 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCO2 919820611 SRMPOIZFZXOIGU-UHFFFAOYSA-N 463.512 0.915 50 20 JCGD CC(C)N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 919886129 VBFWTSCHYFUDDU-NSHDSACASA-N 466.969 0.500 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778090905 HADXDFDQDXFQTR-ATBZTVMXSA-N 489.577 0.342 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCN(C)CC2)C1 1778845671 AOWWWNUHDNRMDU-SQGPQFPESA-N 459.429 0.779 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2 1779034261 PWJNPYCLTPHBIV-OAHLLOKOSA-N 450.710 0.499 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@@H]43)C2)C1 1779044658 BCLJTOUDFDYYCF-XBJMDHIQSA-N 464.352 0.698 50 20 JCGD N#Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cc1 1779374606 RUDFHFRSRKTSKK-HYBUGGRVSA-N 462.510 0.998 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781661322 UWXGAXXVFDZIBQ-ZJSXRUAMSA-N 499.304 0.784 50 20 JCGD CC(C)N(CC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)C(=O)OC(C)(C)C 1783932817 GPWIGNMMRUNYJO-HSZRJFAPSA-N 483.610 0.835 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)N1CSCSC1 1783936581 XLPNVRUTZWPDFQ-HNAYVOBHSA-N 459.638 0.232 50 20 JCGD CCOC(=O)N(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)Cc1ccco1 1784095421 GGBCLSRIAMWNPN-OWLYRPNTSA-N 471.938 0.818 50 20 JCGD COC(=O)c1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1784202442 GRIJREKTKHMWKL-KANFNMMFSA-N 452.935 0.985 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCn3ccnc3)C2)C1 1784399574 QKYKLWPACZCYFC-YALBQKEFSA-N 455.519 0.627 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(C)(C)O)[C@H]2C1)NC(=O)NCc1ccccc1 1786653941 GASIXBFIGQEJCW-UFYCRDLUSA-N 475.590 0.473 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCCO4)C[C@@H]21)c1ccc(B(O)O)cc1 1786979885 WJQMNOJGFRGBBD-LRQRDZAKSA-N 466.299 0.045 50 20 JCGD N#Cc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786985020 KRJUNHVPQUVZFA-LRQRDZAKSA-N 451.263 0.284 50 20 JCGD COc1ccc2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)ccc2c1 1787980933 RNHRNBDUDIKPPY-XZOYJPPVSA-N 489.337 0.830 50 20 JCGD O=C(NC1(c2ccc(NC(=O)c3cc(=O)n4[nH]cnc4n3)cc2)CCC1)c1cccc(B(O)O)c1 1788136836 TYOTXYWVYVOUNY-UHFFFAOYSA-N 472.270 0.159 50 20 JCGD Cc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)n1 1788607907 UMRJGDZVIOFPNG-YSSFQJQWSA-N 452.515 0.225 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4nccc34)C[C@@H]21 1788609696 BACHDEZHMPMJLT-DCPHZVHLSA-N 463.498 0.240 50 20 JCGD CC(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)on1 1789364961 AFAUBYQVIRTSNX-AXHNFQJDSA-N 456.503 0.704 50 20 JCGD C#CCO[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724679 KDUQOFJFHZEHNT-GBAJDQEWSA-N 485.585 0.351 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)CC1 1789925966 KQUROFAXROYVJS-ZQDZILKHSA-N 484.388 0.328 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791574534 JULMBLLQILCFMA-UHMOLFJZSA-N 469.372 0.536 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccc3)CC1)C2)c1ccc(B(O)O)cc1 1795732597 AFLOJUNKTCHZML-RUMRUAAYSA-N 477.370 0.486 50 20 JCGD CC#C[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)c1ccc(O)cc1 1795740916 PQAIAFVNYSNPGG-MGPQRACWSA-N 476.338 0.472 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1 1797233320 UIEAFQPPDLUHGX-UQCYYEOYSA-N 494.552 0.911 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748709 WNRFVGSVVVULGZ-XOIINTDNSA-N 490.561 0.192 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1ON=C(c3ccccc3)O1)C2 1798440487 MJDVKOSZBGVRQD-SAPPFGIOSA-N 464.482 0.672 50 20 JCGD CCSc1cccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1798776237 DUSFYQZVUSNDND-HGKCTWBKSA-N 455.345 0.390 50 20 JCGD CCc1oncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095238 ZSVLIOLKBPQTAU-OPMZPASUSA-N 484.557 0.786 50 20 JCGD CN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1799221410 GDXTYKSGDUDQCR-AUOOEQCUSA-N 492.976 0.872 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)n1 1799347798 SVKUQGVIJRXZSB-NVVZYBJKSA-N 461.244 0.892 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C 1802148912 UPHQWXYGWKKXOA-RGHULWKBSA-N 460.959 0.362 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1802332361 ATFRRJZLSZGWJL-VBUUOAMHSA-N 454.531 0.791 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CC[C@@H](N)C(N)=O)[C@H]1c1cccnc1 1807192750 YGOQQOQLYNMBLR-DNNBLBMLSA-N 454.369 0.711 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCc2cncnc2)[C@@H]1c1cccnc1 1807508429 LCIJJDNQPLMZNV-CVDCTZTESA-N 453.547 0.883 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1808714885 IUYFZRYRCRULIV-ICSRJNTNSA-N 462.319 0.567 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@H]1c1cccnc1 1810294743 MZLOPGLAPCTBLL-HXOBKFHXSA-N 499.535 0.845 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1 1810360636 UBNBVYLPOVHNNL-YZLZLFLDSA-N 469.380 0.912 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@H]1CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]1c1cccnc1)CCC2 1812224873 UJXMLFLAJHYFTQ-XMSQKQJNSA-N 473.342 0.617 50 20 JCGD CNC(=O)CC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)[nH]n1 1815142290 GVAABAFSTRKKAC-GOSISDBHSA-N 484.561 0.884 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4ncccn4n3)sc2C1 1819012155 HCGWNXBQMMMPEH-LLVKDONJSA-N 477.510 0.724 50 20 JCGD Cc1cnn([C@H](C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1 1826744817 OVJTUVRBENNLNI-CJNGLKHVSA-N 453.333 0.815 50 20 JCGD COc1nn(C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828925482 MUKHMTZDKCPPTA-LJQANCHMSA-N 469.546 0.974 50 20 JCGD N=C(N)SCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828927083 ZBMPHFYAIZONBD-KRWDZBQOSA-N 461.592 0.935 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829715238 VIQBGKSRAXLGBX-ZWKOTPCHSA-N 454.420 0.728 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cc1F)CCO2 1830085424 OVWHMMNKQUWACR-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1830450214 OWBXNIWLWMPROS-AVRWGWEMSA-N 482.342 0.249 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1830538122 WHFJHUJUAAWLGM-VQIMIIECSA-N 462.385 0.196 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1 1830543264 OGSNIYVCQAXBRD-XOBRGWDASA-N 468.348 0.887 50 20 JCGD O=C1C[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CN1Cc1cccs1 1830725808 MEOJGJKGMOYIBR-LUQKVYGDSA-N 485.990 0.153 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733487 NLBRMQHBANYRCH-DNVCBOLYSA-N 459.858 0.712 50 20 JCGD COc1cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(OC)c1OC 1830736600 UFEHAILQEGHRMB-IELSTOJBSA-N 498.960 0.782 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1830881866 LTQBJVKRUFXSOC-AOMKIAJQSA-N 492.013 0.984 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873406 IXCFUVCHKSVPDP-WMZOPIPTSA-N 452.600 0.687 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832755376 HJRUYNPCZBHKRL-KKSFZXQISA-N 467.906 0.041 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1833272057 SRIOLOLJYZWDOQ-DLBZAZTESA-N 477.002 0.043 50 20 JCGD COc1ncccc1CCC(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1833826191 YKJMVZVHTNVBAM-UHFFFAOYSA-N 488.633 0.967 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CSC(=N)N)CCO2)C1 1835505480 ZGJNSQZPEVIMMT-DJJJIMSYSA-N 494.014 0.202 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737275 DIOLVVSCYYSRPY-KRWDZBQOSA-N 482.589 0.403 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c(O)n1 1835737967 OWFXNQSZQTUOJC-UHFFFAOYSA-N 481.557 0.593 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1835754381 JLBQTZJRHUSLQK-IRXDYDNUSA-N 494.358 0.743 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4cccc(Cl)c34)C2)C1 1835930596 OQPDNETYRVUNFX-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc([N+](=O)[O-])[nH]1 1836195965 BCBXWFAYHVWOEU-UHFFFAOYSA-N 469.307 0.102 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1 1836400091 VCLQXIDAPAOKOV-FXAWDEMLSA-N 465.422 0.945 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(O)c1 1837461522 XTIKNIXRELFQCI-HSZRJFAPSA-N 469.498 0.083 50 20 JCGD COCc1oncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838166293 VMVZWEKTBOAHIL-UHFFFAOYSA-N 486.529 0.746 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cc[n+]([O-])cc3)CC2)CC1 1838394791 XZVAIBDJYDMKKC-UHFFFAOYSA-N 468.514 0.245 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838417998 SJCJIXWRYKQNQN-SGTLLEGYSA-N 485.360 0.609 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1839153237 WUGAQYGZUWPEEI-ZWKOTPCHSA-N 452.335 0.521 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@H]31)CCO2 1839697566 AWEJPXXMALTEMX-RQQCWZDESA-N 473.555 0.452 50 20 JCGD CCOC(=O)C1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC1 1839761789 BMIABNDSFZUIBN-LRDDRELGSA-N 451.289 0.477 50 20 JCGD CC(=O)NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1839885115 AQJURXWEZWKXNI-QFIPXVFZSA-N 492.485 0.116 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CCO2 1840118238 RFIKGRBZBQLUCQ-FBLLAGFSSA-N 464.327 0.240 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)C1 1840153757 ZCCAXUYUYUQUGU-DRSNIGMVSA-N 489.997 0.954 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)[S@](=O)c3ccccc3)C2)C1 1840155552 DZKLBLSOFSIDPK-CNXFJGJGSA-N 472.991 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccs3)C2)C1 1840183938 IZNHBHHBEYKRBD-GZNAHNRGSA-N 450.561 0.591 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1 1840184947 COOKKKUZSVDJES-OAQYLSRUSA-N 454.474 0.408 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)C(F)(F)F)CCO2)C1 1840204943 WSZRDJNJAFYTMR-LSDHHAIUSA-N 464.268 0.358 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1cccs1 1840374511 ZCBOHJRXBVXHDU-OPAMFIHVSA-N 458.345 0.302 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1 1840436315 XWJMMMZDJHGUIV-OTZYPNAKSA-N 499.572 0.170 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038276 LNMXCYPOWJSCIQ-QGZVFWFLSA-N 479.603 0.217 50 20 JCGD CCNC(=S)NCC(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1845759888 HLDPXTWZFKIQHJ-UHFFFAOYSA-N 463.516 0.821 50 20 JCGD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1847890740 BWTSKUXETSPHLK-MVJPYGJCSA-N 487.362 0.206 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCC(=O)N2CCNC2=O)cc1 11531891 KIDXSLYTBOBMPO-XNTDXEJSSA-N 466.454 0.436 50 20 JCGD Cc1cccc2c(=O)n(CC(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cnc12 16203529 UQITZNSJFFPIBL-UHFFFAOYSA-N 469.523 0.951 50 20 JCGD CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 17407134 DAHWTHJAKALDGK-MRXNPFEDSA-N 482.584 0.908 50 20 JCGD CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1 28634398 QQYYYXHJTCVGTQ-UHFFFAOYSA-N 459.572 0.876 50 20 JCGD C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(S(=O)(=O)N(C)C)cc1 726102437 LVWYCICFNVMXFV-GFCCVEGCSA-N 453.546 0.820 50 20 JCGD COc1ccc(CN2C[C@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)CC2=O)cc1 726523474 NWYRZXTVGKRXGN-GOSISDBHSA-N 488.566 0.820 50 20 JCGD CN(C)CC(=O)NNC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1 727761396 AAPWAONGSBFQMP-UHFFFAOYSA-N 452.455 0.695 50 20 JCGD CN(C)N(C(=O)CNS(=O)(=O)c1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1 728178758 DNXUBOVWUAIXMP-GFCCVEGCSA-N 454.368 0.220 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc([N+](=O)[O-])ccc1N1CCOCC1 728848687 ZVWZVLPTAGTASB-UHFFFAOYSA-N 455.475 0.899 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNC(=O)Cc3cccnc3)CC2=O)cc1 728851900 CORGVNQQOHKORS-QGZVFWFLSA-N 473.555 0.855 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1ccc(Br)cc1Cl 728869813 DICVKADVWAIOLO-KOLCDFICSA-N 478.752 0.899 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2O)o1 730778753 MFGXZOCJMAZGGL-ZDUSSCGKSA-N 481.483 0.541 50 20 JCGD COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C 731181080 KOASRKGOEBDONW-UHFFFAOYSA-N 455.514 0.655 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=S)Nc2ccccc2OC)c1 768276877 QWZMAILCPOCTHE-UHFFFAOYSA-N 467.573 0.905 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1OC 789852419 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CN(CC(=O)N1CC[C@@]2(CN(C(=O)CNC(C)(C)C)CCO2)C1)NC(=O)NCc1ccccc1 1780969945 PFISQEYWQXXYLS-DEOSSOPVSA-N 474.606 0.551 50 20 JCGD C/C(=C\c1cccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782523034 CZGWMNRCXZHIFS-SGMLIIRSSA-N 463.343 0.992 50 20 JCGD CC(=O)NCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783023001 SACGDSIRQCPHOT-PXNSSMCTSA-N 452.349 0.959 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3cccnc3nc1O)CCO2 1783937453 RRQPLFGRPKIZTK-QFIPXVFZSA-N 456.503 0.152 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCN(c3ccc(F)cn3)CC1)CCO2 1783937587 VHEVSVDEUVWRNZ-XMMPIXPASA-N 490.580 0.640 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)nc4n[nH]cc34)C[C@@H]21)c1cccc(B(O)O)c1 1786984614 VLYUWWNUULYEAY-KKXDTOCCSA-N 483.721 0.198 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnc4ccccc43)C[C@@H]21)c1cccc(B(O)O)c1 1786986669 XHGHPOXDRUULBS-JLMWRMLUSA-N 462.315 0.010 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@H]21 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VBWVVHJQARVROA-VQQMMKBISA-N 462.554 0.994 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2c(O)nnc12 1796288939 GSUXKASDJSAZPB-ZMJPVWNMSA-N 452.309 0.812 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(S(C)(=O)=O)CC1 1797141079 VMPUFOBGBKMDTD-FZKCQIBNSA-N 480.425 0.421 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)c2n1 1797753613 AJVZOUKVWHNYNP-CWPLJXCYSA-N 477.525 0.467 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)ccc1Br 1799027722 KQPCDQDRVHYWTI-XEMDLRDOSA-N 487.159 0.954 50 20 JCGD CC(C)(C)OC(=O)N1C[C@]2(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)C[C@H]1CO2 1799155947 AOHOMIILUIREAW-KNJMQODFSA-N 461.918 0.889 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800404865 AISJDLBRHLFPIG-FAQVEIGNSA-N 472.734 0.474 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(C)=O)c1ccc(F)cc1)C2 1800979034 OVXKZXKSIHUGQE-CGHHPOIWSA-N 455.914 0.846 50 20 JCGD COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c([N+](=O)[O-])c1 1801012582 QWILCHPPRGJDJO-MFKICJERSA-N 477.518 0.109 50 20 JCGD CN1CCC(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1802641653 AXYSDXCWCZRKJQ-URXFXBBRSA-N 464.375 0.813 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cc(O)n(C)n2)[C@@H]1c1cccnc1 1804894238 YQDWAEQYDHAKTB-RMFAIBCQSA-N 478.513 0.974 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(=O)c1ccccc1 1806234448 DLDINGUJJBZINB-RBBKRZOGSA-N 457.295 0.964 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2cscn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371694 XWWHHGDTUZXWLC-UWJYYQICSA-N 450.329 0.780 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375005 MAQIKBCMFZNGMW-GIVPXCGWSA-N 451.332 0.654 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807376709 XLAUWODAOWDRKO-NQIIRXRSSA-N 473.298 0.115 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CN2CCN(C)CC2)[C@@H]1c1cccnc1 1808416612 BUMUUCYKRBJNHI-SHIASZOCSA-N 494.600 0.469 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2nn(C)c3c2CCC3)[C@@H]1c1cccnc1 1809368520 XZPOHOYMVWKNKB-SBUREZEXSA-N 467.574 0.996 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1 1809775512 TXVKFDHFGVHKKM-UHFFFAOYSA-N 455.563 0.812 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810301658 BIFWSTNLUZMYGG-UWJYYQICSA-N 492.540 0.556 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)n1ccccc1=O 1810517734 YISYMLISTYZNSD-LLBVYWAGSA-N 474.326 0.504 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCc2cnccn2)[C@@H]1c1cccnc1 1813445566 FRWUQJAKSAABLS-JTSKRJEESA-N 474.525 0.823 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3cccnc13)CC2)c1ccc(B(O)O)cc1 1815344131 JKUHGKSCUNWPHQ-CQSZACIVSA-N 462.300 0.405 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362007 YHCMHKDHBGJQNO-BLLLJJGKSA-N 453.333 0.815 50 20 JCGD O=C(CCc1cncnc1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1815528855 DHHAUCVIGJEBMM-MRXNPFEDSA-N 451.317 0.472 50 20 JCGD CN1N=C(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)CCC1=O 1815619563 BFHRGAHEXYPZSR-QGZVFWFLSA-N 452.280 0.004 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3ccc4c(n3)OCCO4)sc2C1)c1cccc(B(O)O)c1 1816956705 SZDUPHVOQQBIBI-AWEZNQCLSA-N 480.311 0.529 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1818123712 HHJSTQCUFOYLBI-SJKOYZFVSA-N 456.507 0.581 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc2ncccn2n1 1819031952 UUCRARXOSGDHLR-GOSISDBHSA-N 459.275 0.752 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1820117762 BJAIXUGPBXQCQJ-OLZOCXBDSA-N 452.581 0.733 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)NC(=O)OC(C)(C)C)n[nH]1 1821220299 DUVVUOOHONFDNK-LIRRHRJNSA-N 481.554 0.618 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc2nn[nH]c2c1 1824411924 LBGJAZVBCYBPTL-AWEZNQCLSA-N 462.300 0.634 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCCC[C@H]2C2CCN(C(=O)C(Cl)Cl)CC2)n(C)c1=O 1825104844 AVZRBWRAKZXQFM-AWEZNQCLSA-N 499.399 0.857 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052129 PNPAMMDMDJJSLX-DYESRHJHSA-N 457.380 0.905 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1 1830534553 BMBXTGOUUUAOHX-FZKQIMNGSA-N 475.315 0.883 50 20 JCGD O=C(Nc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1)C1CC1 1830733282 HLKYPQBZEMXKTA-XMSQKQJNSA-N 465.934 0.705 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2 1830929749 AIPQDGYGFWCZLZ-RORVVXLTSA-N 497.552 0.975 50 20 JCGD C=CCO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831426901 LFVQZQLGAWKZIW-TUGUMKMLSA-N 461.519 0.168 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)CC1 1831829938 DMMXLXUTUBWVLJ-GOEBONIOSA-N 450.927 0.905 50 20 JCGD Cc1cccnc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833575421 ZJIVKSXKUBZCHG-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cs1 1834290952 LYGVFDFCGYXGBQ-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1csc(C)n1)CCO2 1834456213 YRPLSJUEQZUVNI-GQBLCDNYSA-N 474.543 0.656 50 20 JCGD O=C(Cc1cccc(F)c1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834494000 DYZBUUPGLDJAAV-UHFFFAOYSA-N 467.350 0.933 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2 1834823058 GYDCTVXHADGUDG-HUWVGRHQSA-N 462.341 0.757 50 20 JCGD COc1c(C)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1C 1835939749 ZVEPPHWZKIXSBG-RUZDIDTESA-N 482.342 0.376 50 20 JCGD O=C(CC1Cc2ccccc2C1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940782 AESRVWGLFIUIFU-AREMUKBSSA-N 478.354 0.242 50 20 JCGD CC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccc1 1837457042 TVADEGDUELPQOT-KBMIEXCESA-N 481.553 0.949 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459484 ROJLMIMEJGEBAL-OSPHWJPCSA-N 482.541 0.256 50 20 JCGD C=C(C)CC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459496 RYGOCGGJKBENCS-QHCPKHFHSA-N 459.547 0.748 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)Cc3ccccn3)CC2)CC1 1837975494 DRMDEJONPMQXGK-UHFFFAOYSA-N 466.542 0.935 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cncc1F)CCO2 1838164459 CTINNFYHSBOCKJ-QESWDSMOSA-N 490.467 0.564 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCCNC4=O)CC2)CC1 1838302074 YAZSEIIFSPXSTN-QGZVFWFLSA-N 481.981 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1 1838621623 NEZXVILZQXCFFR-MOPGFXCFSA-N 491.633 0.759 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCO2 1839079718 KBUJNIWBUPUEFH-OZIGNCPNSA-N 496.402 0.172 50 20 JCGD Cc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839312123 FOXTWJTWGRLQPH-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD Cn1nc2c(c1C(=O)N1CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C1)CCC2 1839583662 LLVMCTYIURVTBW-MAUKXSAKSA-N 459.316 0.669 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1 1839625553 ZYLXKKFQIVRQRL-SGTLLEGYSA-N 470.299 0.722 50 20 JCGD O=C(c1ccc2nn[nH]c2c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839629873 SEVKUZUQOXHSJZ-WMLDXEAASA-N 456.272 0.718 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)[S@@](=O)c1ccccc1)CCO2 1839673872 DQTGTGDJKQDNGG-SZNLVYJDSA-N 472.991 0.893 50 20 JCGD COC(=O)C12CC(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](C)CBr)C4)C3)(C1)C2 1840004639 IUYHCVZHDDCQOO-XHNVJUCFSA-N 473.364 0.817 50 20 JCGD COc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)c1OC 1840034737 VZZBNGIOWSKKKH-ORAYPTAESA-N 472.336 0.952 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(OC)ccc3[N+](=O)[O-])C2)C1 1840152224 BIVXZUSYMUVXOH-DJJJIMSYSA-N 472.882 0.322 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1840154802 GZLCRUCNMGZLLD-UWJYYQICSA-N 469.970 0.042 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840183504 IBXKGEHLOGBRSH-HSZRJFAPSA-N 462.547 0.067 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)C2)C1 1840184669 ANGUSEABDJFIOP-GKAYAJSDSA-N 450.580 0.642 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n(-c2cccc(=O)n2C)n1 1840188236 YMMDAPZUPVASHN-OAQYLSRUSA-N 498.367 0.753 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1cc(C)cn1)CCO2 1840403753 OPUPBBHRPDGOJE-OMAORGLMSA-N 485.545 0.343 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1840850891 FYJKETGCLKZJRQ-QOKNQOGYSA-N 462.385 0.779 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1Cc3ccccc3C1)CCO2 1840944391 DTQHOGUQLBKLOO-XMMPIXPASA-N 458.559 0.231 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cnc2s1 1843785380 VIBKOJYEURPLAB-UHFFFAOYSA-N 467.511 0.194 50 20 JCGD Cc1ncc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)cn1 1845038583 VSLCGPBQHGOMPR-UHFFFAOYSA-N 451.531 0.948 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCCC12CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1845172870 JIYCKWOPOONOTQ-VEVIJQCQSA-N 477.414 0.606 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CCC3(CN(C(=O)OC(C)(C)C)C3)O1)C2 1846383868 CZRVSRONYPBRMK-QGZVFWFLSA-N 493.605 0.731 50 20 JCGD CN(CCCOc1cccc(S(C)(=O)=O)c1)C(=O)NNC(=O)CNC(=O)c1ccco1 725872772 RUTSFDVOUBXGQZ-UHFFFAOYSA-N 452.489 0.555 50 20 JCGD COCCC(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 727100010 IIEOLBIRAFOPFL-UHFFFAOYSA-N 456.503 0.248 50 20 JCGD C[C@H](CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)S(=O)(=O)c1ccc(F)cc1 729129557 BJOIFFHGIGQHLK-FZKQIMNGSA-N 480.470 0.909 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2c(C)[nH]c3ccnn3c2=O)c1 729296111 WABZSWBLZULEIL-UHFFFAOYSA-N 460.516 0.365 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl 730781194 HCPNQYQSQOTAMV-UHFFFAOYSA-N 469.903 0.907 50 20 JCGD CC1CCN([C@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 743333861 BIBJUJTZPAPADF-QGZVFWFLSA-N 467.592 0.772 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@@]3(CCCC[C@@H]3C)C2=O)cc1OC 785980778 NJTMFGMMEQRHIC-WHEQGISXSA-N 476.486 0.509 50 20 JCGD Cn1cccc1C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C\c1ccccc1 822066349 MRLXQNYIGNCCFW-DNXIFWLFSA-N 468.557 0.180 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1OC 914831045 BVMYHYHMSBDPJP-HOTGVXAUSA-N 467.544 0.671 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)c2ccccc2c1=O 916266848 IZQFHECLXBORRO-UHFFFAOYSA-N 493.572 0.924 50 20 JCGD C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1F 917915246 HXLGTXARNOUUOG-UHFFFAOYSA-N 459.459 0.612 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C(\C)C1CC1)c(=O)n2Cc1ccccc1 918017221 RPFHJDXFHAZSQO-RVDMUPIBSA-N 450.499 0.932 50 20 JCGD COc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1 1115854306 XUBONQNZQWQKRP-UHFFFAOYSA-N 462.532 0.186 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1 1779230030 OSDMYCSWFIWJNN-NRFANRHFSA-N 474.905 0.256 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2 1779408638 YMHQLJCARMDLCF-HBUWYVDXSA-N 453.319 0.799 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1779682367 PXYJINQJZOPYKX-QFIPXVFZSA-N 473.722 0.571 50 20 JCGD COc1cc(C#N)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1780089327 UCELECNBRAQHMJ-RCZVLFRGSA-N 477.326 0.688 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1O 1781183329 HEMIWMKNLLULEG-RCZVLFRGSA-N 495.341 0.472 50 20 JCGD Cc1ccc(C(=O)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1782094368 SAGVLGVHYDPPCR-PXDATVDWSA-N 464.327 0.685 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(C#N)cc1)C2 1782210122 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COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CS[C@H]3CCCCO3)CCO2)C1 1837510386 KZSVAHFWYVCPCC-VDZJLULYSA-N 450.985 0.956 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cn1 1837711273 BHYLNCYERCJSKK-NRFANRHFSA-N 465.579 0.790 50 20 JCGD COc1nccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1F 1837920360 PBEJOIMEYKCMOZ-UHFFFAOYSA-N 485.321 0.835 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839049020 FGZZVYCFFAMNDC-FUHWJXTLSA-N 470.299 0.419 50 20 JCGD CCNC(=S)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839154944 DAISRRVKUJTZAA-IRXDYDNUSA-N 455.408 0.163 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2 1839690277 CAKWTTVGNZEWRS-FQEVSTJZSA-N 479.440 0.140 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc[nH]c4cc3F)C2)C1 1840184815 BASFQEXJHXOPNW-QHCPKHFHSA-N 475.521 0.750 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840798229 HEVTTZPOJUUDMZ-AUSJPIAWSA-N 496.026 0.299 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843010453 RFKOIBCMTUKBQT-UHFFFAOYSA-N 455.320 0.361 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014493 QIXBSUZQYKIAIP-HNNXBMFYSA-N 453.279 0.141 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1843384755 XQWQDABNSKCEGH-AEIQVQRHSA-N 490.561 0.864 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(Br)ccc2O)C1 1844881828 WBAXURNOKVXTPG-UHFFFAOYSA-N 459.105 0.965 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)Cc2ccc(O)cn2)C1)NC(=O)NCc1ccccc1 1846662082 YPQQNJVUYRLFNV-UHFFFAOYSA-N 466.542 0.879 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1847943465 ZZCJRVJMLARWQT-FCLVOEFKSA-N 475.351 0.110 50 20 JCGD COc1cc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc(OC)c1OCC(N)=O 10159804 CHFZRDOGVIRHJJ-UHFFFAOYSA-N 455.427 0.534 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccs2)CC1 11090878 UDQNYKAAZQOOAC-UHFFFAOYSA-N 470.529 0.758 50 20 JCGD CC(C)(C)NC(=S)NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 14894988 NWMTUZCYSGWMMD-UHFFFAOYSA-N 455.606 0.594 50 20 JCGD O=C(NNS(=O)(=O)c1ccc2c(c1)CCC2)c1cccc(S(=O)(=O)N2CCOCC2)c1 16128193 QJWLDWAQGDUTHX-UHFFFAOYSA-N 465.553 0.820 50 20 JCGD Cn1nc(C(=O)NNC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c2ccccc2c1=O 17193252 WFAFJHVVWUNFOV-UHFFFAOYSA-N 466.410 0.991 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)CNC(=O)c2cccs2)c1 725902173 INXAJSBVAPVXKS-UHFFFAOYSA-N 495.583 0.086 50 20 JCGD CN(C)N(C(=O)CNC(=O)c1ccccc1I)[C@@H]1CCS(=O)(=O)C1 728180692 WGKUTJZXABXBNE-LLVKDONJSA-N 465.313 0.513 50 20 JCGD COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)c2cccc(C#N)c2)CC1 728955094 WOKCZGALHVJSKX-UHFFFAOYSA-N 489.510 0.916 50 20 JCGD CC(=NNC(=O)CNC(=O)c1ccco1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1 750937662 ZXFWOMRDHCMJOS-UHFFFAOYSA-N 450.473 0.693 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1c(C)nn(C)c1C)c(=O)n2Cc1ccccc1 901390890 BUCMECWVWBXRJS-UHFFFAOYSA-N 478.513 0.239 50 20 JCGD O=C(NNC(=O)c1cn[nH]c1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 916144539 DEPWLQAYPLQFJD-UHFFFAOYSA-N 468.539 0.991 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(CN3CCOCC3)c2)c1 918223588 KGQJNKBPDAOYOS-UHFFFAOYSA-N 475.571 0.913 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778113838 DUGDNMYKZCVNQV-RDTXWAMCSA-N 480.425 0.519 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1779197658 JNOCPOBIXRFLOB-KSFYIVLOSA-N 495.964 0.982 50 20 JCGD Cc1ocnc1C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968413 KOYQIJJFDJMBBE-QHCPKHFHSA-N 470.530 0.773 50 20 JCGD COc1cc(C)c(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1OC 1781893037 BIYIACOKCCVWPE-QHCPKHFHSA-N 462.547 0.829 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1F 1782110578 WCLXUNHBBQXUNZ-HSZRJFAPSA-N 488.495 0.787 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H](F)CN1C(=O)OC(C)(C)C)CCO2 1783939523 HGPYGIKMVBMQBK-HKARXFIJSA-N 499.584 0.537 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1 1784252525 GWJDEUCQPIKKCK-KNQAVFIVSA-N 458.707 0.197 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cc3cccc(F)c3)NC(C)=O)C2)C1 1785457851 FEAINMWDGPPXDX-IPJJNNNSSA-N 469.941 0.957 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCOCC3)[C@H]2C1)NC(=O)NCc1ccccc1 1786610016 STWVPWBEYMZUSY-FKBYEOEOSA-N 487.601 0.739 50 20 JCGD CN[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21)C(=O)O 1786898395 JLURODGJGMMROJ-ANUKBMERSA-N 476.480 0.914 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1OC 1786980093 ILKZYWVPXRFRIV-PTLVVNQVSA-N 496.369 0.610 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cccnc4n3)[C@H]2C1 1788310421 NMVCINUYEDLGSN-BRZMCFHBSA-N 478.513 0.457 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1789934323 SRBYVLGBQUIAJM-YGJAXBLXSA-N 496.374 0.932 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1792886012 UDOVHFKCZMLMTO-QVHKTLOISA-N 464.357 0.247 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)n1 1796190937 GETMYBOGDZPHBL-MUJYYYPQSA-N 454.248 0.244 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc[nH]1 1796331989 DOJOUPPTZZRYNR-VTEUUUEMSA-N 457.443 0.689 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C#N)cc1)C2 1796440401 WMWKDKDJCWHMTC-RHZSSNLCSA-N 462.510 0.824 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c(O)c1 1796441686 PXNIKSLYNJFHIP-JXZJUKCJSA-N 469.498 0.738 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncncc3c1)C2 1796442057 PLDZGORIAYPJPS-NKNSKHGVSA-N 475.509 0.967 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796444036 VTSVGQZUOJZGHL-HHWFLTMWSA-N 463.491 0.272 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnn1)C2)NC(=O)NCc1ccccc1 1799097063 AEXMXFXEWGSBQP-RMFSNUHRSA-N 467.530 0.026 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(C)CC1(F)F)C2)NC(=O)NCc1ccccc1 1799099349 UVRMHYCHIMISHS-ZRAXVTTISA-N 479.528 0.968 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)C1 1799350445 RBHPDRWVYYQXGF-XLWJZTARSA-N 494.358 0.902 50 20 JCGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1cccn1 1801386177 HTMXTSCEPIXOLG-KMQSCTNJSA-N 483.573 0.380 50 20 JCGD CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1801799067 OLZXYFCYORRCPI-CRWXNKLISA-N 495.378 0.245 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2cnnn2)[C@H]1c1cccnc1 1804240351 ZGQTYLKVBKHFMY-RYRKJORJSA-N 492.968 0.906 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1804827431 MYZZJPRAAOLIPN-XXBNENTESA-N 487.325 0.748 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365061 VONVNLKLSUQFNX-ACIOBRDBSA-N 473.342 0.046 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372352 DNNKQRUOSDZOTL-UWJYYQICSA-N 488.288 0.577 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)no1 1808388762 NLPVDCKYFQUUJI-JPYJTQIMSA-N 491.313 0.406 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H](F)Br 1808661337 IOUGJKCBXXPLAK-USXIJHARSA-N 464.100 0.772 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)Cn2nccn2)[C@@H]1c1cccnc1 1808947095 KHUDUQHLSZFAEJ-FIAMHUAMSA-N 463.502 0.513 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=N/O[C@H]2CCCCO2)[C@@H]1c1cccnc1 1810357998 NXMCUJKSROSYPF-DUGOWKOGSA-N 474.562 0.989 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@H](C)NC(=O)c2cnccn2)[C@H]1c1cccnc1 1810441683 SFQYKYMDQBZDPN-PCODUJHASA-N 474.949 0.950 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1 1811452466 ZMRJFZXCHIHLON-BREJEOOZSA-N 476.497 0.619 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813072818 FYMBHSDFIYXSLA-ZWCUEREDSA-N 455.563 0.993 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4ncnn4c3)sc2C1 1819402811 QDPDNZFXSIPSPQ-CYBMUJFWSA-N 456.532 0.785 50 20 JCGD CN1CCN(C2(C(=O)Nc3cc([C@H]4CCCCN4C(=O)CCC(=O)NN(C)C)[nH]n3)CC2)CC1 1820801689 TYTOJAISHIDZJS-GOSISDBHSA-N 474.610 0.555 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cn3ncccc3n2)CC1 1828261113 LHIANARUQYNYQX-NRFANRHFSA-N 461.331 0.956 50 20 JCGD O=C1NC[C@@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCN3C(=O)OCc2ccccc2)O1 1828549082 VHZMYFIBMQJMOO-HOIFWPIMSA-N 494.932 0.147 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828922185 QRUHLGFZJNSAME-VQTJNVASSA-N 458.563 0.833 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829026068 NCGVDWJGMRANQI-JTSKRJEESA-N 493.373 0.208 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829041662 RCDLZKLALXKZNO-OAQYLSRUSA-N 464.331 0.633 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1830358094 LKVKASFUYIFMGH-HXUWFJFHSA-N 473.979 0.820 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)C1 1831645617 CPSKFJDPWMVWLL-VWKPWSFCSA-N 477.986 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnncc2C(=O)O)CC1 1831873118 AMKQEQZXVYXOEU-SFHVURJKSA-N 460.535 0.781 50 20 JCGD Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cs1 1833819340 OSTZRVRPKFQPSX-UHFFFAOYSA-N 485.614 0.878 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H]3Cc4ccccc4CN3)CC2)CC1 1835087338 ICUGOIDFQMYUTF-HSZRJFAPSA-N 484.645 0.646 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cc3cnccn3)CC2)CC1 1835116305 HQCMMYFGAYXOAU-STBIYBPSSA-N 480.573 0.725 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc4cncn4c3)CC2)CC1 1835618475 YLQGOOGTJABESK-UHFFFAOYSA-N 469.590 0.893 50 20 JCGD CC[S@@](=O)CCC(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835655818 WGDSMWDRQFOPAK-OIGAYQAOSA-N 492.646 0.851 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3nccn3)CC2)CC1 1836421767 HYOYFSOHBBUSND-SFHVURJKSA-N 498.028 0.982 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1837116684 NLCZFZQPKDATOJ-LIRRHRJNSA-N 463.362 0.819 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1837375238 OWHVGALSGKROQL-IYOUNJFTSA-N 463.373 0.181 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1ccccc1=O)CCO2 1837681400 ZAGCTVXTCWOCTF-QINHECLXSA-N 470.364 0.897 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1 1837715528 VOHJIRRGNPAJHR-QFIPXVFZSA-N 452.624 0.993 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n[nH]1 1838658537 SMWSTKIKSLIDIB-HRAATJIYSA-N 485.969 0.920 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839154390 MRIQSFXQIHFBDX-UPRAQXHNSA-N 484.377 0.522 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1cc(C)cn1)CCO2 1840403752 OPUPBBHRPDGOJE-LOQXBKARSA-N 485.545 0.343 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1840784577 WMEIOPDSZPGKQV-FXAWDEMLSA-N 474.341 0.968 50 20 JCGD CCN1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CC1 1840929366 RKDPOPUJVGAVMM-CRAIPNDOSA-N 450.349 0.865 50 20 JCGD Cc1cccc(C)c1N1C[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CC1=O 1841915789 LAXLJDQUYDSIFR-FQEVSTJZSA-N 475.354 0.853 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCNC3=O)C2 1841924463 OOOOBHCCRTZUJL-AWEZNQCLSA-N 480.953 0.576 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015493 JZFCFWLEZYMRMF-SFHVURJKSA-N 459.352 0.877 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039032 WCAWEFFZADNDBZ-KRWDZBQOSA-N 456.547 0.227 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846157679 HFPRWJGYBSRMAR-DVECYGJZSA-N 483.374 0.831 50 20 JCGD COC(=O)N(CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)Cc1ccccc1 1846259811 ZYZAURDNVRJKIX-UHFFFAOYSA-N 465.315 0.452 50 20 JCGD CC(C)(C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)S(=O)(=O)c1ccc(Br)cc1 726137956 HUBHBGKHMMHLAK-SNVBAGLBSA-N 467.363 0.584 50 20 JCGD CCCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 728320155 ZUVDJHYGZNKODG-SFHVURJKSA-N 477.495 0.983 50 20 JCGD O=C(Cc1cccnc1)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1 728982119 RKVIRSGTAHNQHA-UHFFFAOYSA-N 467.467 0.868 50 20 JCGD O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1 730539322 BRQGKKBLGANCLR-FQEVSTJZSA-N 457.494 0.846 50 20 JCGD CS(=O)(=O)N1CCN(CCNC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)CC1 749352146 GGWDECASZJBEJS-UHFFFAOYSA-N 489.598 0.564 50 20 JCGD COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2=O)cc1OC 915077416 OQRAQQOHCIAZRT-KRWDZBQOSA-N 489.550 0.960 50 20 JCGD O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)c1csc(N2CCOCC2)n1 915902639 YHXCUIRSXSLNRF-UHFFFAOYSA-N 473.603 0.742 50 20 JCGD C[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)N1CCC[C@@H](C)C1 916450429 NURBOJVUYIDMKS-SJORKVTESA-N 453.613 0.764 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCSc2nnnn2C)c1 917900252 VERXVWQEXLQWRX-UHFFFAOYSA-N 491.555 0.963 50 20 JCGD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 919361670 PNAHQRNNQGLPNQ-HNNXBMFYSA-N 456.477 0.493 50 20 JCGD Cc1c(C)c(C)c(S(=O)(=O)NCCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)c1C 920212313 AQPXBHJWAJHRHV-MRXNPFEDSA-N 474.605 0.415 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)CC1 1778114628 XDUKFTQNRCNBIC-QGZVFWFLSA-N 466.398 0.273 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2[nH]ccc2n1 1778997576 UUUPMLDDGCQNFC-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CCn3cncn3)CCO2)C1 1780098294 IWJRAALDKMXCTK-NRFANRHFSA-N 472.458 0.645 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)nn1C 1780433919 ZVXLMOPYMRQUFU-KURUZVKSSA-N 457.491 0.006 50 20 JCGD COCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559207 BUYBWMGAPKAQMN-AUSIDOKSSA-N 461.563 0.493 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)c(O)n1 1780969372 YVPKJROSGFQKRH-RUZDIDTESA-N 496.568 0.885 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc(N)s1)CCO2)NC(=O)NCc1ccccc1 1780970677 ZSORCBVJKACEFG-QFIPXVFZSA-N 487.586 0.515 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cnc2c(c1)CCNCC2 1781523075 SGYLPQJNKUJEFR-WOIUINJBSA-N 450.967 0.497 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)C2 1782003000 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CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCOC3)C2)C1)NC(=O)NCc1ccccc1 1784722571 NPVSNVRWFGJLFV-CVDCTZTESA-N 459.547 0.199 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccnc3Cl)[C@H]2C1 1785170205 PIJBZGGIYRFMTE-ULQDDVLXSA-N 451.955 0.630 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)n[nH]3)[C@H]2C1 1786937261 BYIVWGAZKGRJIC-JURCDPSOSA-N 471.942 0.841 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3COc4ccccc4O3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978800 XIMQTMUNLXKDIA-UDSSINMLSA-N 480.326 0.190 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CS(=O)(=O)C4)[C@H]2C1 1787151383 YKEANUMNSNDBAK-ASHKBJFXSA-N 489.392 0.462 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)CC1 1789521691 VTGIADSNJPREMX-UHFFFAOYSA-N 493.568 0.597 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)[C@H](Cl)COC)C[C@@H]31)C2 1790687147 DEDSZMJHNGOVKI-CWLGOENISA-N 496.992 0.856 50 20 JCGD 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CCNC(=O)N[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798385502 ODUIGHMQKDWSRJ-RSPOEFSDSA-N 487.605 0.678 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]cc1I)[C@@H](O)CCl 1798791696 QINSZQGATDLWTC-DKIAZLNASA-N 452.680 0.866 50 20 JCGD CN1CCC(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1802568226 YOKDYRQHVXBUCI-NQIIRXRSSA-N 465.558 0.742 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1 1803016799 ZDLQBJCENXSBFM-INWMFGNUSA-N 469.336 0.661 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cn2nnc3ccccc32)[C@H]1c1cccnc1 1804018209 BRFPYSROXXBQGY-HOYKHHGWSA-N 478.557 0.905 50 20 JCGD O=C(CC1CCOCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1806934681 XNEGKEKTBCTGFV-REWPJTCUSA-N 451.332 0.898 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2[nH]nnc2C)[C@@H]1c1cccnc1 1807802539 LKMZTLYSSRROQU-RBIZEYAUSA-N 463.502 0.962 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1808712494 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Cn1c(=O)c2c(ncn2CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](F)Cl)CC2)n(C)c1=O 1825105631 WBDPCNWLHRRDER-YOEHRIQHSA-N 482.944 0.588 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCCC2=O)CC1 1828925358 KBYOUQREUPCORN-LJQANCHMSA-N 456.547 0.541 50 20 JCGD CN(C)c1cccc(OCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830726356 QEKPCDMHXMJPJV-WIYYLYMNSA-N 455.939 0.188 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830730690 CRFPTDLCKCVPGY-PNLZDCPESA-N 489.997 0.832 50 20 JCGD COc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(OC)c1 1830735274 FRNCVYQETQCJNY-PGRDOPGGSA-N 470.950 0.693 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737774 GYZZDLOPGHUYMI-QYWGDWMGSA-N 477.986 0.736 50 20 JCGD O=C([C@@H]1CCCN1Cc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830739122 ZDPJJUHFRHYKCD-JTAQYXEDSA-N 465.978 0.707 50 20 JCGD O=C(c1cnnc(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1833209708 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O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1n[nH]c2ccc(F)cc12 1835589935 OXEMKKLKICLIBD-UHFFFAOYSA-N 493.348 0.881 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1 1835823786 AMJWPEFJTMCVBG-WRWLIDTKSA-N 469.380 0.959 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2n1 1835931773 CCUCUFUXZMZONA-VWLOTQADSA-N 492.341 0.015 50 20 JCGD Cc1cccc2cc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)[nH]c12 1835936834 FXKYRWXRFOPMAO-VWLOTQADSA-N 477.326 0.540 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)C2)C1 1835941483 LOEJMPDRELRSMJ-ZJBJCVSYSA-N 498.307 0.805 50 20 JCGD O=C(Cn1cc(Cl)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1835974957 TWHJDIGRCSQPSU-ZFWWWQNUSA-N 453.696 0.683 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)cc1 1837455661 CEXQZLHXQWVRFM-CRICUBBOSA-N 497.552 0.567 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1837638917 GFZRJXFCIDBKMA-BQYQJAHWSA-N 452.552 0.477 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1 1838513498 VKOLPLGDKVWTRJ-GTNSWQLSSA-N 470.349 0.940 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1cn3c(nc1=O)SCC3)CCO2 1839044435 GCELDEGTOBGOSI-OAQYLSRUSA-N 496.662 0.199 50 20 JCGD CNc1nsnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839149741 QSGRJUVESHGWRN-CVEARBPZSA-N 452.364 0.886 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839154391 MRIQSFXQIHFBDX-VMDGZTHMSA-N 484.377 0.522 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)nc2ccc(Cl)cn12 1839603549 PYJGSIPUIAUZRV-MGPUTAFESA-N 471.341 0.966 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(Br)cnn3C)C2)C1 1840152942 ZATIDQXVTPEFOU-DYVFJYSZSA-N 479.759 0.506 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)[S@](=O)c1ccccc1 1840186085 ZGRAZGRSDCCWHY-VHKJGPOGSA-N 494.614 0.012 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840896985 GESQURKYKQNXJH-SJORKVTESA-N 484.427 0.539 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2sc3nccnc3c2N)C1 1842991666 VFDQBLGCKZSUJG-UHFFFAOYSA-N 452.500 0.403 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1844692711 BPTUIEUXONAHJQ-MRXNPFEDSA-N 464.431 0.402 50 20 JCGD COC(=O)[C@@H](CC(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2)NC(=O)OC(C)(C)C 1846305247 YYRAAUUJQWIIMH-OAHLLOKOSA-N 483.566 0.019 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CCC3(CN(C(=O)OC(C)(C)C)C3)O1)C2 1846383867 CZRVSRONYPBRMK-KRWDZBQOSA-N 493.605 0.731 50 20 JCGD O=C(Cc1ccc(Br)cn1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1848243142 UVDZHYUTJLBFOL-ROUUACIJSA-N 458.121 0.582 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)Cc2csc(N3CCCC3=O)n2)ccc1Cl 726152468 QDKPKDOGFJYQLC-UHFFFAOYSA-N 457.921 0.574 50 20 JCGD N#CCCn1cc(/C=C(/C#N)C(=O)N2CCN(C(=O)Cn3cnnn3)CC2)c(-c2ccccc2)n1 727391999 LRSBREONDVGQDX-UYRXBGFRSA-N 470.497 0.728 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1 728381564 OPXXWWUNCQMLGD-NVXWUHKLSA-N 471.557 0.015 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cscn1)N(S(C)(=O)=O)CC2 728600811 UOYHDVPOAYJGQA-CQSZACIVSA-N 454.530 0.870 50 20 JCGD O=C(NNC(=O)c1cnn[nH]1)c1cccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1 729455593 MXHNRWFBGDBVFY-UHFFFAOYSA-N 469.527 0.386 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)cc1 913430457 AVXALPBODZPWGZ-UHFFFAOYSA-N 478.527 0.598 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)c1 914748282 SCIJUHPFZNFEIA-UHFFFAOYSA-N 470.529 0.389 50 20 JCGD O=C(CN1CCCCCCC1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915802973 YBKRYYPSTHEDHW-UHFFFAOYSA-N 452.533 0.261 50 20 JCGD CO[C@@H](C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 917690039 UMFTVBPMAZBDSK-KRWDZBQOSA-N 460.556 0.989 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCc1cnn(C)c1)N(S(C)(=O)=O)CC2 919792869 OLNUHACTSVIZQM-INIZCTEOSA-N 480.547 0.217 50 20 JCGD CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 919887139 ZPZCISINVRWEJW-HNNXBMFYSA-N 497.551 0.984 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1)NC1CC1 920821886 GCZOPVSDZFNJPJ-UHFFFAOYSA-N 451.549 0.804 50 20 JCGD CC(C)(C)OC(=O)N1CCn2ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2C1 1778375892 DYWFTDWRKNRLCK-JTSKRJEESA-N 497.980 0.677 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3cccnc23)C1 1778964898 VFEZDOGWQLOHOS-WZONZLPQSA-N 478.513 0.169 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccn(-c4ccccc4)n3)CCO2)C1 1779032501 LWOANRZQVATPRN-DEOSSOPVSA-N 475.509 0.628 50 20 JCGD Cc1nnc(CC(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)o1 1780970561 XFIXNFUUTUSULU-QHCPKHFHSA-N 485.545 0.097 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781052569 KWDRUWNRIVJOLO-KTTGSAFNSA-N 495.341 0.264 50 20 JCGD CC[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)NC(=O)OC(C)(C)C 1781357121 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CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1783353617 XVXADEMKLJYSIM-LIRRHRJNSA-N 466.336 0.948 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)c1 1785587922 WUTLATONDMORSW-HJPIBITLSA-N 478.340 0.769 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(F)cc1 1789692341 RZZKRECHJWBWPT-GBBGEASQSA-N 455.914 0.582 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789926604 CWHOHUKVNWCTSP-SLZITWOASA-N 474.331 0.127 50 20 JCGD CCN(CC)C[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790602293 IGFYOERWAHCQNE-FVCZOJIISA-N 460.579 0.256 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1 1791292472 SXZDYIVEPYQJFU-IHPCNDPISA-N 459.547 0.611 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)CC2=O)c1 1792487631 CBVGSEREPGPWEH-BZNRXQDOSA-N 491.353 0.680 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)c(F)c1 1792743356 ABQSJXBTCIEIJV-USGNIVHTSA-N 473.480 0.799 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1[C@@H]2CCC[C@H]1c1ccccc1N2 1795498817 LPBLEGCWZZFLFZ-IBWAHOODSA-N 489.381 0.948 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(C(F)(F)F)c1)C2)c1ccc(B(O)O)cc1 1795736997 SVZIOUWMKGDPQL-VPTLXERWSA-N 494.250 0.970 50 20 JCGD O=C(/C=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)NCc1ccccc1 1796189771 YGOBDSVJYBKUDF-RPEZMIMVSA-N 461.327 0.491 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCCO3)C2 1796442215 WNZMAGAITYCYQS-IHBLFXCCSA-N 481.509 0.795 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)C2 1797751507 BRNVLMYZDVALBL-DHAILBGBSA-N 479.562 0.776 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1 1798439654 SSYZMVCYHPCTST-MUJYYYPQSA-N 471.539 0.654 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(=O)OCCO 1798567582 HLJZDSARPODTQS-ZJOBFFGXSA-N 469.332 0.822 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl 1799276343 JHDHKTMHWOEWEL-SFUJAXRZSA-N 453.319 0.307 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Br)c(O)c1 1799584859 VHODLFGHFVPPIP-CCWDJLKJSA-N 489.131 0.352 50 20 JCGD O=C1NC(=O)[C@@H](CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)Cc2ccccc2)N1 1800435752 MJGXINQVLNAQGJ-WXQHOCMDSA-N 493.358 0.180 50 20 JCGD O=C(Cc1cnc2ccccn12)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1803099211 NHXBFTUKAZWZLN-NLFFAJNJSA-N 483.337 0.971 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1803791577 PEULOSOLSCDJRG-DENIHFKCSA-N 461.331 0.745 50 20 JCGD CN(C)c1ncc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)o1 1805340919 KECSJJSLADTQLQ-DNVCBOLYSA-N 478.513 0.768 50 20 JCGD Cn1nc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c2c1CCC2 1807362467 LZSVBDLTKSFLMU-FDDCHVKYSA-N 473.342 0.617 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1 1807366638 GDNGCDGAWGWSQP-NQSCKRDGSA-N 461.331 0.847 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375827 VOCNVSVSLYLJSJ-URXFXBBRSA-N 499.373 0.151 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](N)Cc2cccnc2)[C@H]1c1cccnc1 1808365219 VPYGRGFZBJOWQG-ZRCGQRJVSA-N 467.574 0.425 50 20 JCGD COCCn1nccc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1808639878 TTZATMPQYUNOMQ-XMSQKQJNSA-N 471.562 0.617 50 20 JCGD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc1 1808895632 TWHPRJGZDMABLR-XMSQKQJNSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnn2cccnc12 1809740800 GUFSVOQNIDMUMT-WIYYLYMNSA-N 470.298 0.438 50 20 JCGD C[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)n1ccccc1=O 1809978670 JXFQRWSHELYVQM-SFHVURJKSA-N 451.332 0.634 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)C1 1810295396 SIRIGSYMINTZMM-ONFYXGJMSA-N 494.552 0.989 50 20 JCGD Cc1noc(N)c1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810301814 CPBOEHPPBHXKRG-KDOFPFPSSA-N 464.486 0.592 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCc2cncnc2)[C@@H]1c1cccnc1 1810301870 DDHOQQXQTJRFNZ-XMSQKQJNSA-N 474.525 0.823 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1 1810950003 FQFRORLUVHWROQ-DYVFJYSZSA-N 450.459 0.142 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813020440 CKUPTAWXWXXOMP-CWKRKGSWSA-N 491.353 0.836 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813072317 FRVFYLPDZLMKJC-AVRDEDQJSA-N 459.547 0.970 50 20 JCGD COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1813267040 MPJGPLBGSRSWDQ-CPJWQURSSA-N 469.502 0.577 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)[nH]n1 1818113215 FTFGSKXBFHGDLX-NDYZHDMBSA-N 454.491 0.672 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnc2c(c1)CCNCC2 1821700772 KJFFDHIRBFSNQH-JOCHJYFZSA-N 488.357 0.792 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)C(=O)C(=O)O 1823009351 NWQYHJHQLVZHOV-LHLIQPBNSA-N 451.274 0.289 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3nc4ccc(F)cn4n3)sc2C1 1824393618 SPBIWDSKSMMVDA-LLVKDONJSA-N 495.500 0.863 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3c(c1)n(C)c(=O)n3C)CC2 1826086003 JZFHSXQFGRJAOY-AWEZNQCLSA-N 499.597 0.932 50 20 JCGD NC[C@H](N)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CCBr)C2)C1 1829046994 ITUUFWALDGMODS-LAUBAEHRSA-N 496.406 0.510 50 20 JCGD N#Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1829630799 BFYGPRYGEVAACV-VWLOTQADSA-N 492.536 0.260 50 20 JCGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1 1830376022 ZPFYEMKWEHWNCO-JSGCOSHPSA-N 470.303 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cc3ccccc3n1C)CCO2 1830435320 XUEPJVUPHTWRHK-RUZDIDTESA-N 485.585 0.550 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc12 1830722594 FINXQKBUMQGUBS-VGOFRKELSA-N 494.932 0.181 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(-n2nccn2)c1 1830732100 RLNGLIPCABFRKO-GHTZIAJQSA-N 463.922 0.245 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCC(C)CC3)CCO2)C1 1831105553 HNBYKSAEBBPRGU-BMBTXRBNSA-N 488.589 0.309 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCCO3)CC2)CC1 1833112991 YOLBVFBZKCZZLR-FQEVSTJZSA-N 458.563 0.439 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cnoc1C1CC1 1834345479 BQZXKFHHHWUXBB-UHFFFAOYSA-N 466.347 0.731 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)CC1)c1ccc(B(O)O)cc1 1834797503 QBWJZJQAGOVFSE-XMMPIXPASA-N 493.369 0.392 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc4c3OCC4)CC2)CC1)c1cccc(B(O)O)c1 1834800099 QBDFYLDOXLTFAT-UHFFFAOYSA-N 477.370 0.800 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CC[C@@H]3CCOC3)CC2)CC1)c1ccc(B(O)O)cc1 1834800694 ZMJFVWDZRSQTAW-GOSISDBHSA-N 457.380 0.368 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834824238 ZKYQLJKGRAXANR-IBGZPJMESA-N 454.321 0.641 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CC3(O)CCC3)CC2)CC1 1835737392 NWLFRVUOXMMNCZ-UHFFFAOYSA-N 458.563 0.175 50 20 JCGD O=C(c1ccoc1I)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836261998 AYSOHBOQASMHPU-BLLLJJGKSA-N 498.701 0.554 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1csc3c1CCCO3)CCO2 1836387654 SFRGXGYRNOXJQA-HSZRJFAPSA-N 486.355 0.137 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837319927 NNLPRGFBTCZQDN-NHYWBVRUSA-N 475.258 0.722 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1837715579 YLWPWPOZWIDBKL-INIZCTEOSA-N 456.490 0.400 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CCO2 1839388240 LLCLKNJJWBUSES-JCGVRSQUSA-N 480.356 0.069 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1839642488 QYHTWQCDSHEUID-MWTRTKDXSA-N 492.529 0.930 50 20 JCGD O=C(Cn1nccn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802479 XXKQKANIRPWHNM-NQIIRXRSSA-N 492.374 0.741 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CN)c3ccccc3)C2)C1 1840031928 GXTKGWVIBJGFMX-XAUMDUMWSA-N 454.365 0.969 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1 1840184948 HYUYUCOWZYRKBW-RDPSFJRHSA-N 474.558 0.210 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1847014715 QJEWHEMYIKHXCJ-LJQANCHMSA-N 461.538 0.449 50 20 JCGD O=C(NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)C1CCN(c2ncccn2)CC1 728889846 RPHPBHNBHYIXIA-QZTJIDSGSA-N 472.546 0.822 50 20 JCGD CCOc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc(Br)c1O 730570284 FCPQJUMTLHCAME-UHFFFAOYSA-N 472.321 0.588 50 20 JCGD COc1cc(N2C[C@@H](C(=O)NNC(=O)COc3ccccc3O)CC2=O)cc(OC)c1OC 730781368 LCMJEWIMGPIIBC-ZDUSSCGKSA-N 459.455 0.997 50 20 JCGD O=C(NCCCN1C(=O)CNC1=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 731116576 BKHUAIGPBLHLER-UHFFFAOYSA-N 480.528 0.435 50 20 JCGD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)/C(C#N)=C/c1cc(C)n(CCOC)c1C 790088088 ADMJKQFRZHUZDZ-WAGPWIPHSA-N 450.561 0.810 50 20 JCGD O=C(COC(=O)C1CCN(c2ccc3nnnn3n2)CC1)NNC(=O)c1cccc(Cl)c1 904493799 DTWNMHNMIVVOBL-UHFFFAOYSA-N 458.866 0.394 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(S(=O)(=O)N(C)C)c[nH]1 915407473 HXEWCAVNGWTCET-UHFFFAOYSA-N 458.880 0.545 50 20 JCGD O=C(NCc1ccc(-n2cncn2)nc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916395971 QMZRGHICGPFFPU-UHFFFAOYSA-N 470.515 0.591 50 20 JCGD COc1cccc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 916740993 MLILUQOOIIBBMI-UHFFFAOYSA-N 477.539 0.875 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O 918781327 SKFNRPCTQAELDD-OAHLLOKOSA-N 488.522 0.892 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cc2S1(=O)=O 919541369 HOFOWDQKAZVUJS-UHFFFAOYSA-N 495.897 0.749 50 20 JCGD O=C(NCc1cccc(C(=O)NC[C@H]2CCCO2)c1)NNC(=O)c1ccc(-n2cnnn2)cc1 920347257 HDMFDPDJFBQMIU-LJQANCHMSA-N 464.486 0.715 50 20 JCGD CCCn1nc(C(=O)NNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2ccccc2c1=O 921235629 UGAMYAJVTBIKSX-UHFFFAOYSA-N 456.484 0.065 50 20 JCGD CN1CCN(CC(=O)N2CC[C@]3(C2)CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)CCO3)CC1 1778263908 NJAOTNJJSPILSZ-BLGDVBTISA-N 473.524 0.949 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779030780 IDJOCOXNXMHRTK-DEOSSOPVSA-N 467.526 0.770 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCCC3)C1 1779038501 BXOKBDBRHQSEER-AUSIDOKSSA-N 460.579 0.720 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(S(C)(=O)=O)cn1)CCO2 1779296671 YECWFHPTXRSZIJ-IBGZPJMESA-N 455.609 0.780 50 20 JCGD CC1=C(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)CCO1 1780968723 DQZNONAJBASTNF-XMMPIXPASA-N 471.558 0.857 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1781442996 VLEZTDBSMZGNFI-HSZRJFAPSA-N 467.287 0.302 50 20 JCGD CSCC[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1782230940 XTDSIVZLBAQCOY-NTXWZOLCSA-N 479.603 0.748 50 20 JCGD CC(C)N(CC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)C(=O)OC(C)(C)C 1783932818 GPWIGNMMRUNYJO-QHCPKHFHSA-N 483.610 0.835 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(-n3cnnc3)cc1)CCO2 1783933815 HOTXSPGBYXQWQR-QFIPXVFZSA-N 455.519 0.084 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccn(Cc4ccc(F)cc4)c3=O)C[C@@H]21)[C@@H](O)CCl 1784086815 ORCKCHRDFGWXSC-WNHJNPCNSA-N 492.935 0.624 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCO3)C[C@@H]21)[C@@H](O)CCl 1784092586 NFXQFJLXAVLOCE-UQVNRYHBSA-N 465.978 0.467 50 20 JCGD Cc1ccccc1OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1786588081 YVIADEYPJHDIRK-LRQRDZAKSA-N 467.526 0.666 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncncc4c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979722 NUXHGOZCTINMMH-XJABCFGWSA-N 460.299 0.217 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H]3CNc4ccccc4O3)[C@H]2C1 1788552098 RHSGGMFFYFZDRA-ZLFOXAAKSA-N 494.552 0.542 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(C(F)(F)F)ccn1 1788966508 VOGDREYPKJLCID-FNHZYXHNSA-N 477.248 0.687 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc(Cl)n1 1789045637 LJAKSBLDTBYVLC-ZLIFDBKOSA-N 488.932 0.649 50 20 JCGD COc1cccc2[nH]cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)c12 1790423144 HUXGRYUYMUHRIT-BPXKWBHBSA-N 477.326 0.763 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2 1792866816 KWJXPVGWSIBPNS-RMEBNNNOSA-N 478.384 0.493 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc[n+]([O-])c1 1794251458 VHNOJAJPSIIDJJ-CWPLJXCYSA-N 470.438 0.671 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(C)(C)C)NC(=O)NCc1ccccc1 1795565764 HJSQBJIAASUGSQ-HATOLVCRSA-N 474.606 0.310 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cc(Cl)ccc13)C2)c1ccc(B(O)O)cc1 1795734297 LUYUWCCUQPGANB-HBCWATKFSA-N 468.706 0.413 50 20 JCGD CN(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)c1ccc(Cl)cc1 1795736708 GNSDKEDEXBUALH-UDKICSLYSA-N 485.777 0.526 50 20 JCGD C[C@H]1Oc2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)cc2NC1=O 1796191973 XCOCQASSDXCYMF-CODKJTEISA-N 463.299 0.651 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1occc1Br 1796545508 FXEHOYVAMQNYHS-DRXBFXEBSA-N 457.325 0.618 50 20 JCGD COCCn1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)n1 1797065975 ZFPUVNQZACJXEV-GSWMANSFSA-N 455.519 0.915 50 20 JCGD COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c(F)c1 1797255487 HYIGBUZWPRNSRB-GPVSGQMNSA-N 464.538 0.730 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1ccccc1=O 1797932321 USJZIAVNRZPBOP-OFVMJGGRSA-N 468.514 0.133 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCNC(=O)c1ccc[nH]1)C2 1798440787 RZDQNAISAJMXLQ-QDMKHBRRSA-N 453.503 0.085 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1COc3ccccc3O1)C2 1798440797 SLXHDPNIWXQIHP-YYQBIWNASA-N 451.483 0.777 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)on1 1799094760 JEYKJGWHNXRWSY-RMFSNUHRSA-N 470.530 0.532 50 20 JCGD Cc1ncoc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095188 YRPONTGELDHNHX-OPVJXMOQSA-N 470.530 0.532 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccnc1)C2)NC(=O)NCc1ccccc1 1799095235 ZRNBYLDYIOOYHO-RUMRUAAYSA-N 480.569 0.560 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(OC(F)(F)F)cc1 1799494741 HLNJQQRXKCSQAE-HGKCTWBKSA-N 478.232 0.782 50 20 JCGD COc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)ccc(F)c1F 1799677242 RTJPQSXAOPTXPL-DBWKPXFBSA-N 454.474 0.550 50 20 JCGD COCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br 1800762912 KGEMEBLRHOVLQF-PNBKFKSVSA-N 451.358 0.429 50 20 JCGD CCOC(=O)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)Cc1ccco1 1801236783 RFFXJCIAWPCSJQ-FAQVEIGNSA-N 493.561 0.201 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc(F)ccc1[N+](=O)[O-])c1cccc(B(O)O)c1 1804313982 VTNQXTZJMOQKHA-REPLKXPHSA-N 455.251 0.908 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1 1807287133 VHPJZUIEMYWBQB-IFQKHITRSA-N 464.486 0.964 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nc(CO)[nH]c3c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373835 CKGWZCGOUZBJEF-CYFREDJKSA-N 499.336 0.763 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2cnn(C)c2)[C@@H]1c1cccnc1 1807432286 UZEFNTULXKXJCI-XXBNENTESA-N 455.563 0.827 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)o1 1810303320 QNJSAKWHKYFUHG-FOIQADDNSA-N 464.486 0.334 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCOC2)[C@H]1c1cccnc1 1810308104 JBIUHQHFJZPLBX-ZWOKBUDYSA-N 452.515 0.826 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CC2(O)CCC2)[C@@H]1c1cccnc1 1810309383 QMZIDXAVSSSYDO-OXJNMPFZSA-N 452.515 0.705 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1 1813070976 OWCKKYZBAXVBMC-VGOFRKELSA-N 464.530 0.817 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2C(=O)C=CC2=O)n[nH]1 1815476332 KDABTZZPJLXKBZ-HNNXBMFYSA-N 459.507 0.090 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2n[nH]cc2[N+](=O)[O-])n[nH]1 1819658060 XDWUZKACDZIUJO-ZDUSSCGKSA-N 468.434 0.659 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1824525149 TVIAKRTUOZUNGU-OXQOHEQNSA-N 464.393 0.280 50 20 JCGD O=C(CCBr)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1827396356 DZYRDIVYDRLDNR-CQSZACIVSA-N 466.340 0.831 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1828957423 NTJIFCPYTJYTEA-PMACEKPBSA-N 482.578 0.474 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1828957429 NTJIFCPYTJYTEA-WOJBJXKFSA-N 482.578 0.474 50 20 JCGD COCCn1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n1 1830538645 LTYIRQUWRQLTJT-HNAYVOBHSA-N 473.368 0.631 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1830698349 AFNXCBQWIFXUER-BIZBXSGISA-N 460.955 0.412 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726958 YBELDZUDKLGCLI-KXBFYZLASA-N 450.841 0.703 50 20 JCGD COC(=O)C12CCC(C(=O)N3CCOC[C@@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)(CC1)CC2 1830730473 AQNRXHNHCGKZFW-QGFHRSQPSA-N 472.966 0.556 50 20 JCGD CN1CCN(C2(C(=O)N3CCC([C@H]4CCCCN4C(=O)CCC(=O)NN(C)C)CC3)CC2)CC1 1831874694 UIWQBWTXQCEWRP-OAQYLSRUSA-N 476.666 0.759 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1C 1832094468 XHEAGMLMOBEMCJ-DEOSSOPVSA-N 476.574 0.376 50 20 JCGD C#CCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551180 HBKCGXLOHWXKQH-HRAATJIYSA-N 457.955 0.988 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(C)noc3C)CCO2)C1 1832555344 HUCVIWIVWKZGQD-AJPHYDNBSA-N 486.529 0.424 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833313492 HHYHQRXXFBUMJO-QZTJIDSGSA-N 491.029 0.433 50 20 JCGD CSCC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833505709 SSLLLKBCMQLJAM-UHFFFAOYSA-N 461.437 0.941 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1834329109 QGNXNOFJOSFKKI-ZDUSSCGKSA-N 481.395 0.595 50 20 JCGD Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)on1 1834797396 IHOCZKCRKQHUPN-UHFFFAOYSA-N 454.336 0.091 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnc(N)s3)CC2)CC1 1835736735 GEIFMGOKOWGVCJ-UHFFFAOYSA-N 472.575 0.223 50 20 JCGD CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1836395040 PBOUWARBUNEYKG-SFHVURJKSA-N 463.044 0.306 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457756 PSPNBKUSIQXHJI-DEOSSOPVSA-N 483.525 0.006 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461514 WYQTZLDBESOXNK-NSYGIPOTSA-N 492.536 0.696 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)[nH]1)CCO2 1837763292 CGOCXVNKXHABHV-FQEVSTJZSA-N 481.236 0.097 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1N(C)C 1839114176 IYIFGNGLMWTLEI-UWJYYQICSA-N 455.939 0.431 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1839209846 SXKKNJKPUFPATC-OPAMFIHVSA-N 492.013 0.984 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2 1839634695 VWEGRTRULZHLFH-WIYYLYMNSA-N 479.375 0.994 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1840034009 XQGWHGGQPFAIOL-UTXAPGEGSA-N 484.347 0.692 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840037390 ZDPJKXONMOGWTG-ASKKUZCQSA-N 473.364 0.982 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCOCCOCCOC)CCO2)C1 1840076344 GHLGOAGPILXERN-WIYYLYMNSA-N 464.987 0.920 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cc(Cl)ccn3)C2)C1 1840153687 XRYUULNHNXGNTE-HNAYVOBHSA-N 462.330 0.824 50 20 JCGD COc1ccc2oc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2c1 1840184418 LGOUDFKUPZEODW-XMMPIXPASA-N 488.541 0.884 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)C(F)(F)F)CCO2)C1 1840203695 OCCZKEHDURMNHV-XHDPSFHLSA-N 474.274 0.295 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCO1)C2 1846384960 DQMGQIYMKZUFET-QGZVFWFLSA-N 481.594 0.589 50 20 JCGD COc1cc(F)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(F)c1 726764245 CPLLXBNJKZXVDS-UHFFFAOYSA-N 491.494 0.618 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCc1cccc(O)c1 727239475 JEHPDQPXPGEINA-UHFFFAOYSA-N 476.555 0.919 50 20 JCGD CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O 729276610 ISKRHHYMZKUDIJ-GXFFZTMASA-N 495.421 0.386 50 20 JCGD CC(=O)N1CCN(C(=O)CCNC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1 730819993 ADIYYXJQPSMJMC-ZDUSSCGKSA-N 484.351 0.628 50 20 JCGD O=C(NNC(=O)[C@H]1Cc2ccccc2O1)c1cncc(C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1 748358969 YGTYNIDWDNSHFS-NHCUHLMSSA-N 487.472 0.611 50 20 JCGD O=C(COC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12)NNC(=O)c1cccs1 761598516 FPQHHGLRAFPGEJ-UHFFFAOYSA-N 466.522 0.978 50 20 JCGD C=CCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 834829413 AKJFLGWYRDMPCP-GOSISDBHSA-N 475.479 0.295 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)n1 904222360 IMIALGALIOHBQC-NSHDSACASA-N 479.446 0.785 50 20 JCGD Cc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1NS(C)(=O)=O 906487451 ZSIAIIXMCBQHKX-UHFFFAOYSA-N 460.921 0.742 50 20 JCGD C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1 915475326 IPAMXEVRXWMHBB-GFCCVEGCSA-N 469.903 0.617 50 20 JCGD C[C@H]1CCc2sc(C(=O)NNC(=O)N3CCN(S(=O)(=O)N4CCN(C)CC4)CC3)cc2C1 918779487 WZRKCKNILPHNNH-HNNXBMFYSA-N 484.648 0.337 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1 919822972 YAHXXSNQLKICJQ-UHFFFAOYSA-N 476.555 0.786 50 20 JCGD Cc1nn(C(F)F)c(C)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 920879309 ONXVKCPFHVQVCW-UHFFFAOYSA-N 471.486 0.920 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C#N)c1 1779037081 MUTQFOWTEKIUET-XMMPIXPASA-N 478.509 0.252 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cn1 1779859200 UHRDMCZDHRGQJL-HYBUGGRVSA-N 466.347 0.269 50 20 JCGD COCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559445 MWXZXMVWLGGWAF-HYBUGGRVSA-N 475.590 0.883 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780774760 LLURUCLGCSEKQR-KTSGXFQWSA-N 454.293 0.255 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(OC(F)F)cc3)C2)C1 1781698982 GETOISQRDUWRCX-QFIPXVFZSA-N 460.242 0.725 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1 1782197506 AFIDZMITCJSMRG-JOCHJYFZSA-N 453.503 0.251 50 20 JCGD COc1ccc(F)cc1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782299156 PZDFILGQLFZMAV-RCZVLFRGSA-N 484.333 0.884 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccc(O)nn3)C2)C1 1782632715 GTPKCUAZDQEZEA-NMWDDECMSA-N 469.502 0.079 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1 1783678658 UTFRGHGOUWLAJI-XMMPIXPASA-N 477.525 0.638 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1=CCCN(C(=O)OC(C)(C)C)C1)CCO2 1783933245 FQFUTZMDVCLBSF-XMMPIXPASA-N 493.605 0.757 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1783936343 GMWQHKOIMSQMTR-DPSWKAHMSA-N 469.542 0.099 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC(=O)N(C4CCCC4)C3)[C@H]2C1 1784968124 ICISPIATQNHHFY-LRGYGIHKSA-N 498.584 0.070 50 20 JCGD Cc1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)ccn1 1785121626 ZXQZFVMLGBPLAI-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)C1 1785477750 MRHDRLULFFRYGX-XMMPIXPASA-N 487.362 0.067 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)c(F)c1 1785738315 MQGIKQWLINVVLM-FNJBETSUSA-N 486.504 0.957 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](N)c3cccc(Cl)c3)[C@H]2C1 1786886524 XPSVBQQKCQNNCH-QUJKESNLSA-N 465.982 0.693 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](CN)c3ccccc3)[C@H]2C1 1786922325 QNLZWRPRINRYMR-BSEDRUNASA-N 480.569 0.843 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3Cl)C[C@@H]21)c1cccc(B(O)O)c1 1786983423 PLVMTELYRCIYNO-LRQRDZAKSA-N 474.725 0.995 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1nc(-c2ccccc2)ns1 1787144324 YEZJVDXZQYZPCY-IHPCNDPISA-N 492.366 0.792 50 20 JCGD O=C(NC1(c2ccc(NC(=O)c3cnncc3C(=O)O)cc2)CCC1)c1ccc(B(O)O)cc1 1789754716 GXYXMZSRHIZJMO-UHFFFAOYSA-N 460.255 0.916 50 20 JCGD Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1[N+](=O)[O-] 1789911420 UXYSFLJGUKPRCH-LRQRDZAKSA-N 496.524 0.738 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789925560 RFLYIALANZSFRB-IICXDKKESA-N 471.327 0.870 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)OCO4)C[C@@H]21 1791289015 BDVDEPUWDKAVKJ-ZWOKBUDYSA-N 460.531 0.311 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CN(C(=O)OC(C)(C)C)C3)[C@H]2C1 1792203391 IHOATBVKXVEAFX-FHWLQOOXSA-N 495.621 0.596 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3ccc([N+](=O)[O-])cc31)C2)[C@@H](O)CCl 1792974812 DSIPEMFLWCAABF-CSHUHZATSA-N 450.879 0.739 50 20 JCGD Cc1ccc(C)c(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1793812588 CXUIGFHUEUKNCB-BBIADKPPSA-N 452.316 0.265 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C(C)(C)C)c1Cl 1794432934 VKULOAUOZGWZEO-ZSBFGKGUSA-N 468.986 0.868 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796191035 QNQPOVODFHAMKS-RDGPPVDQSA-N 475.351 0.158 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1 1796192604 LFFFEUMMQCLHDA-BJWYYQGGSA-N 490.774 0.989 50 20 JCGD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)ncc1[N+](=O)[O-] 1797073023 PZEGSWMJYUSGDH-BTTYYORXSA-N 453.459 0.862 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)C1 1799198098 RMZQQNHVKUUSRT-ARSDKDGVSA-N 494.358 0.494 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1nc[nH]n1 1801299337 AUELUQIZAMPKSS-IVWMJMPLSA-N 490.498 0.634 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nn1C 1803292315 NUVVSSIGTBWWKW-MBSDFSHPSA-N 455.563 0.745 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807360643 TYZWBZNPDASCIC-MAUKXSAKSA-N 466.332 0.288 50 20 JCGD COc1cnc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(F)c1 1807361808 HUEGDDBNFXBZJT-VGSWGCGISA-N 478.289 0.938 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808416062 DBVLCHVJXGWRST-HVSXFEFRSA-N 467.530 0.746 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1 1808417634 OAYQYPXBHMGTLG-RKPMPJFSSA-N 464.486 0.964 50 20 JCGD COCCn1nccc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808635410 IMPSTKMDEAPUHO-UGKGYDQZSA-N 477.330 0.238 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810356051 HDSRIFXYSOUCCQ-NOHQGCKHSA-N 480.330 0.610 50 20 JCGD CCOC(=O)C1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)CC1 1817477183 OPUUXJJEWOKVJO-KRWDZBQOSA-N 454.292 0.739 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)[nH]n1)c1cccc(B(O)O)c1 1817477339 TXWBZOSFTFYYNF-JOCHJYFZSA-N 488.357 0.792 50 20 JCGD CN1CCC[C@@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)C1 1819798102 WBAOZWUQLLRLMD-OLZOCXBDSA-N 457.560 0.709 50 20 JCGD O=C(c1nc[nH]c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059146 GKNXHYDSPLPILE-QGZVFWFLSA-N 455.280 0.545 50 20 JCGD COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828860433 WUVDFCCZZPMYLS-DYESRHJHSA-N 453.923 0.685 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)n1ccnn1 1828924649 WMQIYDNVUHZBMU-BEFAXECRSA-N 454.535 0.771 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829705988 NNBZILGMPMQBFD-CRAIPNDOSA-N 464.426 0.523 50 20 JCGD Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1F 1830094604 PXVSHTOIYVHURZ-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)no1 1830364512 MPNMVDWVXKSCQW-HXUWFJFHSA-N 456.927 0.434 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1 1830534555 BMBXTGOUUUAOHX-UGSOOPFHSA-N 475.315 0.883 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830535472 OYQPDVURHTXFIM-DYVFJYSZSA-N 467.382 0.380 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)NCc1ccccc1 1830674926 FUATUUMXYSIMIQ-GXGIYUIGSA-N 453.898 0.850 50 20 JCGD O=C(c1ncsc1Br)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728557 UPKMZVSCTMOZKL-ZUZCIYMTSA-N 468.757 0.575 50 20 JCGD O=C(c1cc2cccnc2nc1O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830736074 RGDQPXMTOJBKHG-QRWLVFNGSA-N 450.879 0.005 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1830838713 TVLOEAGNLUIRRI-JOCHJYFZSA-N 498.363 0.862 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1830883222 CJLVXQZFHNNMNJ-PJIJBLCYSA-N 467.922 0.253 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1831645948 FIXDFHIYKIBLQI-APWZRJJASA-N 466.000 0.276 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831646220 IGAPERXHQWPGSK-SDHSVNELSA-N 467.954 0.984 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(Cl)c1 1832540210 ZSKCXDUFZHCWQB-HSZRJFAPSA-N 496.992 0.721 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CCN3C(=O)C=CC3=O)CC2)CC1 1833613272 CGRHDMVBFCNOHF-HNNXBMFYSA-N 483.407 0.904 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nc4ccccc4[nH]3)CC2)CC1)c1cccc(B(O)O)c1 1834799973 JYHUKZWUWJPGCH-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4ccc(F)cc34)CC2)CC1)c1cccc(B(O)O)c1 1834800058 OJLHPFNBKVSJEB-UHFFFAOYSA-N 493.348 0.881 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800282 CITYZTUPQUQFCP-IBGZPJMESA-N 493.417 0.557 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cc3nnc(C)o3)CC2)CC1 1834832184 WWGSUSFGTNGNQB-CVKSISIWSA-N 484.561 0.626 50 20 JCGD Cc1ccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1835166470 JNEIYDDMUUDXII-QHCPKHFHSA-N 462.547 0.203 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1 1835835791 HXONAAJUKMNWAO-URLQWDBASA-N 455.353 0.711 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835936756 BPPDSGBDIWULFO-VWLOTQADSA-N 490.325 0.002 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835940924 DROYGBPHXMRQSR-UUOWRZLLSA-N 452.316 0.240 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1837178249 ABQDGUYGNNMFGJ-UHFFFAOYSA-N 483.573 0.811 50 20 JCGD Cc1cccc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)[nH]c12 1837458979 GZBWBZFJFAPTNP-VWLOTQADSA-N 492.536 0.859 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n(C)n1 1837462198 GUDNHEQWNWFDHA-UHFFFAOYSA-N 454.336 0.334 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C(F)(F)F)ccn1)CCO2 1838083982 UFJGPMMFIRWTIQ-NRFANRHFSA-N 493.247 0.164 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1 1838605140 QMWQFRDSGINESY-IERDGZPVSA-N 479.921 0.766 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cc1)CCO2 1838958546 GYKYISLBVOWUEH-JOCHJYFZSA-N 458.707 0.404 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839152172 PUAISTNFLRXKDW-AEZZAFEZSA-N 488.372 0.813 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)nc2ccc(Cl)cn12 1839603548 PYJGSIPUIAUZRV-FOIQADDNSA-N 471.341 0.966 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C1)CC2 1839792489 JXKWBWWQVOPWLF-HFJQGTKSSA-N 466.962 0.856 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)C(=O)c3ccccc3)C2)C1 1840030685 SWQCJELTXSJNST-HRAATJIYSA-N 482.375 0.998 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1 1840033437 FGJPMNLBWORWCK-PMUMKWKESA-N 456.341 0.517 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4cc(C)ccn34)C2)C1 1840155042 NSXVWBDACKAWDN-KKSFZXQISA-N 450.923 0.967 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)n(C(F)F)n1 1840185226 HJPUWAKMJDBMLY-HXUWFJFHSA-N 472.493 0.030 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COCc3ccc(OC)cc3)CCO2)C1 1840254836 KTENRMYAOVDCJC-UGKGYDQZSA-N 470.950 0.922 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2nc3c(Br)cc(F)cn3n2)C1 1845725751 NNUVNJMGAFWFTL-UHFFFAOYSA-N 496.341 0.821 50 20 JCGD O=C1c2ccccc2C(=O)N1CCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1848087584 CTAVJDIFWPOKJC-SFTDATJTSA-N 475.310 0.258 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 15884629 WJSXLLUTVBXXHW-UHFFFAOYSA-N 477.539 0.875 50 20 JCGD CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1 28642925 QETMHXWLUYGPAB-UHFFFAOYSA-N 453.546 0.579 50 20 JCGD COc1cc(I)c(Cl)cc1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O 729274900 HBWTZMVKRQPETE-LURJTMIESA-N 475.692 0.652 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1)C(=O)N1CCCC1 748246164 GYRNKGOEYGAXKA-UHFFFAOYSA-N 476.477 0.876 50 20 JCGD COc1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)CNC(=O)c2ccco2)cc1 751201919 MZELIBFQZSEZKE-UHFFFAOYSA-N 452.489 0.266 50 20 JCGD COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 811263085 DJTYWIZLUWKMAZ-UHFFFAOYSA-N 498.583 0.001 50 20 JCGD CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1 819931669 QXNLCRBARAJFJU-JZXOWHBKSA-N 479.603 0.931 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@H](NC(C)=O)C(C)C)N(S(C)(=O)=O)CC2 913161452 MVUWVEAPUBZAET-OXQOHEQNSA-N 484.575 0.261 50 20 JCGD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3ccc(OC)c(OC)c3)cc2)[nH]1 914688476 DSBBOIXNVMYNFW-UHFFFAOYSA-N 454.439 0.973 50 20 JCGD Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 914846145 BFHPMLRFXLBCSQ-UHFFFAOYSA-N 472.527 0.521 50 20 JCGD CC(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1CCN(C)CC1 916258161 LUKFOONDHNGZGH-HXUWFJFHSA-N 480.635 0.687 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@@]2(N3CCOCC3)CCSC2)nc1 916637021 SFYGUMDQPAYANQ-SFHVURJKSA-N 458.610 0.602 50 20 JCGD O=C(NC1CC1)C(=O)N1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1 918779336 NEJHPNMNWJWIKX-UHFFFAOYSA-N 455.471 0.636 50 20 JCGD CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 920384732 OYNGSJDTEASYAJ-HNNXBMFYSA-N 454.530 0.968 50 20 JCGD Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)Cn3c(=O)c4c(ncn4C)n(C)c3=O)cc2)cc1 929086135 QUAFJAUWICNXOR-UHFFFAOYSA-N 482.522 0.718 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1 1779037078 MPZJDIISJQKZJF-NRFANRHFSA-N 475.889 0.507 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1779359659 ZOKBKHSYBBHCIX-KBMIEXCESA-N 487.601 0.903 50 20 JCGD COc1cc(C#N)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1780173645 AWCHDLNKUJYDLI-QHCPKHFHSA-N 464.482 0.323 50 20 JCGD CNCCCC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968644 CVDQNCVMPVEVME-QHCPKHFHSA-N 460.579 0.162 50 20 JCGD CC[C@H](NC)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970036 QKWKNNGOBDILKT-WMZHIEFXSA-N 460.579 0.161 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781333226 FFNFSRGNHDOJOQ-GUYCJALGSA-N 475.340 0.412 50 20 JCGD COc1cc(F)c(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(F)c1 1781707397 WFVXRJNZWDAKDY-QFIPXVFZSA-N 460.242 0.411 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)Cc1ccccc1)C2 1782214460 RBRRBQKAYYMPSM-DCLXLUIPSA-N 460.575 0.477 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1783536585 HCYBHKULUVUEAN-KPZWWZAWSA-N 471.377 0.505 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1785133656 MQQAGSFBJKVBNL-JOCHJYFZSA-N 458.707 0.786 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1785321147 PGQBGIXWRRZZLV-NJSLBKSFSA-N 466.000 0.672 50 20 JCGD NC[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)c1ccccc1 1786924091 YVHXONYBHWBULH-GIUOSPMZSA-N 466.542 0.021 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1 1787450139 MHLOYGUHYITSFY-YGJAXBLXSA-N 479.933 0.957 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(=O)c3cccs3)[C@H]2C1 1787513587 LADZNZXFQNUTBG-CGKUUYIJSA-N 462.572 0.840 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(S(C)(=O)=O)CC3)[C@H]2C1 1788110959 CEKXNLVPPMCFIU-QAETUUGQSA-N 450.001 0.655 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1789853496 MXLDEQYDYMPCKD-VGWMRTNUSA-N 463.959 0.107 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)c3ccccn3)[C@H]2C1 1790587815 OLOHLPHXLVWVRS-FDPKGLCPSA-N 452.939 0.433 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2 1792886539 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O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnn2c1OCCC2 1812117833 QOUMIEZPHJZZIN-GHTZIAJQSA-N 475.314 0.374 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnn2cccnc12 1819019238 TZGLNMGAQLBMQB-GOSISDBHSA-N 459.275 0.752 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1819355075 IWGABOPRNHUQQG-DZGCQCFKSA-N 450.544 0.482 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CC2 1819800515 PNZJVRUHBPOERA-MSIPSHCFSA-N 456.528 0.935 50 20 JCGD COC(=O)C12CC(C(=O)N[C@H]3CCc4nc(NC(=O)CCC(=O)NN(C)C)sc4C3)(C1)C2 1826089388 BLQYSFFQCONSQU-UWVKGYLDSA-N 463.560 0.771 50 20 JCGD O=C1CC[C@H](C(=O)N2CCN(C(=O)OCc3ccccc3)[C@]3(CCN(C(=O)[C@H](O)CCl)C3)C2)N1 1828915043 ILUDUEGNZVODLN-PNCHPQGNSA-N 492.960 0.317 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830737342 DMODHSBUHVDZRA-FXAWDEMLSA-N 474.341 0.968 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CS(C)(=O)=O)CCO2 1831452214 NAYOCNFJBCKZHB-KEYYUXOJSA-N 469.398 0.155 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n1 1832770418 YKJONSOUHIRORL-FUHWJXTLSA-N 460.300 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCCc3ccncc3)CCO2)C1 1833057443 DTILSMZPSCODRR-XMMPIXPASA-N 482.541 0.173 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@H]3C[C@@H]3C3CC3)CC2)CC1 1833249656 WQVCPKUOOCLFHO-UXHICEINSA-N 454.575 0.916 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@@H]1COc2ccccc2O1 1833715366 DWWDFDMWKPIBNQ-DEOSSOPVSA-N 493.369 0.392 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)Cc3ccccc3)CC2)CC1)c1ccc(B(O)O)cc1 1834798891 HBAWSBHLZUZPPY-DEOSSOPVSA-N 479.386 0.155 50 20 JCGD Cc1nccn1CCCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801541 VQIGUXHZHGZSNF-UHFFFAOYSA-N 481.406 0.537 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1n[nH]c2ccccc12 1835559973 JFGVJXRSLOIHCL-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Nc1cccnc1)CCO2 1835686503 DGZLCIJBOOLIHB-IQQKDHQBSA-N 497.556 0.472 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1sc(N)nc1C)CCO2 1835803495 KNGXAZBWDBHUBT-NFCNUSAFSA-N 489.558 0.238 50 20 JCGD CCCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939137 GJEDZQPKGZDNKD-VWLOTQADSA-N 466.343 0.703 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1 1835939620 VUXMZUOEAPJNDI-HSZRJFAPSA-N 498.732 0.280 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1 1837760190 XZWSJEFHAHWHON-VBKZILBWSA-N 456.927 0.249 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838114978 WFRIQQZWMIOAHX-QFIPXVFZSA-N 497.980 0.577 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CCc3cnccn3)CC2)CC1 1838395453 RWZZMXBKYNXGQN-UHFFFAOYSA-N 481.557 0.720 50 20 JCGD C/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054387 WPYPLAGASZDUCD-WVKANMAXSA-N 459.547 0.365 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1839210463 PZSDOIKFGOVYKY-VWKPWSFCSA-N 477.986 0.736 50 20 JCGD COCCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839743459 RYJOHMCJJMLKIM-SCVJVIIRSA-N 479.480 0.991 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCNC(=O)C3)C2)C1 1839743905 DFHKMTWEQSDKNS-OVOCXKRTSA-N 488.491 0.854 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)Oc1ccccc1 1839748112 XDDRESKTHOGDKE-AVRWGWEMSA-N 497.552 0.613 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839935749 GUDMAPDJXZUXHB-XMMPIXPASA-N 460.575 0.675 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1840076082 QQLBKFLBUZOHRZ-FXAWDEMLSA-N 495.411 0.544 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(NC(C)=O)c3)C2)C1 1840156952 YQLLUCXEIFFSOH-RXVVDRJESA-N 453.923 0.969 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1 1841924635 KIMROGUOPVGVGJ-HOTGVXAUSA-N 489.953 0.817 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1 1842060941 XRZCIDMDPMALBE-HZPDHXFCSA-N 467.954 0.978 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)COCCNC(=O)OC(C)(C)C)C2 1843416657 KFLYSQFYKKBXQO-WGOQTCKBSA-N 490.561 0.865 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cn3ccc(Br)cc3n2)C1 1843989831 MJGWFENZSAHKTN-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])cc3c1OCC3)C2 1844264715 ZVCRNJDBRDQCJN-UHFFFAOYSA-N 466.454 0.659 50 20 JCGD O=C(CSCc1nc2sc3c(c2c(=O)[nH]1)CCC3)NNC(=O)[C@@H]1CCS(=O)(=O)C1 9930740 GHKIMBFICDYLJV-SECBINFHSA-N 456.571 0.289 50 20 JCGD CN(C)CCCNC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O 18139012 PUQKGIWMNDRRCK-UHFFFAOYSA-N 465.601 0.931 50 20 JCGD CCOc1ncccc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 22236486 MCRYZZIELZQTCV-UHFFFAOYSA-N 462.528 0.895 50 20 JCGD CC(=O)N1CCc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)ccc21 28028381 MRSXZKNGZGSLBK-UHFFFAOYSA-N 472.523 0.691 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN2CCC[C@H]2C(=O)N(C)C)nc1 726277028 GUNJCHXMASNYLP-KRWDZBQOSA-N 469.612 0.681 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CCc2c(C)nc3c(C#N)cnn3c2C)n1 728721758 GPHZTKMPSTXFLG-UHFFFAOYSA-N 455.500 0.849 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1 729275851 SESXBDTZJBBIIS-ZDUSSCGKSA-N 460.578 0.339 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=S)Nc2ccc(OC)nc2)c1 729692365 RYVJOVXOZQFTQS-UHFFFAOYSA-N 494.599 0.868 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C1CCOCC1)c(=O)n2Cc1ccccc1 751300145 RPQJKTCCILENGS-UHFFFAOYSA-N 454.487 0.002 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCc1ccc(S(N)(=O)=O)cc1 806967186 YAKNDOIXNWIKDO-UHFFFAOYSA-N 468.561 0.122 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)cc1OC 914602326 YVPJQMFBJUQZCO-UHFFFAOYSA-N 492.510 0.891 50 20 JCGD COc1ccnc(NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Br)n1 914762722 FLQODBWTFUORQO-CYBMUJFWSA-N 486.348 0.924 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1 915076984 ATXCYGBRVXODJH-KRWDZBQOSA-N 485.609 0.951 50 20 JCGD CCOc1ccccc1C(=O)NCC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 915789116 MPGPTTIWONCZLM-UHFFFAOYSA-N 454.892 0.577 50 20 JCGD Cc1ccc(-c2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCNC(=O)C4)c3)n[nH]2)cc1 917178829 UDWQIFQULVBACZ-UHFFFAOYSA-N 482.522 0.580 50 20 JCGD COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Cl)nc1 917251161 SUCIHWJWLMUDJH-CQSZACIVSA-N 468.919 0.738 50 20 JCGD CCCC(=O)NCC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 917393290 JGYJRRSYXSMFJP-OAHLLOKOSA-N 470.548 0.016 50 20 JCGD CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OC)c([C@@]2(C)NC(=O)NC2=O)c1 917720562 JOMLKPZLELYNFP-OAQYLSRUSA-N 492.510 0.537 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)COc3ccc(C)c(C)c3)cc2S1(=O)=O 917908129 AOEGKILCTPBYKI-UHFFFAOYSA-N 461.496 0.934 50 20 JCGD CN(CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)c1ncnc2[nH]cnc12 918008969 XLQNCCHUNQGVAZ-UHFFFAOYSA-N 483.496 0.952 50 20 JCGD O=C(NCCS(=O)(=O)c1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 918229802 RVKGUYLIRKWIRS-UHFFFAOYSA-N 496.567 0.125 50 20 JCGD O=C(NNC(=O)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1)c1ccc(-n2cnnn2)cc1 918779103 AOYBYZWFEAJPGG-UHFFFAOYSA-N 473.497 0.885 50 20 JCGD COc1cc(C(=O)NNS(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)cc(OC)c1OC 1317789194 ORIBPNGFSSAJPX-UHFFFAOYSA-N 452.489 0.900 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)CC2)CC1 1778321096 JYDHGZSLGDAHCD-NZQKXSOJSA-N 485.025 0.139 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1 1779031459 AFBIIANYEJVNMI-AOAINSGISA-N 476.493 0.164 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1 1779032578 NQKNACWCVBNTSX-QHCPKHFHSA-N 456.547 0.147 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2 1779374642 VPOHODPDVRHZKM-AUSIDOKSSA-N 498.496 0.740 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2)n1ccccc1=O 1779531189 MUPBOTUHAZHWJY-PMAPCBKXSA-N 461.563 0.296 50 20 JCGD CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)[nH]2)C1)NC(=O)NCc1ccccc1 1779783602 VWNODDZHKHGCFK-NTKDMRAZSA-N 499.572 0.589 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnnc3O)C2)C1 1779914443 GUCOGTNOKZDSND-VBKZILBWSA-N 469.926 0.758 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1 1780184267 VCIBTGZRCWFSRI-RUZDIDTESA-N 487.520 0.899 50 20 JCGD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c(O)c1 1780323703 XBRMCBSGHFQXQM-AUSIDOKSSA-N 462.547 0.901 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780939805 JNVMJFGDUYRJAO-XIKOKIGWSA-N 471.377 0.505 50 20 JCGD Cc1n[nH]cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969100 VFKRWFSBGWULSJ-HSZRJFAPSA-N 469.546 0.508 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969280 VODGZQMUMFKHGV-NTKDMRAZSA-N 498.588 0.090 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2)C1 1781356173 XMDHSRZYYKLEAA-AVYPCKFXSA-N 463.959 0.346 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1O 1781978312 JTFQKSCIWNWHLC-QHCPKHFHSA-N 454.288 0.228 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1 1781998144 UPLYNCQGWDDJAT-CTWCOEIASA-N 450.330 0.348 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(-c3ccccn3)[nH]n1)C2 1782212085 HETBWYXZFCVOKF-HYBUGGRVSA-N 483.573 0.972 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1783343716 PDWAAJONHYNAPR-HNAYVOBHSA-N 453.337 0.815 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O)CCO2 1783347745 OISGIARSHMYSPY-UWCDFFNFSA-N 461.382 0.792 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C[C@H](NC(=O)OC(C)(C)C)C1CC1)CCO2 1783933214 RWFCLFJHYQDVAW-MHECFPHRSA-N 495.621 0.883 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)C1CC1 1784084584 YKKUOVIYBWQNPO-LLLHUVSDSA-N 459.971 0.965 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c2cc(O)ccc2n1 1786979660 IEPBMIMIJGFNEC-OWSXEPHWSA-N 489.337 0.836 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1791112497 KFWNUTAMFZUSFS-UHFFFAOYSA-N 490.281 0.884 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cc(C)cn3)[C@H]2C1 1791595453 RCQGNBVTWNMAJE-MVOWZPSLSA-N 469.546 0.866 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CN(C(=O)c2ccccc2OC)C1 1792815258 SHDDWVABABYNQH-WQDJSCAQSA-N 479.961 0.611 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795739760 KEXMHVGWDNPBEE-XEMDLRDOSA-N 474.363 0.328 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1795894685 BYKUTVGUMWVESJ-IWTMDLJTSA-N 494.358 0.637 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccn3)CC1)C2 1797753223 ZPEHMZRBGLSUNS-OPMZPASUSA-N 493.568 0.200 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C/N=C/c1ccco1)NC(=O)NCc1ccccc1 1797840111 ZVJOIVPKSZUDEN-ZCQJHIOPSA-N 496.568 0.634 50 20 JCGD COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c([N+](=O)[O-])c1 1800236733 JUCAJBYUMZGHKM-REPLKXPHSA-N 467.287 0.778 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1 1804817931 YVUPBHVUCOJWBW-IIBYNOLFSA-N 467.530 0.268 50 20 JCGD Cn1c(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cccc1=O 1805312106 QOUWYXAOPKBHOX-HRAATJIYSA-N 475.509 0.412 50 20 JCGD CC(C)NCCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1807324139 UVQFCAICUNTCDS-UTKZUKDTSA-N 453.547 0.788 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)c2ccccc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362730 HWFGPKCYVHSWCC-WWNPGLIZSA-N 459.311 0.815 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)COc2cccnc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363407 OPLDALPLJROTLP-AUSIDOKSSA-N 460.299 0.555 50 20 JCGD Cn1c(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cccc1=O 1807369169 BZHZCSCXMQPHCP-AVRDEDQJSA-N 460.299 0.094 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CCc3nc[nH]c3C2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374527 LAHXQXWKAIQPBQ-WCAVRKLYSA-N 473.342 0.609 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C#CC(=O)O)[C@H]1c1cccnc1 1808416343 NKMAWJQHJYWEPS-LFUFGAAPSA-N 450.455 0.309 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)COCCO)[C@@H]1c1cccnc1 1808611860 BFCHKEBGHSIIOK-QGJUGNDFSA-N 456.503 0.230 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@H]1CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]1c1cccnc1)CCC2 1812224509 HXHOIUSXBSUDHO-XMSQKQJNSA-N 473.342 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCn2ccnn2)[C@H]1c1cccnc1 1813432707 JPWFEQOHNURCPN-OXJNMPFZSA-N 463.502 0.082 50 20 JCGD Cc1cnn([C@H](C)C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1 1815347865 UFHZHCNCBYETNU-CJNGLKHVSA-N 453.333 0.815 50 20 JCGD O=C(/C=C/C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)NCc1ccco1 1817472157 LQHIJYCRPFNKBZ-CTDFXDFQSA-N 491.313 0.861 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nccc2nc[nH]c12 1817928964 QRBHDSHJRDHONC-QGZVFWFLSA-N 459.275 0.981 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1 1818112750 JXPLYTGWGGWZCV-QHBIDGPYSA-N 453.463 0.412 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ccccn3n1)CC2 1819797116 LPISKOUEJIIBFT-LLVKDONJSA-N 477.510 0.724 50 20 JCGD Cc1cnn(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c1 1819797419 VIXITJYEQTWRTO-LBPRGKRZSA-N 454.516 0.573 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)/C=N/O[C@@H]3CCCCO3)sc2C1 1819905344 ZPWDHZRFOXGTPT-QSBQKVFRSA-N 487.542 0.896 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2)n1cccn1 1826858325 CXNJVBSWFOMJJM-NEPJUHHUSA-N 454.516 0.825 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829074159 YWUCDNOYVFGVDC-UTKZUKDTSA-N 457.380 0.905 50 20 JCGD O=C(Cn1nccn1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829232086 LAMSOGQWMHUDFY-GCJKJVERSA-N 490.948 0.330 50 20 JCGD O=C([C@H](O)CCl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)CCN2C(=O)OCc1ccccc1 1829427991 HXWBAZAKILMFDM-UEHPKLIBSA-N 491.972 0.931 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3OC)CCO2)C1 1830232060 RZMICJLUJSBUQD-IERDGZPVSA-N 456.923 0.784 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1830454814 HGJZXKOZQLYKST-HOYKHHGWSA-N 476.574 0.628 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc12 1830722592 FINXQKBUMQGUBS-HTAPYJJXSA-N 494.932 0.181 50 20 JCGD CC#C[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)c1ccc(O)cc1 1830738330 NPBWHBYCTXKLSZ-KKLQWCBXSA-N 464.946 0.945 50 20 JCGD CN1CCN(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1 1831871929 ZIKPPSLOEFRTIP-OAQYLSRUSA-N 464.655 0.617 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1833272060 SRIOLOLJYZWDOQ-SJORKVTESA-N 477.002 0.043 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)nc1 1833597913 BJGZMLRVWBZEMD-SFHVURJKSA-N 490.376 0.340 50 20 JCGD Cc1scc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1C 1834536219 NDDXFRHZQIPDMC-JOCHJYFZSA-N 458.345 0.429 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1834821225 CENMYWUQUCOEOD-HXUWFJFHSA-N 481.347 0.910 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1 1835117104 LIXDXMQWIHDQCW-KRWDZBQOSA-N 452.980 0.518 50 20 JCGD Cc1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835225439 BIWKBSDNYXZZQV-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835589244 OPPWXXUCIVVZGE-NRVIRDBHSA-N 491.029 0.948 50 20 JCGD Cc1ccc(NCCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(C)c1 1835938561 YOUKJDFHZLBETO-AREMUKBSSA-N 495.385 0.555 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc(C)c1C(=O)O 1835939535 RPVCXYHWPURPLT-VWLOTQADSA-N 496.325 0.065 50 20 JCGD O=C(Cn1ccnn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1836212267 DJAUDKBAISZTSH-GHTZIAJQSA-N 492.374 0.741 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1 1836971643 BPLNNUPNTYLSAO-OALUTQOASA-N 461.346 0.972 50 20 JCGD Cc1cccn2ncc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c12 1837460132 WDIQTKOIRPGYJY-DEOSSOPVSA-N 493.524 0.025 50 20 JCGD Cc1cc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)ccc2[nH]1 1837460249 YJDFQECNTIKVME-VWLOTQADSA-N 492.536 0.859 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)C2)C1 1837460355 CNJLDTBEKTUNDV-RNHFSVANSA-N 479.537 0.559 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ncccn3)CC2)CC1 1837502162 DGYBVNPOZLRWTF-UHFFFAOYSA-N 453.503 0.401 50 20 JCGD O=C(c1nnc(-c2ccccc2)o1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837534394 LWFCVBZTYDWOCU-YWZLYKJASA-N 450.879 0.406 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1 1837760189 XZWSJEFHAHWHON-JLTOFOAXSA-N 456.927 0.249 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919217 QZHSERJBHCGIAX-QGZVFWFLSA-N 481.362 0.269 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)CN)CC2)CC1 1838073604 ALIIVAZBDXWGBJ-IBGZPJMESA-N 477.518 0.418 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839149855 UMNIRWKTTYOKEM-VHKYSDTDSA-N 498.404 0.565 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(=O)[nH]c1C 1839197800 ISZAPTFBZKCGOZ-CXAGYDPISA-N 461.288 0.147 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nn1 1839201888 MORLPDRCIRNVMX-GUYCJALGSA-N 462.320 0.794 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)ccc1Cl)CCO2 1839327550 QCRCLVVDIJRJTN-NRFANRHFSA-N 470.929 0.922 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)n4ccnc4n3)CCO2)C1 1839549768 JPXULRVWEOPGRB-QRWLVFNGSA-N 451.911 0.362 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1839964680 YTSYNBJQVRBQCV-UGSOOPFHSA-N 467.324 0.368 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1840033765 PPRIYTPPDOBBGZ-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COCc3ccc(OC)cc3)C2)C1 1840156217 OVMRUZKGDCURMN-UGKGYDQZSA-N 470.950 0.922 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1841924592 DSZSQMTUFJSTSP-HNNXBMFYSA-N 480.953 0.634 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(Br)cn2)C1 1844424600 JCOWRDDYXIIPKU-UHFFFAOYSA-N 459.304 0.973 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc(Cl)c1 1845018100 FOSQLWPAEHILSR-HXUWFJFHSA-N 469.734 0.714 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)c1cc(=O)n3[nH]nnc3n1)C2 1845870950 WRBLCLJWELTROB-AWNIVKPZSA-N 466.408 0.515 50 20 JCGD CC(=NNC(=O)[C@H](C)NS(C)(=O)=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1 728435783 ACNPKHKMUGBNME-BBRMVZONSA-N 474.561 0.092 50 20 JCGD O=C(NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)c1ccc(-n2cnnn2)cc1 729838618 ZHRHPHGUNUNOHI-UHFFFAOYSA-N 463.426 0.456 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 750216157 RCGDJIWDKOQQDW-KSSFIOAISA-N 477.495 0.192 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cccs1 771192324 RRSYAYQXVZMGEW-JSGCOSHPSA-N 487.943 0.530 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc2c(c1)CCC(=O)N2 783457701 OQJXXPICBVOXGY-UHFFFAOYSA-N 486.550 0.986 50 20 JCGD COC(=O)c1cc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1OC 915891436 PKYALJPIULRYDT-UHFFFAOYSA-N 478.527 0.941 50 20 JCGD COc1ccccc1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915903942 IHEPXYVCXGTRJK-UHFFFAOYSA-N 462.528 0.903 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)c1 916645475 XVDHRFYSFDBLIZ-UHFFFAOYSA-N 454.530 0.154 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)[nH]n1)C2 1778092758 PWFYKUZKDCLTHI-GULKHOJOSA-N 455.519 0.980 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1 1778541611 SPDASWZCYDIFNX-QFIPXVFZSA-N 467.461 0.229 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1N(C)C 1779032422 JRWMJFKVYMAWQH-DEOSSOPVSA-N 482.541 0.517 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1NC(C)=O 1779032815 WFQCBQXSGWKQRL-XMMPIXPASA-N 496.524 0.409 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1 1779034093 MGUOWXVTQVVGOB-HSZRJFAPSA-N 452.515 0.547 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CCN(C)C(C)=O)CCO2)C1 1780095516 QKGYEZYMWKBTSU-QFIPXVFZSA-N 476.486 0.832 50 20 JCGD Cc1n[nH]cc1C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1780282145 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O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(-c4cccc(F)c4)n3)C[C@@H]21)[C@@H](O)CCl 1784087167 ZWBBAMZGYIEWRI-STECZYCISA-N 451.886 0.599 50 20 JCGD COc1ccc2c(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)c[nH]c2c1 1784148651 BUYRPTNGSIBFSI-OWSXEPHWSA-N 491.353 0.692 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1785488925 RBKAPCVWCGRGEW-XMMPIXPASA-N 462.315 0.319 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786978739 PBQZHZKKEBPWGD-UHMOLFJZSA-N 489.378 0.121 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1OC 1786984911 XVOFDKOKUXKCRF-JLMWRMLUSA-N 468.315 0.291 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)n(C)c(=O)n4C)[C@H]2C1 1787962547 WUNSVEPSOGWXSU-FPXQBCRKSA-N 464.950 0.724 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)CC1 1789868672 ZYIRNJVJUCUJNE-OGNFBWPZSA-N 463.406 0.367 50 20 JCGD 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456.279 0.198 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1OC 1839398206 COUQQJZVYRFQCG-KKSFZXQISA-N 456.923 0.682 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1839642490 QYHTWQCDSHEUID-WAIKUNEKSA-N 492.529 0.930 50 20 JCGD COC(=O)C12CC(C(=O)N3CCO[C@]4(COCCN(C(=O)CO[Si](C)(C)C)C4)C3)(C1)C2 1840005610 KYQFJADUUQFCNS-CBNMVNINSA-N 454.596 0.638 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc4ncccc34)C2)C1 1840182256 AXWSYXLTJGZAMI-RUZDIDTESA-N 483.569 0.607 50 20 JCGD CN(C)c1cccc(OCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)c1 1848083688 JOGYNSDSUHDNNE-PMACEKPBSA-N 452.515 0.646 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)c2ccccc2c1=O 23158413 UFBJGKYJZWAFQU-RUZDIDTESA-N 488.504 0.961 50 20 JCGD Cc1cccc(OCC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1 725909061 AIQUABBGKHFTAG-SFHVURJKSA-N 483.568 0.303 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2C[C@@H](O)CN2C(=O)c2ccc(F)cc2)cc1OC 725956416 UGFDCVGDJSJUMM-IAGOWNOFSA-N 489.456 0.423 50 20 JCGD O=C(C[C@H]1CCS(=O)(=O)C1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 842479266 ATCRMKGQOQLDFD-MRXNPFEDSA-N 454.512 0.974 50 20 JCGD C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1 914459268 QLJUAJJOWVIHLS-CYBMUJFWSA-N 464.475 0.175 50 20 JCGD Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc(C3CC3)nc21 915197319 QJUYCPVEPIVLJV-UHFFFAOYSA-N 457.468 0.390 50 20 JCGD C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C2=O 915789060 BUQUMVYOFWYAJD-BIBXISHDSA-N 499.977 0.885 50 20 JCGD O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)N[C@@H]1CCS(=O)(=O)C1 915880290 FCEVRLADDQZXAQ-LLVKDONJSA-N 458.543 0.680 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccccc1 916295911 ZKUJLWPWSSRFQU-UHFFFAOYSA-N 468.561 0.211 50 20 JCGD CN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)CC1 916388171 XLGXZEATDCLNLJ-UHFFFAOYSA-N 488.614 0.829 50 20 JCGD C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)cn2)CCO1 916392908 PNFAZWCKRSTFSH-CQSZACIVSA-N 461.548 0.744 50 20 JCGD CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNC(=O)Cc2nc3ccccc3n2C)CC1 916639524 LMUDQTLUTUEVBX-UHFFFAOYSA-N 487.561 0.964 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2COCCO2)c1 918108465 JQUDPLPVWCYDSW-HNNXBMFYSA-N 464.500 0.855 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)cc1 919690488 RFMQWCBMNQULNX-UHFFFAOYSA-N 482.526 0.071 50 20 JCGD C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 919885857 OJIQABQRFCZLQI-PBHICJAKSA-N 492.579 0.958 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1nc2ccccc2[nH]1 1778470451 LQFADKWPEARPBS-HYBUGGRVSA-N 462.315 0.684 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1 1778909481 OKYMUYAGKFLEDL-DICZOGMTSA-N 455.515 0.225 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1 1779235340 SAASOXNAEWPHBI-OTZYPNAKSA-N 497.556 0.251 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnc[nH]1)C2 1779371368 SWEYJCVFGOLCEL-XMSQKQJNSA-N 455.519 0.169 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)Cn3ccccc3=O)CCO2)C1 1780097334 XWLLMPFZHCKKMK-HSZRJFAPSA-N 484.465 0.826 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969458 MMGYEOKKVRIZGC-HYBUGGRVSA-N 488.589 0.077 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781333540 ICOOMCWFHSSHTK-CZUORRHYSA-N 461.244 0.277 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1781339982 KPMZPKRTHTWBHD-IIBYNOLFSA-N 473.643 0.944 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1781342330 KYFKZCDLGLVEKJ-XIKOKIGWSA-N 454.351 0.896 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1782302337 FSSLNQHYGJEYBV-QHCPKHFHSA-N 466.278 0.219 50 20 JCGD C=C1C[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)N(C(=O)OC(C)(C)C)C1 1783937413 KHTOJSYOQQENKR-MHECFPHRSA-N 493.605 0.755 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)CCn3ccnn3)C2)C1 1784532720 AHZPUYHEXDJGSH-NRFANRHFSA-N 472.458 0.645 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)s1 1785599121 AQGLFLUBIMMIJQ-RCBQFDQVSA-N 459.528 0.662 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1c[nH]c2nccc-2c1Cl 1787347370 UZXVZGDPBISWFU-JVPBZIDWSA-N 482.733 0.755 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCC3)C[C@@H]21 1787508135 HWIUFHVLHYLQLV-RWRPXTCXSA-N 458.563 0.586 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cn2cc(F)ccc2n1 1788342036 NNOWIVMVHGAAMW-QSFXBCCZSA-N 466.278 0.060 50 20 JCGD COc1cc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1OC 1790194013 NERZADGDELDRRM-MDKPJZGXSA-N 476.574 0.979 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(=O)O)ncn3)C[C@@H]21 1790961264 NJUGPIBVDLOGQG-OHTBPHCPSA-N 455.309 0.942 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(c3)CCNCC4)C[C@@H]21 1791257498 KGVRWRARGUVYAP-CAIZAGQASA-N 450.967 0.617 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C[C@@H]21 1791288070 UMEKUIBJGXNNCE-MMKMLUHNSA-N 471.558 0.532 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCCC1)NC(=O)NCc1ccccc1 1792543173 BEGVYAGBYZLEAT-JHDGKUDLSA-N 472.590 0.018 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc(N)n1)NC(=O)NCc1ccccc1 1795663436 FVCPTALRXCZSJS-HGKCTWBKSA-N 487.586 0.275 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)C1CCN(Cc2ccccn2)CC1 1796190762 JDBWQRAOQNMOAF-BKFWDETESA-N 476.386 0.925 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)[C@H]1SC(=N)NC1=O 1796429986 RUJAJKXGPTZYBD-PQCBQTOFSA-N 461.382 0.552 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cn1C)NC(=O)NCc1ccccc1 1796715918 OBJBBYQWSGLKDW-OPMZPASUSA-N 486.548 0.714 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3[C@H]1O)C2 1797748465 DXIQNMNOCNRSLH-PNIWUYDQSA-N 479.537 0.184 50 20 JCGD Cc1noc(C)c1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095411 RYDGMGFRUFBXCB-IRJINJETSA-N 498.584 0.770 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2 1800979558 PAIOFECLLQOMIJ-IMTAKKMFSA-N 464.872 0.987 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801015345 JDAMHNBJQKJUGI-XCCSTKFXSA-N 464.346 0.958 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)CC1 1803142797 JJGREKCMZXQEHW-KURKYZTESA-N 472.995 0.359 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363057 ALMUSAPVZILFPL-WZONZLPQSA-N 475.314 0.209 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2ccc(F)cn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370361 BWKHNTJKPKDFDO-FDDCHVKYSA-N 462.290 0.858 50 20 JCGD Cn1cc(CCC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1807370743 KBLIPOACEVPGJI-OFNKIYASSA-N 461.331 0.447 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807996644 XZBPGMOYIOYZML-JLTOFOAXSA-N 477.481 0.520 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@@H]1Cc2ccccc2CN1 1808238673 JMTFGPAMWWGWAO-VJTSUQJLSA-N 484.365 0.796 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc2ncccn2n1 1809763527 MPYKTHQLYWGMQS-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD C[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)[C@@H]1SC(=N)NC1=O 1809967085 SLGLJLBTUSIRLH-PBHICJAKSA-N 472.376 0.014 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810121458 KUEDLDMTJPYBCB-KHZGNEAMSA-N 457.361 0.240 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810295329 SGQWAXKOXKGONR-FFZOFVMBSA-N 467.530 0.314 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1 1811270922 PYRRARQGKCZUOW-IERDGZPVSA-N 485.508 0.756 50 20 JCGD O=C1Nc2c(C(=O)N[C@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)cccc2C1=O 1815356318 BVJSDZSPRSAEFO-ZDUSSCGKSA-N 490.306 0.497 50 20 JCGD O=C(Cc1ccc(F)cn1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1815502358 SVDDANNEPFERKW-INIZCTEOSA-N 454.292 0.826 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815820084 IIDVPQIMJWDTQR-KRWDZBQOSA-N 467.251 0.200 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817281448 FMZOBWIQOMZKIW-QYYIONLISA-N 489.558 0.340 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)N1C[C@H]2C[C@@H]2C1 1817472568 XDUGYFANWNHQBS-WVSUBDOOSA-N 451.336 0.736 50 20 JCGD O=C(COC(=O)C(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819313282 CBILOYGJTKBPBD-AWEZNQCLSA-N 468.197 0.501 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4cn[nH]c4cn3)sc2C1 1819449698 HWRKUDMATSDYAM-LLVKDONJSA-N 477.510 0.953 50 20 JCGD CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)CC2 1822841103 HXQIDAYYVPEPJR-QWRGUYRKSA-N 493.977 0.520 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cnnn2)CC1 1827195768 AYEHAQQSOBGZBQ-WORIPGKHSA-N 455.523 0.427 50 20 JCGD O=C(Cn1nccn1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551288 LYKTWYJTUFQCMS-XMSQKQJNSA-N 490.948 0.330 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830736947 CAIKERLLFGUVNC-HYFFOGBASA-N 489.997 0.690 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cn4nc(C)sc4n3)CCO2)C1 1832110609 RUUZBWIRKFATAB-DNVCBOLYSA-N 471.967 0.352 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1 1833334227 GCXBMUKTTQWKCL-OAQYLSRUSA-N 464.595 0.962 50 20 JCGD C=CCCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(O)n1 1833695597 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O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc4ncccn4n3)CC2)CC1 1837919078 BKUVUEQEHBTWPY-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837921048 VJAYCYSVPXVIHQ-JOCHJYFZSA-N 473.379 0.283 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc3ncnn3c1)CCO2 1839047895 COFBBJRBWKORPI-IBGZPJMESA-N 466.336 0.513 50 20 JCGD O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839482489 ZDFGWXZAZKFBRU-HNAYVOBHSA-N 467.866 0.141 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)Cc1ccccc1)CCO2 1839957851 JJDYKDDPWDOUMW-PXNSSMCTSA-N 455.349 0.831 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cn4nc(C)sc4n3)C2)C1 1840150733 PSQKRCGQHWYDNU-HNAYVOBHSA-N 471.967 0.352 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)C1 1840219075 APPSHFVLWNCFON-WOJBJXKFSA-N 496.388 0.618 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)CCO2 1840945692 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COCCC(=O)NNC(=O)Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O 727099794 DCPLKPSLXNRMHV-UHFFFAOYSA-N 490.520 0.640 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1 729277011 RCNLPKHCXULHIS-GWCFXTLKSA-N 461.338 0.139 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)C(=O)N1CCCC1)n2C 748247420 NHKXEHIFPUNCBR-UHFFFAOYSA-N 478.575 0.306 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)NNC(=O)c1ccccc1 825461340 LKQSVGIGQQZNIA-KRWDZBQOSA-N 461.496 0.762 50 20 JCGD NS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccs2)ccc1Br 915449505 AYTHVKSCLJDBOY-UHFFFAOYSA-N 462.303 0.776 50 20 JCGD COCCS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 915636525 OFBABGQPAMVXTJ-UHFFFAOYSA-N 489.959 0.963 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cnns1)N(S(C)(=O)=O)CC2 917394022 YEGITAAZXWDHNJ-GFCCVEGCSA-N 455.518 0.265 50 20 JCGD O=C(Nc1ccc(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1)c1ccc(F)cc1 919956436 WJUICCGITSTBJE-CYBMUJFWSA-N 455.489 0.822 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c1 920238447 CPTKSEYEACQTPM-OAHLLOKOSA-N 475.593 0.085 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1 920826482 LYXVHJQVGMDMIT-UHFFFAOYSA-N 472.483 0.453 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CS(=O)(=O)N2CCCC2)C1 1778090330 OTULYVPTQXIAPS-GPMSIDNRSA-N 450.001 0.943 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1778822629 JZHBKMDTZPQDDF-NHOCJEJCSA-N 493.630 0.321 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1onc3ccccc13)CCO2 1779037354 WUOZPXBXGOQYOB-JOCHJYFZSA-N 450.455 0.584 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1 1779236324 DMJFOFRGAKYVQK-OAQYLSRUSA-N 450.612 0.968 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)CCO2 1779299346 YAZMGZKIFXSKRT-OAQYLSRUSA-N 475.578 0.974 50 20 JCGD COc1nc(C)ccc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779740145 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JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@H]1CCN(C(=O)C(O)O)[C@@H]1c1cccnc1 1804239200 HXXPFPNRSAYPTQ-QLFBSQMISA-N 456.927 0.530 50 20 JCGD Cc1noc(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804244251 JLGACEDCJUDIKL-AUSIDOKSSA-N 462.315 0.929 50 20 JCGD Cc1nc(O)c(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nc1C 1804874159 OUTSLEVEHDGKGT-OXJNMPFZSA-N 490.524 0.826 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1 1805094297 IXZBWCMDRCDKBN-AUSIDOKSSA-N 473.342 0.856 50 20 JCGD CN1CCN(CCC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1806914832 NQOOEHKDYSGXEI-WMZHIEFXSA-N 494.600 0.037 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1807352513 GIBWNBJRWQJWRX-QILLFSRXSA-N 477.974 0.592 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1cc(=O)n2[nH]cnc2n1 1807358542 KIRYHRDYQTUTTJ-BXUZGUMPSA-N 450.286 0.936 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)[C@@H](N)CN)[C@H]1c1cccnc1 1808268605 YUJNDJVEIWFZGL-MOXGXCLJSA-N 470.486 0.521 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1 1810301800 CMOVAJSAJUSNLG-NPIIGJQGSA-N 477.525 0.235 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810506850 MHAHPHLQSGVGJZ-GTCCEBARSA-N 466.347 0.386 50 20 JCGD CC(=O)NCC(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1812621033 IHXLQZMXMVDCII-ZJSXRUAMSA-N 495.584 0.570 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1 1813072155 ASZWIPUAEIDSMA-OXJNMPFZSA-N 468.514 0.898 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813413228 WZWVDZTZYWPSNZ-AGHHOFFYSA-N 461.331 0.614 50 20 JCGD Cc1nccn1[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813489645 IMBQCNHZLZRANB-QGCDCVKKSA-N 461.331 0.847 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cc(Cl)cn3)sc2C1 1815416386 KHHYCARALWNMPY-GFCCVEGCSA-N 453.956 0.978 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cnc4ncccn34)sc2C1)c1ccc(B(O)O)cc1 1818435099 VPNXSLGQCHWXMP-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819792760 AHIUXCNAHDCXGC-GHMZBOCLSA-N 459.532 0.282 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1827546535 NVMMUUZPLKFNEX-SFTDATJTSA-N 470.404 0.626 50 20 JCGD O=C(Cn1cncn1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829010387 RRYSSDRATGFCRV-GCJKJVERSA-N 490.948 0.330 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1830358091 LKVKASFUYIFMGH-FQEVSTJZSA-N 473.979 0.820 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1830364132 ZQTRNSVGNIAUQW-OAQYLSRUSA-N 485.006 0.613 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725543 JLWOWOWPQHCYNI-KDOFPFPSSA-N 465.856 0.699 50 20 JCGD Cn1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(C(F)(F)F)c1 1830727940 LDHVKSSVPYATAF-WMLDXEAASA-N 453.845 0.714 50 20 JCGD O=C(/C=C\c1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832733991 NQUJXILMGWELIX-RELALGRQSA-N 489.337 0.631 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833084120 PBUFHDCPNDIVRJ-LJQANCHMSA-N 493.417 0.557 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CNC(=O)OC(C)(C)C)CC2)CC1 1833271988 DUPDJWNIPOOPOI-ZWKOTPCHSA-N 491.029 0.697 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3C(=O)OC(C)C)CCO2)C1 1833394143 OOZPIEWHLDERCX-VGOFRKELSA-N 483.949 0.971 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833399872 IPNKOZCVBJUFQD-LPHOPBHVSA-N 459.952 0.573 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C[C@H]3CCCCO3)CC2)CC1 1833681533 ONPCIOBQVUVXKF-LJQANCHMSA-N 472.590 0.830 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(F)cc4)CC3)C2)C1 1835934283 STRDNNWNMGZWFF-DEOSSOPVSA-N 482.317 0.307 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)COC4)CCO2)C1 1836568005 BKAQGBJKDZNECZ-XMMPIXPASA-N 481.509 0.099 50 20 JCGD Cc1ccc2[nH]c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)cc2c1 1837459686 WOEBEQKUUMOFSK-VWLOTQADSA-N 492.536 0.859 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1837710161 LQCAMKQXBMVBQH-FQEVSTJZSA-N 450.568 0.102 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)N1C[C@@H]2C[C@H]2C1 1837919202 QDKPTRGYMZWKQA-HOJAQTOUSA-N 469.391 0.319 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1oc(C)nc1C)CCO2 1838004127 YNFVUTUVPAQTFI-IBUSPFOHSA-N 472.502 0.495 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838731134 LUSXYCVFYBQTFJ-OAQYLSRUSA-N 483.953 0.187 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1839018428 QCCQRJNIGXPCBZ-XMMPIXPASA-N 468.315 0.149 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)c1 1839026150 IRRFWZQWVFWDBX-QHCPKHFHSA-N 462.547 0.447 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203826 XVQFKAHFVKVMBQ-WMZOPIPTSA-N 461.332 0.726 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)ccc1C 1839402609 XHMIGHINIVNABO-GHTZIAJQSA-N 453.923 0.623 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1 1839477135 YPVLJRIJPINULM-QAPCUYQASA-N 466.890 0.834 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(=O)OC)cc3[N+](=O)[O-])C2)C1 1840155134 QIANXLUEOXLHSN-KKSFZXQISA-N 499.904 0.705 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185250 NGRZTSJFKOOSMU-XMMPIXPASA-N 460.575 0.675 50 20 JCGD Cc1cc2cc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)ccc2[nH]1 1840185556 TVJHZZOMBPPLIM-XMMPIXPASA-N 471.558 0.919 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840239896 RPSWSLIJQODXSO-XMMPIXPASA-N 470.306 0.127 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@@H](O)c2cccc(Br)c2)C1 1845040652 OQXFUVDPMYENBJ-SFHVURJKSA-N 473.132 0.680 50 20 JCGD CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)C(=O)NC1CC1 9889190 YRJDQEADDYOTFP-CYBMUJFWSA-N 457.350 0.727 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(Cn2cncn2)cc1 11609864 WMKAJUVXZRCAQF-UHFFFAOYSA-N 470.511 0.422 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1OC 14770946 GTTKVMMJGZVHRY-AWEZNQCLSA-N 479.511 0.683 50 20 JCGD O=C(CSc1ccc(S(=O)(=O)N2CCOCC2)cn1)NNC(=O)c1cccc([N+](=O)[O-])c1 22885777 WWAIIEWFSOSXOU-UHFFFAOYSA-N 481.512 0.564 50 20 JCGD COCCCNC(=S)N(C)NC(=O)CNC(=O)c1ccccc1I 726075907 PXAGKHNPMGOQLU-UHFFFAOYSA-N 464.329 0.895 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)c1csc(N2CCOCC2)n1 727798716 BPASGTZCJBBLQF-NSHDSACASA-N 451.427 0.904 50 20 JCGD C#Cc1ccc(C(=O)NNC(=O)C[C@@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)cn1 728960041 OBYWDVUJSMNLBY-GOSISDBHSA-N 472.523 0.790 50 20 JCGD Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)cc1 729274851 FWDVXERUTBMFHQ-CQSZACIVSA-N 468.557 0.803 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cc[n+]([O-])cc1)N(S(C)(=O)=O)CC2 913161260 GLBOJJYJIZKOGU-MRXNPFEDSA-N 464.500 0.047 50 20 JCGD CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(C(=O)NCC(=O)O)cc1 916109892 IZSSMIMBXQABRB-UHFFFAOYSA-N 451.457 0.288 50 20 JCGD C[C@@H](CN1CCCCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916462074 PPXHYSSUHRBVCV-INIZCTEOSA-N 453.565 0.526 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCc3cn4c(n3)CCCC4)nc2)CC1 916578299 CUWDYAOIRKMKIZ-UHFFFAOYSA-N 462.580 0.419 50 20 JCGD C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)CN3CCCC3=O)ccc2Cl)C[C@@H](C)O1 920435587 KGVZQTCUEDCPIZ-CHWSQXEVSA-N 472.951 0.521 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)NCCc2cccs2)cc1[C@]1(C)NC(=O)NC1=O 920832812 BKIQWYHBAQFABJ-SFHVURJKSA-N 467.529 0.547 50 20 JCGD O=C(NCc1ccco1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1 920856602 TVCNNAZHILZQSU-UHFFFAOYSA-N 464.500 0.982 50 20 JCGD Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)Cc1csc(N2CCOCC2)n1 1321405517 ZJPMUCHKQIFESJ-INIZCTEOSA-N 466.589 0.845 50 20 JCGD C[Si](C)(C)c1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)co1 1778994074 HIUSJCZVBWQYCH-JOCHJYFZSA-N 456.380 0.262 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ncsc1Br)CCO2 1779030334 OBTJXFBMDOZHAB-SFHVURJKSA-N 495.359 0.661 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(O)c1 1779032856 YMFUTVACYGLFGB-JOCHJYFZSA-N 455.471 0.157 50 20 JCGD CC(C)n1nccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779748217 GHYXMTTXSXMUMP-NFBKMPQASA-N 454.336 0.585 50 20 JCGD CN1CCCn2nc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cc2C1 1782563242 AAYVCECOSYSOCP-MAUKXSAKSA-N 458.332 0.853 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc(C#N)cc3)[C@H]2C1 1783443722 BEQDXOSHCJJEOH-ACRUOGEOSA-N 455.559 0.844 50 20 JCGD CCOc1ccc(CC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1OC 1783706598 SBNKOFQOMFKIMH-DEOSSOPVSA-N 476.574 0.839 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CS(C)(=O)=O)C[C@@H]21 1783964074 JCZYPVDDFMWKEX-YTFOTSKYSA-N 453.399 0.678 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1 1785276448 YCWQBAMYWSRFOH-XMMPIXPASA-N 466.299 0.219 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785561753 PMZDEQCBWPZXSN-HXOBKFHXSA-N 459.547 0.008 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1785608008 NSDDNMZIIWVCBZ-BTYIYWSLSA-N 486.642 0.437 50 20 JCGD COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1F 1785641105 TUPCPWBJSTVVAC-QRTARXTBSA-N 451.499 0.196 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786404315 CYSLPHQQXNJRTP-VTRWRZSMSA-N 496.402 0.931 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3Cl)C[C@@H]21)c1ccc(B(O)O)cc1 1786979727 BSSXVGUKCFCBSZ-JVPBZIDWSA-N 482.733 0.755 50 20 JCGD CC1(C)Cc2cccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)c2O1 1786979917 OCFOSJZHFWPHJR-NYVOZVTQSA-N 478.354 0.987 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cccc(O)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786982990 FDTMEZNEMYURLR-KRJYPNDCSA-N 450.300 0.379 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4cc(Cl)ccn34)[C@H]2C1 1787241016 GDXBXYORTADLHR-ZVZYQTTQSA-N 476.965 0.954 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cccnc34)[C@H]2C1 1788291780 WBYHAXBVRCFFAU-VOVAKLSQSA-N 478.513 0.457 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1788961432 NHWJUMJGGIVGLG-QRTARXTBSA-N 480.252 0.026 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)N1C(=O)OC(C)(C)C 1792971052 GOOWZZROYPRREY-WBAHDQRJSA-N 459.971 0.964 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C[C@H]2C[C@H]21 1792994806 LIMYQJQRYQAVIX-OCWHGYOISA-N 457.955 0.574 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1ccc(B(O)O)cc1 1793399580 IUBRYDOFBKVDKU-XBYSBRQOSA-N 475.354 0.667 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(-c3ccccc3)n1)C2)c1ccc(B(O)O)cc1 1795735008 HYGUNSLAAQSTFY-OPMZPASUSA-N 460.299 0.069 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCOCC2)n1)c1cccc(B(O)O)c1 1797089359 BWPWDULJBWYBSC-ACDBMABISA-N 464.331 0.164 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C/N=C/c1ccco1 1797838684 MOCVCMMWJFKHQU-JNEOAWQVSA-N 454.487 0.422 50 20 JCGD O=C1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)Cc2ccccc2)N1 1800436095 QRFLUKVZKCVXDI-OREBXVKISA-N 464.360 0.861 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCCNC(=O)OC(C)(C)C)C2 1801010572 HUTSDWZXEZRBEM-UPHUGPLXSA-N 483.610 0.644 50 20 JCGD CNc1nsnc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1802472715 RCQCBCIFPHLWKX-YJBOKZPZSA-N 466.332 0.288 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cc1 1805163608 XWMWLSRVKKBRIN-QFIPXVFZSA-N 466.343 0.953 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807360649 TYZWBZNPDASCIC-YJBOKZPZSA-N 466.332 0.288 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374894 KXMCCTCHVLNAKD-OXQOHEQNSA-N 463.259 0.631 50 20 JCGD COCCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1808653109 OPDLUEJJKGQRDO-UGKGYDQZSA-N 477.330 0.238 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)Br)[C@@H]1c1cccnc1 1810093989 JYIIZPOANJHSDM-UZMCECQYSA-N 457.325 0.935 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cncc(O)c2)[C@H]1c1cccnc1 1810305313 JZAUESPWPJNFHR-YWZLYKJASA-N 461.482 0.814 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1 1810306055 RVBWGMJPTCHZQL-KSFYIVLOSA-N 490.524 0.528 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1810565372 OQIMVUNOSPCOFX-FTNNHQPHSA-N 497.556 0.373 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)CC2)c1ccc(B(O)O)cc1 1815343730 LTDOWIWNNJZBCB-AWEZNQCLSA-N 482.283 0.976 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817471097 RNWJHCQPQFTIOG-KXBFYZLASA-N 450.308 0.928 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CC(F)(F)C(=O)O)[nH]n1)c1cccc(B(O)O)c1 1817475366 OXSINXGBVVQNFR-AWEZNQCLSA-N 450.207 0.505 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)n1cncn1 1819404806 ZZNKLANVJNUAEI-WBMJQRKESA-N 452.479 0.567 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cnn4c3OCCC4)sc2C1)c1cccc(B(O)O)c1 1823996665 UURZHNKOIZAFGP-CQSZACIVSA-N 467.316 0.342 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1824598906 OGCTVZJNFKCXCY-RISCZKNCSA-N 461.305 0.610 50 20 JCGD CN(C)c1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)o1 1827051410 XWIRPRAWYPXDPM-IBGZPJMESA-N 454.336 0.968 50 20 JCGD O=C(O)c1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)ncn1 1827055755 DRUWHCYVVJDDMG-FQEVSTJZSA-N 466.303 0.402 50 20 JCGD CNC(=O)CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828547915 BLLIYTVSOQGAET-JTSKRJEESA-N 480.949 0.174 50 20 JCGD C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1829267269 NRBVJGRFMJTQTR-XMMPIXPASA-N 469.542 0.445 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCO1)CCO2 1829917658 VBYCKDRDYIOSOJ-OOMZYFKXSA-N 461.519 0.146 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1830539549 IFRMZHCVLSMQIB-KZULUSFZSA-N 471.308 0.276 50 20 JCGD CC(C)(Cc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830551122 AKBUTGUNUXUZLV-SANMLTNESA-N 480.370 0.705 50 20 JCGD Cc1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccn1 1832627986 UVUDIGGWVDCYSL-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)n1 1832765114 YBNXDDXQRJEPTA-IBGZPJMESA-N 456.337 0.874 50 20 JCGD CC(C)n1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1C(=O)O 1833307961 FLOMDXVIWJFEDV-SFHVURJKSA-N 469.970 0.947 50 20 JCGD CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1833532515 SWMNITZULFLNMQ-INIZCTEOSA-N 452.920 0.690 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833599741 RLMLEVCDGXDEOQ-FZKQIMNGSA-N 490.376 0.339 50 20 JCGD O=C(c1cccnc1OCC1CC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833624998 YGTGCDWYVHOJEE-UWJYYQICSA-N 453.923 0.540 50 20 JCGD Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)on1 1833731467 HOFGOYJEHYRQIW-UHFFFAOYSA-N 454.336 0.091 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801469 MZQVAJHDZHYULR-UHFFFAOYSA-N 497.376 0.942 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2 1834823056 GYDCTVXHADGUDG-CPIJOOSUSA-N 462.341 0.757 50 20 JCGD O=C1CC[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)N1 1835128232 VIEUPAHTPYINOU-KGVIQGDOSA-N 494.386 0.728 50 20 JCGD C=CCO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835734432 HCHOACJQSDGDJN-MRXNPFEDSA-N 458.563 0.461 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCS3)CC2)CC1 1835737326 IKVQFEYXQXFIBG-LJQANCHMSA-N 460.604 0.766 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc3cc(Cl)ccn13)CCO2 1836370630 ZHPOGMLROFJLGW-JOCHJYFZSA-N 492.964 0.431 50 20 JCGD CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836396739 MXOCDGGAEWXFRK-SFHVURJKSA-N 450.971 0.888 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1 1836457774 XNUUYFGLQZANMP-KPZWWZAWSA-N 452.309 0.811 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncncc4c3)C2)C1 1837459002 HAVWKUADURBACO-DEOSSOPVSA-N 491.508 0.012 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459526 HULUZIUKGNQJOX-GKVSMKOHSA-N 499.543 0.773 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)C1 1837709359 YPXVNIYGMBGVCK-LZJOCLMNSA-N 456.612 0.884 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)ccn1 1837976751 RTLLTGVRPMORPM-LRULAXNGSA-N 484.513 0.294 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3F)C2)C1 1838528130 GSLYMDNUQNLOPJ-WJPUGNRLSA-N 465.434 0.948 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)cc1 1838965735 FGYCBWILTXKDNM-OTZYPNAKSA-N 483.525 0.899 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)c1ccc(F)cc1 1839039396 FOOVWAOOORVKJR-UWVAXJGDSA-N 459.877 0.994 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1C[C@H]1F)CCO2 1839095894 UIMDCKIBCLXLBV-YYQBIWNASA-N 463.934 0.933 50 20 JCGD COc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1F 1839198362 YPZDNMYAQZRHHZ-SUMWQHHRSA-N 464.263 0.990 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)c(F)cc1F)CCO2 1839287510 ILDWBSZGOZPPBO-JOCHJYFZSA-N 478.232 0.168 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2 1839690150 VFNWWYUMRNZBTK-YYHBXHNPSA-N 493.467 0.962 50 20 JCGD C[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802510 ZQDBNPCEURVOQU-KNBMTAEXSA-N 455.349 0.830 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3C1)CCO2 1839990693 BISKQPKMOUDTTB-NVQXNPDNSA-N 478.354 0.242 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)C1 1840032615 DSOJHXXHMCNARS-BIENJYKASA-N 494.383 0.112 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](C(=O)OC)CC3)C2)C1 1840150115 FPQQILTXJSPBCC-IAGYGMIVSA-N 460.955 0.676 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)C2)C1 1840155543 AFTPNHWDASVBKV-FOIQADDNSA-N 471.894 0.927 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3Cl)C2)C1 1840185282 IVSIXGAMTWNHSN-LJQANCHMSA-N 458.968 0.845 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)Cn2nnc3ccccc32)C1)NC(=O)NCc1ccccc1 1841816609 PLNHBEKTIOLRBT-UHFFFAOYSA-N 490.568 0.981 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c(F)c(OC)c1F 1843014652 KZVXFUXREJNGHF-UHFFFAOYSA-N 460.242 0.793 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)ccn1 1844791302 DVZUZHFLOFUNMA-UHFFFAOYSA-N 452.471 0.388 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1)C2 1846385505 OKHZQHPUYQCZQW-QFIPXVFZSA-N 467.567 0.247 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2cc(F)ccc2[N+](=O)[O-])C1 1847048429 FUYZKBCDJDAILE-UHFFFAOYSA-N 456.434 0.792 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)COc1ccc(C)cc1)c(=O)n2Cc1ccccc1 10161283 NFJLYFSRWLHXDY-UHFFFAOYSA-N 490.520 0.963 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)CC2)c(C)c1 15639709 AQQXSLQQQRMCHF-INIZCTEOSA-N 457.574 0.286 50 20 JCGD Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C 16201190 OZSCYKKXFKXNIQ-UHFFFAOYSA-N 467.511 0.717 50 20 JCGD O=C(O)c1cc2c(c(S(=O)(=O)NNC(=O)c3csc(N4CCOCC4)n3)c1)CCC2 108297377 QUWKGZVMPBAABN-UHFFFAOYSA-N 452.514 0.790 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1 725871564 DQSHUUQLAYLSJK-UHFFFAOYSA-N 467.479 0.286 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CS(=O)(=O)NC2CCC(C)CC2)c1 728065015 JWVJMXVCCBTHME-UHFFFAOYSA-N 488.632 0.976 50 20 JCGD Cn1c(=O)c2c(ncn2CCC(=O)NNc2ccc(S(=O)(=O)Nc3ccccc3)cc2)n(C)c1=O 728214912 FLTWDOBRJAGFOT-UHFFFAOYSA-N 497.537 0.768 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@@](O)(c3nccn3C)C(F)(F)F)cc2)CC1 728215369 YGDUYVSTBLDENJ-GOSISDBHSA-N 490.508 0.640 50 20 JCGD O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1)C(=O)N1CCCC1 748247323 XVBRGQWTOBULLS-UHFFFAOYSA-N 474.495 0.642 50 20 JCGD CC(C)Cn1[nH]c(CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1=O 751139280 BQGUBIFSIJYVAS-UHFFFAOYSA-N 493.586 0.176 50 20 JCGD CCOc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)cc1 844153516 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COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1778050404 BKBXIIGAYGUQHY-DXEZIKHYSA-N 477.986 0.640 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3occc3c1O)CCO2 1779037380 YVSHVYJVAVBXBZ-HSZRJFAPSA-N 465.466 0.894 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779333088 HKHMGQGUOYURKT-IVZQSRNASA-N 453.503 0.024 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781232871 NGUSGGTTWQNZSP-SVIJTADQSA-N 495.404 0.821 50 20 JCGD CCN(CC)C[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1781507910 NJMQKFYPGPECCA-YCRNBWNJSA-N 453.628 0.851 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CS(C)(=O)=O)C2 1781997073 BIQPRHBWJSWIOO-ZOMKSWQUSA-N 453.399 0.964 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2cnc[nH]2)C1 1782428728 KHTWDHGJGHMOKL-SRIRNZLBSA-N 453.503 0.249 50 20 JCGD C[C@H](Cc1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 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CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1800712007 OKHQDHGZTRWOPF-VMKVGTKNSA-N 457.955 0.433 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C 1800784462 JZXZYRWEKSLMTL-CLWJZODNSA-N 481.594 0.349 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1 1801966622 FDQKLLFSDOSZJE-ZMMAXQRCSA-N 489.013 0.383 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn1 1803139445 PIJXIIQKMDBWTQ-MNEFBYGVSA-N 480.974 0.941 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1ccnc1 1803310436 MELABUHRXBFMRG-MDYRTPRTSA-N 462.514 0.857 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CNC(=O)c2cccs2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369798 WHASOUWCXLDHJD-AVRDEDQJSA-N 492.366 0.573 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808417732 OLXDEWFJRCQHLR-AEKCRQKESA-N 499.528 0.286 50 20 JCGD 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LDFBQXXSLLIXDV-QFIPXVFZSA-N 488.932 0.046 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)c1 1837460012 QQNMSSCCRVHYJW-DEOSSOPVSA-N 483.525 0.386 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460088 TZSXECFWNBKFAW-XDHUDOTRSA-N 482.541 0.029 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1 1837531491 NTFOIWSJPZCZEK-DSLRRYSGSA-N 457.600 0.823 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1837712179 HHNKIDUVJDQLKK-HXUWFJFHSA-N 485.635 0.407 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)N1C[C@H]2C[C@H]2C1 1837919204 QDKPTRGYMZWKQA-RLLQIKCJSA-N 469.391 0.319 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)CC1 1837920158 FNXAWMAGAGRFKA-XMMPIXPASA-N 478.354 0.982 50 20 JCGD CSCC[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838789198 KTCXXXIMCYRYEF-GOSISDBHSA-N 458.625 0.472 50 20 JCGD Cc1[nH]ccc1C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054421 XZJIBUNHBDDFJX-VWLOTQADSA-N 498.584 0.739 50 20 JCGD CN(C)c1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1 1839197953 NVGJLZTVJFFQEV-MAUKXSAKSA-N 459.316 0.908 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCOCCOCCOCCOC)CCO2)C1 1839220236 BYBHIKPNHRSKPH-KNQAVFIVSA-N 495.013 0.547 50 20 JCGD Cc1cccc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839367999 AHMAUWSAMWAKFS-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839470087 XSULFSZJMOMKDC-GCJKJVERSA-N 476.917 0.519 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc(C)c1C(=O)O 1839480075 KPOPQBYWLMHOML-RUZDIDTESA-N 496.325 0.065 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc3c(c1)CCNCC3)CCO2 1839692684 KOICMNLTKXPQLW-OAQYLSRUSA-N 481.391 0.625 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1839964054 DQDKIRXGXBAPJX-IFXJQAMLSA-N 482.335 0.678 50 20 JCGD CCc1nn(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1Cl 1840183784 ZYZBPKFYUKMESK-NRFANRHFSA-N 484.985 0.079 50 20 JCGD CC(C)COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccn1 1840183961 KNMNKTYXQRCWHA-XMMPIXPASA-N 491.589 0.559 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CCCN2C(=O)c3ccccc3C2=O)C1 1841913960 OCMGZGOANQTDKS-UHFFFAOYSA-N 475.310 0.260 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCCC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1845160092 DTSLHLZVZGVXAF-MRXNPFEDSA-N 477.986 0.738 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@]1(C)CN(C(=O)OC(C)(C)C)CC[C@H]1O 1847239485 VUROIAONBLOOML-MNFWLRKXSA-N 495.621 0.569 50 20 JCGD Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1nn(-c2ccccc2)cc1O 10159871 DYVAKUBVKZNLCJ-UHFFFAOYSA-N 474.499 0.012 50 20 JCGD CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)ccc1Cl 14854848 FIKMCRYDGRANNC-UHFFFAOYSA-N 465.875 0.833 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=S)NCC3CCC3)cc2)CC1 727869485 XWFCIUZFHZHVGG-UHFFFAOYSA-N 453.590 0.448 50 20 JCGD CC(C)[C@H](NC(=O)c1ccccn1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728342139 GJTQLLJYMIPKSP-HKUYNNGSSA-N 456.455 0.367 50 20 JCGD CC(C)OCCCn1c(NNC(=O)Cn2cnc3c(cnn3C)c2=O)nc2ccccc2c1=O 729279861 RUAXCJHGHAFONY-UHFFFAOYSA-N 466.502 0.798 50 20 JCGD CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)C(=O)NC(C)C 744447009 RUFSIVCBSQYERS-ZDUSSCGKSA-N 459.366 0.973 50 20 JCGD CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)C(=O)NC2CC2)c1 744463519 IXJMKDQABZKRAR-UHFFFAOYSA-N 461.338 0.566 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)c1ccc(C#N)cc1 747175426 WTJQHCVXJQGUKC-KRWDZBQOSA-N 458.496 0.561 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccncc1)C2=O)c1ccc(-n2cnnn2)cc1 769598700 WZPPPFZVURDWMT-UHFFFAOYSA-N 468.433 0.928 50 20 JCGD C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 912642865 BFBHVFUWWCSIHC-ZTFGCOKTSA-N 476.555 0.796 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2C(=O)NC(CC)(CC)C2=O)c1 912643094 UOCOQUOSDVGKLI-UHFFFAOYSA-N 467.548 0.589 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(Cl)c(C(=O)O)c2)c1 916110310 BZQSCOHKBNGGTK-UHFFFAOYSA-N 461.905 0.912 50 20 JCGD CC(=O)Nc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 916373609 KKSKOKUMHWDJQM-UHFFFAOYSA-N 475.527 0.810 50 20 JCGD CCNC(=O)c1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 916391977 OVORRVJGSZMZRS-UHFFFAOYSA-N 461.544 0.896 50 20 JCGD CCN(CC)C[C@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 921119519 CPMAPPVXPODTBA-KRWDZBQOSA-N 469.608 0.701 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1=NN(c2ccc(F)cc2)[C@H](C(N)=O)C1 934652521 TYZNUVKKUDFIQC-INIZCTEOSA-N 491.863 0.912 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1778257813 OSIFMGVWLAILPW-QHCPKHFHSA-N 459.547 0.390 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3cncc23)C1 1779133696 ZHYLMAGVPYPIGO-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD COCC1(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)CC1 1780969740 NYJTUEPOEXBJLE-XMMPIXPASA-N 473.574 0.589 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2 1781268712 UNHRQFSNKIHLLM-ZHNJOBQTSA-N 459.503 0.460 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781335018 TVHGNCRYCRHSEN-SCLBCKFNSA-N 484.282 0.813 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)ccn1 1782212352 WDGNEPYCKIBLNB-NTKDMRAZSA-N 489.573 0.759 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3ncnn3c1)C2 1782214162 GTEYQKSEUNDTJH-VGOFRKELSA-N 457.535 0.230 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c([N+](=O)[O-])c1 1783934826 NVMYPRMWLXNXNQ-JOCHJYFZSA-N 491.501 0.198 50 20 JCGD COc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1C 1784922627 BHWXJWDZFJORKO-HSZRJFAPSA-N 453.499 0.759 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccccc3=O)C[C@@H]21 1785076612 ZKHYHKZNFCVCSQ-XSLAGTTESA-N 496.992 0.960 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc2c(s1)CCC2 1786248322 BULBKNUOASTBBF-WDSOQIARSA-N 454.357 0.824 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccco4)no3)[C@H]2C1 1787285610 XHTDZLKRTYULMA-RISOHXOYSA-N 480.481 0.840 50 20 JCGD CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)cc1C 1788998739 XXPCRTZNEQDAQY-XWOIHUEZSA-N 469.546 0.939 50 20 JCGD Cn1c(=O)c2c(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](F)Cl)C[C@@H]43)csc2n(C)c1=O 1789703123 UFIBDGCXVBQWLQ-SDPXSBNPSA-N 486.953 0.355 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1 1789870598 PXGPZVACFLAGPW-SIBFUHKCSA-N 467.346 0.697 50 20 JCGD CN1CCN(C2(C(=O)Nc3ccc(C4(NC(=O)c5cccc(B(O)O)c5)CCC4)cc3)CC2)CC1 1790446667 RTODMASHDLRALF-UHFFFAOYSA-N 476.386 0.894 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]31)CC2 1790762567 NCGQYBSBEZCTRS-PMYHVQSLSA-N 492.381 0.773 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(CNC(=O)OC(C)(C)C)CC3)C[C@@H]21 1791287204 TZGVGVCMTUKWKW-BZSNNMDCSA-N 495.621 0.644 50 20 JCGD COc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1F 1791289154 MAFJXJAZKKSWPS-BPUTZDHNSA-N 451.499 0.196 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O 1792780515 HFWSYQAQLOFGSL-YHDJZSDMSA-N 451.951 0.773 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2 1792887258 NZUMQIJRCSPMKG-JYYAWHABSA-N 459.616 0.313 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)[C@@H](F)C1 1792974868 GANVCECIEDIACD-PHPOFCCKSA-N 477.961 0.771 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792975377 PGSKNVZOCPDITC-RIUYPTKQSA-N 459.971 0.965 50 20 JCGD C[C@@H](Sc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793233449 FUJHODWAWUEZCP-LAVAIGHBSA-N 454.357 0.750 50 20 JCGD CC(C)(C)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cn1 1795732926 SLIQSWYSPHRVSP-RMFSNUHRSA-N 451.332 0.576 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3N1)C2 1796444045 VYXSAHCLDURBHR-VHDDJOBXSA-N 464.526 0.747 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)C1=NO[C@@H](c2ccccc2)C1 1797175672 RBGKNGKFOPIXRB-GMQQQROESA-N 463.299 0.087 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1n[nH]cc1I 1798115530 IZKXNIFULGIWJP-YRCORFKGSA-N 456.643 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc3snnc3c1)C2 1798439753 CEQXMSUYKRLWOD-CLLJXQQHSA-N 452.500 0.650 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cc2nn[nH]c12)c1ccc(B(O)O)cc1 1799331868 OVQPWHAGGIJHQA-MUJYYYPQSA-N 453.695 0.857 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2 1799382669 DWUWAOMTUOIGDT-VXIBKDFQSA-N 495.411 0.446 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)[S@@](=O)c1ccccc1 1800213259 UERUCACFTZEKLT-LNTPBIQESA-N 499.593 0.906 50 20 JCGD CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1 1800335382 GPHCKYIYGMLKCN-MOAIGLLQSA-N 487.022 0.164 50 20 JCGD Cc1cc(Br)cnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801009576 OGPSKZUSFGOCDS-HBCWATKFSA-N 482.379 0.729 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc([N+](=O)[O-])o1 1802259015 IVXBJLFWHPPZJQ-OXJNMPFZSA-N 464.243 0.896 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1 1807361080 OSDMINPRUQTFAE-GHTZIAJQSA-N 476.346 0.741 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361741 CVPMEHOBQHMOAG-VQIMIIECSA-N 460.137 0.866 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1 1810293871 DXOYONVQSPTLFZ-PGRDOPGGSA-N 476.298 0.946 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810305352 KHSFENKVLAVBFL-MNEFBYGVSA-N 472.571 0.514 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H](O)Cc1ccccc1 1812769095 BDPFIIKFMDUYEV-QPTUXGOLSA-N 473.338 0.685 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1 1814563358 XCZAPVHBOHUCQF-IXBOPPFXSA-N 471.522 0.807 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1 1814639294 TUSWFEPJJLDIOG-PJAVDKHJSA-N 487.586 0.911 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(C(=O)O)ncn2)n[nH]1 1816155513 DNLLGZHCASBDRR-OAHLLOKOSA-N 458.479 0.577 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CC(F)(F)C(=O)O)sc2C1 1817092841 SHGXMEIBVRYRIN-MRVPVSSYSA-N 468.442 0.477 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccnnc1O)CC2 1817281856 RQZSLHOFLHBRIX-VCEHOBFASA-N 468.499 0.999 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1 1824188577 SSYVIYSUOGBUJZ-DOTOQJQBSA-N 454.911 0.976 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@H](O)Cc3ccccc3)sc2C1)c1cccc(B(O)O)c1 1825429478 USVHNDWYNSVXTL-PKOBYXMFSA-N 465.340 0.652 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825966089 PLPNEGWROUYNTL-YESZJQIVSA-N 483.355 0.804 50 20 JCGD N=C(N)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829053062 XVHMHKQDGLQIBY-OXJNMPFZSA-N 468.917 0.456 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(=O)NC1)CCO2 1829960273 LOVGGAYRRRRRNW-PCYHPGSBSA-N 488.491 0.854 50 20 JCGD O=C(c1n[nH]c2c(Cl)cccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830735287 FTRUXVCWBHVXSH-AUUYWEPGSA-N 457.314 0.886 50 20 JCGD CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)N(CC)CC 1831668347 RVLJVBYVIHPUSE-CWAXPOLXSA-N 490.605 0.697 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncn3-c3ccncc3)CCO2)C1 1833656552 IIDVWGQECQKNJH-LAUBAEHRSA-N 463.922 0.591 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc(Cl)nc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797746 AXJQLCGKZIKSJQ-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD Cc1nnc(CCC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1834799813 CBULIPFPDCFZNR-UHFFFAOYSA-N 485.419 0.344 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2 1834824524 ANVAQNOHRYIBSP-IBGZPJMESA-N 481.384 0.298 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)CN)CC2)CC1 1835066981 HTKNMNQNAWKJEN-HZBHDWBUSA-N 460.529 0.729 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1835844121 HRSGBFJSXMQFIU-HOTGVXAUSA-N 465.364 0.400 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836129876 CGCTVWRXJSEZJS-AUUYWEPGSA-N 472.336 0.639 50 20 JCGD O=C(Cn1ccnn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1836212269 DJAUDKBAISZTSH-RXVVDRJESA-N 492.374 0.741 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3ncsc13)CCO2 1837071361 NILMYGOCRSFYMT-HSZRJFAPSA-N 496.549 0.679 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3sccc3[nH]1)CCO2 1837129136 RRYRLNRGPJXVPI-JOCHJYFZSA-N 469.328 0.293 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457135 YDBVJCJEQCIUFH-RUZDIDTESA-N 497.552 0.451 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3Cl)C2)C1 1837459188 LVEKUWJBKJBIOO-HXUWFJFHSA-N 479.946 0.784 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C3CC3)C2)C1 1837460375 DWFOJUXUBAKFPA-RUZDIDTESA-N 479.537 0.946 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837949371 OWZYHDSSRWMWNS-KSSFIOAISA-N 471.308 0.418 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCC=CO3)CC2)CC1 1838386885 FFPCUHIZJCRTMG-HXUWFJFHSA-N 457.531 0.990 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1 1838621633 NEZXVILZQXCFFR-RTBURBONSA-N 491.633 0.759 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1 1838795772 OZTNWTQKDUNCHX-DYESRHJHSA-N 463.922 0.591 50 20 JCGD O=C(Cc1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839070554 VWVSGNVGNDIYJR-VWLOTQADSA-N 477.326 0.160 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1840035334 NHILAZGYLUTPLJ-HXPMCKFVSA-N 499.387 0.979 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840039280 MYHCBOHERZXVRC-DJDZNOHASA-N 487.981 0.442 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccc(C)c34)C2)C1 1840155281 VWMLIZFICOYZIC-UTKZUKDTSA-N 450.923 0.967 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840186364 GLMLZWZZUCXSNO-QFIPXVFZSA-N 498.363 0.862 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCS1)CCO2 1840576693 VHQPBWZCYKEQLO-RCQWNHEVSA-N 463.560 0.472 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C)cc1O)CCO2 1840668734 ZLCGZVRBWLYZFO-MSIOFZDNSA-N 483.525 0.905 50 20 JCGD Cc1nccc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n1 1843550814 PNQPRHJHPRMOJG-UHFFFAOYSA-N 451.531 0.948 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)c2cccc(Br)c2)C1 1845041669 ZFKFNNBQJXAYAS-KRWDZBQOSA-N 488.342 0.998 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1846116796 PRDCAKVFGHHIKB-GOSISDBHSA-N 469.347 0.440 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846484057 VHOYJRDFGAILOS-KRWDZBQOSA-N 471.319 0.110 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)C1 1848093049 ZGPZULRDLHXYQS-GTAWCEEGSA-N 469.347 0.651 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1 17822353 GSAIIRJOIKRFKM-UHFFFAOYSA-N 464.500 0.925 50 20 JCGD CCCn1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NCCOC)cc2)c2ccccc2c1=O 26070044 OKLOTEGRLHVJIM-UHFFFAOYSA-N 487.538 0.806 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 725873776 QHBOQXCCOSZWTC-HNNXBMFYSA-N 495.583 0.466 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cnc21 727061296 DVYWXOPJXBPOMU-UHFFFAOYSA-N 450.209 0.262 50 20 JCGD CN(C)C(=O)NNC(=O)Cn1cc(I)c(=O)c(I)c1 746008710 SBXCPMPGCQWINW-UHFFFAOYSA-N 490.039 0.360 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1)N[C@H]1CCS(=O)(=O)C1 749583663 SWUGCMLBDVNCGU-KBPBESRZSA-N 473.349 0.571 50 20 JCGD Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)c1 914829993 NUJZNTWGBGSOMJ-HOTGVXAUSA-N 451.545 0.680 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCCNC(=O)C3CC3)c2)cc1 915906349 DOIZBFJNKXZOQP-UHFFFAOYSA-N 475.527 0.966 50 20 JCGD O=C(COc1ccc(F)cc1)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 915921804 KRBZYHXIHDNFSX-UHFFFAOYSA-N 466.491 0.756 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 920433521 WNKFFOIINHDVPU-CYBMUJFWSA-N 495.535 0.454 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc(C(F)(F)F)cn1 1777800923 KSTRVSPCHPKXBP-WIYYLYMNSA-N 492.263 0.617 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)n1 1778374254 AEMXLWAXDSWBLC-PJIJBLCYSA-N 456.883 0.726 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1778822628 JZHBKMDTZPQDDF-HUBRWUETSA-N 493.630 0.321 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034972 YOQXJMPBTZQGGQ-OYHNWAKOSA-N 470.555 0.704 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780777063 LVPOSCWYRXEIFN-OAFZBRQQSA-N 488.358 0.661 50 20 JCGD Cc1n[nH]cc1C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969103 VFKRWFSBGWULSJ-QHCPKHFHSA-N 469.546 0.508 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1782729848 VACZXAUQFNWDJE-FQEVSTJZSA-N 451.365 0.998 50 20 JCGD O=C1C[C@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)CN1 1783168227 PTHOQILKHPUNKO-FVJLSDCUSA-N 464.360 0.959 50 20 JCGD CCN1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)CC1 1783298367 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499.612 0.880 50 20 JCGD CCc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c1Br 1792976273 BCWALLHKTBCFFS-QPPBUOOMSA-N 463.760 0.548 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1794249784 VFLAXIZZDGMURX-FQUUOJAGSA-N 495.378 0.103 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(S(C)(=O)=O)c1 1794321190 NCFBJJFOTWLRQI-ZFHGCVPZSA-N 464.371 0.925 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(F)cc3)CC1)C2)c1cccc(B(O)O)c1 1795737225 HIMHOUOWDYNLPJ-UPHUGPLXSA-N 452.291 0.441 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1796028204 NSKBHECCSYBQNY-BASYENTBSA-N 489.577 0.179 50 20 JCGD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c([N+](=O)[O-])cc1O 1796188403 AADQWSZHROPKNM-MUJYYYPQSA-N 469.259 0.554 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc(-c2cccnc2)n1 1796484893 LQERKRJUBWIIMS-CWPLJXCYSA-N 472.571 0.781 50 20 JCGD C#CCO[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798521731 YGOMQYXSRQIQPG-BCEDRHLLSA-N 459.455 0.762 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1798874665 QWXFIMYCWSINCD-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC1(F)F)C2)NC(=O)NCc1ccccc1 1799097630 QYVPXXVILXIKQJ-SFNKJDCFSA-N 465.501 0.577 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799341976 AYZOBXIVSOITMX-FPYNETTCSA-N 468.320 0.152 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2 1800975821 UYHBAXHHQPUDRC-FSDCSDTHSA-N 459.952 0.083 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cc1cccc(F)c1)NC(C)=O)C2 1800982296 BXDMIGFSQOPUDI-QQXMDYFESA-N 469.941 0.716 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801010816 VXBFEBQEKPPATP-SRYPRDQNSA-N 487.601 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2 1802337807 ARISIBZPXMXXTD-YVSFHVDLSA-N 469.583 0.273 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(=O)oc2)[C@H]1c1cccnc1 1806120454 OVZOVQMCMCZJQP-MGPUTAFESA-N 462.466 0.667 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807359636 KTPQQMWVQWEEOT-DENIHFKCSA-N 461.331 0.745 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)C1 1809977456 HEWYSBAYQVQJOZ-MOPGFXCFSA-N 456.348 0.801 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@H]1c1cccnc1 1813071647 WBFVNNHDGBUPAJ-CYFREDJKSA-N 472.590 0.863 50 20 JCGD CC(C)(NCCC#N)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1817318284 QPMHYZSITFFXKJ-KRWDZBQOSA-N 467.534 0.996 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817471176 CLTNADAEQWZOKN-FUHWJXTLSA-N 468.348 0.422 50 20 JCGD O=C(CSc1ncccn1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1817592499 INEBBFCTDPYUPD-KRWDZBQOSA-N 466.332 0.978 50 20 JCGD CSCC[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800325 NBRCNPSOEMQKNM-YGRLFVJLSA-N 464.573 0.481 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800336 NFRATXTVTMJLQK-GHMZBOCLSA-N 476.515 0.929 50 20 JCGD C[C@@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1 1820868470 JAYYLIYDUSQMKC-RDTXWAMCSA-N 450.367 0.925 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@@](C)(O)CC(=O)O)n[nH]1 1822414851 USQVOZBMLWWLKF-VBKZILBWSA-N 452.512 0.391 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](F)Cl)CC3)N1 1824807734 BVYUXKIUIKLCON-KMUQISDUSA-N 489.982 0.770 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CSCC(=O)O)sc2C1 1826114492 UPLXFHRGGKBWMA-SECBINFHSA-N 464.529 0.185 50 20 JCGD CNc1nsnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827048875 BAZZVBBNWGTLTJ-QGZVFWFLSA-N 457.365 0.807 50 20 JCGD O=C(c1cnc(O)[nH]1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829153234 ZPFQDRYWFNBPSM-JTSKRJEESA-N 491.932 0.781 50 20 JCGD CN1CCN(C2(C(=O)N3CCOC[C@@]4(CN(C(=O)C(C)(C)CCl)CCO4)C3)CC2)CC1 1830364024 XSPAWTUMHYOMPP-OAQYLSRUSA-N 457.015 0.488 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)cn2[nH]cnc(=O)c12 1830364178 AVRLTQWPXRGENZ-NRFANRHFSA-N 465.938 0.666 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830735018 CBIGOXVHWYZLPK-MRNZGAJFSA-N 487.981 0.155 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830738061 LCZWWTFPKYOGNY-WSOZGMELSA-N 475.970 0.346 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1831649915 CMMSHGNTQNYQOM-QVKFZJNVSA-N 467.954 0.494 50 20 JCGD Cc1nn(C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549639 VWAYMWZSWNYIGU-HTAPYJJXSA-N 499.996 0.931 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc(Cl)nc1 1833010593 MGOIGZHIFOEOPP-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3C(N)=O)CCO2)C1 1833316444 PIRNSMAJMLKISG-LIRRHRJNSA-N 469.336 0.424 50 20 JCGD CN1CCC(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1835734447 JGWYUTGXHSMCOP-UHFFFAOYSA-N 471.606 0.212 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)on1 1835737029 IKNDVMJTZPNJTR-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)ccn1 1835916285 JPSLJXNFFRARSF-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ncc(Cl)cc3Cl)C2)C1 1835925967 DZKJXSYBZAOMQP-NRFANRHFSA-N 494.140 0.452 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(Cl)c1 1835941833 RBBOFHGJRXMBCR-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2)C1 1836473382 FVFGTAASFDBQHZ-TYILLQQXSA-N 494.383 0.112 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1 1836694322 CULYLHZZIAULOV-XMMPIXPASA-N 494.564 0.596 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1 1837459577 KVCIQXOPAVJHDZ-JOCHJYFZSA-N 475.452 0.347 50 20 JCGD CCc1ncsc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460262 YRFWRXFQJQSAHH-OAQYLSRUSA-N 474.543 0.088 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)N1CSCSC1 1837569553 MARJGZVCUVQDCS-JKIFEVAISA-N 454.014 0.086 50 20 JCGD Nc1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1837899078 CJRAACPWBHSGLW-UHFFFAOYSA-N 458.349 0.331 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCC(=O)N3C)CC2)CC1 1838103254 ULJAYQCKLBMJRG-NTRYICDMSA-N 486.573 0.740 50 20 JCGD COCCn1nccc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838137190 WZEZLBLLQDYNEP-UHFFFAOYSA-N 499.572 0.454 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)no3)CC2)CC1 1838394537 HECFSIRQLCOOLR-UHFFFAOYSA-N 458.475 0.305 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1839148679 GFLROBRBMXNGPY-TXXWUTRGSA-N 489.997 0.831 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1839149951 XDCMVOHLGKIVKG-ZWKOTPCHSA-N 454.420 0.728 50 20 JCGD N[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)c1cccnc1 1839199104 JMEPQNNQJDQRNY-HFTRVMKXSA-N 459.316 0.618 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c2ccccc21 1839201295 UGPJIVQJNXGUKE-PXNSSMCTSA-N 499.337 0.487 50 20 JCGD O=C(c1ccc(Br)cc1O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839268483 SZPZECITGCJRIQ-MAUKXSAKSA-N 477.739 0.824 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cccnn3c1)CCO2 1839560402 OJKUKCCWLYYHII-FXZATJRASA-N 493.524 0.538 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4)CCO2)C1 1839574434 JQMGQNUAKNISTK-HRAATJIYSA-N 451.907 0.505 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1840034919 AUOWTIBQAWIMKV-ACJLOTCBSA-N 457.325 0.355 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1 1840036951 TZYMWARLPSKPCF-ORAYPTAESA-N 454.321 0.639 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1 1840152730 RGZFIGRDUATUJJ-MGPUTAFESA-N 451.911 0.362 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1840156175 ORQDNMNNBSRWHV-PGRDOPGGSA-N 466.966 0.094 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1840381393 IWMWHAUVFWEEQJ-LRDDRELGSA-N 462.370 0.527 50 20 JCGD Cc1cc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840777289 PPZDETDWKGAGNF-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840881734 LJCFXPOMQVRCEQ-WSOZGMELSA-N 475.970 0.346 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1 1841924690 REAMRMQUDVNWOJ-LSDHHAIUSA-N 460.959 0.473 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010498 VVIQHTKQOSMPPG-LJQANCHMSA-N 471.363 0.973 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)C1CC1 1843012931 UIDBUBUFCVRLEM-UHFFFAOYSA-N 457.336 0.583 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)CO2)C1 1846120278 LGKZYJVTZWXSHU-SFHVURJKSA-N 499.373 0.209 50 20 JCGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C)C1 1846331387 SQDLCNLVQBGHIA-GJZGRUSLSA-N 496.026 0.772 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCc2nc3ccccc3c(=O)[nH]2)cc1OC 8953534 ZEBWXFWCYHTRJF-UHFFFAOYSA-N 454.439 0.877 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccccn1 14049430 LHDAHDSXCJTVMN-IDKBZEPQSA-N 466.541 0.236 50 20 JCGD CCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 15736957 KTVIXFUPJABQDK-UHFFFAOYSA-N 469.541 0.730 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)N[C@H](C)c1nc(C)no1)N(S(C)(=O)=O)CC2 726277617 CTRDOFREGOOPPY-IAQYHMDHSA-N 496.546 0.736 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N[C@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)N(C)c2ccccc21 728698318 OBFGXURHEONSIE-FXAWDEMLSA-N 487.582 0.271 50 20 JCGD O=C(NNC(=O)c1cnn[nH]1)c1cccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c1 729455721 VUVVYFKUMKEWNA-UHFFFAOYSA-N 473.490 0.530 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)NCCOc2ccccc2)ccc1Cl)c1cnn[nH]1 729455873 DYYYOKUJNNVJKZ-UHFFFAOYSA-N 464.891 0.890 50 20 JCGD COc1c(F)cc(Br)cc1S(=O)(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 730765658 DONZEXMEZFLLPG-MRVPVSSYSA-N 460.303 0.276 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cc2S1(=O)=O 916745702 HKWPWGUBMVZMJV-UHFFFAOYSA-N 469.479 0.942 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)COc2ccc(F)cc2)CC1 918138414 QTIBMPUTMCBGFE-UHFFFAOYSA-N 453.471 0.614 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCCCn1ccnc1 918139773 XZABZMSUYPQJTP-UHFFFAOYSA-N 478.575 0.647 50 20 JCGD COC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 920309443 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CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](COC)NC(C)=O)C1 1779559548 JFFQLIQTKROZDI-WFXMFSGNSA-N 462.385 0.825 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1C 1780781158 ALUQRXMWVZGYID-QHCPKHFHSA-N 453.499 0.759 50 20 JCGD CC1CCN(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)CC1 1782210251 JZEFGUNIFFMCRB-AUSIDOKSSA-N 451.612 0.605 50 20 JCGD C[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)Oc1ccccc1 1782879888 SBEIZAJJKYZBSV-XDHUDOTRSA-N 467.526 0.986 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(F)cc3F)C2)C1 1783378081 TXFSCBKCCYZQTB-JOCHJYFZSA-N 459.453 0.650 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2 1783877391 XZRCNERYHQNVMF-STXHMFSFSA-N 462.975 0.312 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc([N+](=O)[O-])c1OC 1783934308 CYFODPUSCSDMMM-QFIPXVFZSA-N 493.517 0.429 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(=O)Nc4ccccc4)CC3)[C@H]2C1 1784556357 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C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1834793557 DETBWPLUMNGROQ-CYBMUJFWSA-N 494.394 0.634 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1 1835081392 OLKWOOMQRCWCKX-GOEBONIOSA-N 450.939 0.936 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1835754382 JLBQTZJRHUSLQK-SJORKVTESA-N 494.358 0.743 50 20 JCGD CCC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)n1cccc1 1835928579 RKKKGUGEWRHTDH-ZJSXRUAMSA-N 469.347 0.279 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@H]1SC(=N)NC1=O 1836718088 RQOPMYYADRUGMR-NILFDRSVSA-N 460.984 0.387 50 20 JCGD CO[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccc1 1837456132 CRDZBYOMCORQQY-YKSBVNFPSA-N 483.525 0.143 50 20 JCGD Cc1c(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cnn1C 1837543562 YCHWFHDQRNHXOF-UHFFFAOYSA-N 454.336 0.334 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837630267 NJSWKPSTDFJBCB-CXAGYDPISA-N 459.272 0.167 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838353182 GRMLGXOYBZQOIJ-PGRDOPGGSA-N 483.949 0.309 50 20 JCGD CSCC[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838395327 CTUALHNYLNYKQU-LJQANCHMSA-N 479.603 0.411 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C#N)cc(OC)c3)CCO2)C1 1838583509 HGPIULJIJXYLHH-WIYYLYMNSA-N 451.907 0.891 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839219043 RVZSMFVFCLNLEP-OSPHWJPCSA-N 483.525 0.223 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839764891 NRTYGSCRALWIEC-CJAUYULYSA-N 484.333 0.454 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1839928753 LTWULTDTMAGQMC-DFBJGRDBSA-N 466.343 0.630 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)CCO2 1840059689 MSLBQQPHTVJPQL-VLMPBXDWSA-N 489.997 0.831 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1840083887 GDBJHOFDIFILJY-JDSQYFAJSA-N 456.898 0.904 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)C2)C1 1840150233 IBFQKUFWMZLCST-VLIAUNLRSA-N 472.926 0.486 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)[S@@](=O)c3ccccc3)C2)C1 1840155554 DZKLBLSOFSIDPK-IDDVCLSOSA-N 472.991 0.893 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2 1840156916 YAKIIRZWQYWMAR-JLHGSKIFSA-N 487.981 0.613 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccs3)C2)C1 1840183462 FXYMIZHTPQBXCB-NRFANRHFSA-N 452.577 0.510 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc(OC)c1C 1840755536 ZRXKEPBFCRUHML-IERDGZPVSA-N 456.923 0.682 50 20 JCGD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1841690916 CDULDFHXVZKZOM-QFBILLFUSA-N 487.362 0.208 50 20 JCGD CC(C)(C)OC(=O)N1Cc2[nH]nc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)c2C1 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0.759 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CS(C)(=O)=O)CCO2 1831452212 NAYOCNFJBCKZHB-CPUCHLNUSA-N 469.398 0.155 50 20 JCGD O=C(CN1CCc2sccc2C1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832586898 XOCVBNKMZMTKBY-OXJNMPFZSA-N 457.980 0.162 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1834329134 UHPKPFOHADLLAR-MRXNPFEDSA-N 495.422 0.985 50 20 JCGD Cc1nc(N)sc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1834755801 XUKHDBKRUOXWKF-UHFFFAOYSA-N 465.624 0.592 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CNc4ccccc43)CC2)CC1)c1cccc(B(O)O)c1 1834801072 NBBCFYYCYLHHDM-QHCPKHFHSA-N 476.386 0.761 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccn4nccc4c3)CC2)CC1 1835737794 ANGBBLOCQFJLCA-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1Cl 1835926150 HOLQIWPZMJFOFJ-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1837710288 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COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=C4c5ccccc5C(=O)N4CC3)C2)C1 1840154021 ICYZHBGQHYXNJI-CYFREDJKSA-N 489.956 0.967 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1 1840154665 BYDJTIPZPPWXHO-RXVVDRJESA-N 463.922 0.591 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c12 1840185725 WBZQDCHALCJGRP-XMMPIXPASA-N 487.557 0.620 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c(C)n2n1 1840187744 UBAMDWODYHSYSA-SFHVURJKSA-N 457.318 0.615 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCSC)CCO2 1840200356 DZLWRUWUCWDDQT-JJRVBVJISA-N 453.399 0.730 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C3=COCC3)CCO2)C1 1840558773 MTAYBCCWOJGSOZ-KKSFZXQISA-N 473.954 0.879 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1840715247 VDLSBAZCOBSCPP-SSOJOUAXSA-N 492.536 0.696 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)c2C1 1841351342 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UVBKHFCOZIOZCX-SREVYHEPSA-N 467.456 0.223 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)[C@H](C)O)cc1C 777289187 CGOGOSACUKTXIF-IFXJQAMLSA-N 497.957 0.989 50 20 JCGD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)C1 807136234 YBWPDPINHICJJW-IRXDYDNUSA-N 469.550 0.139 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)cc1 913429624 OARHGZQLMQUWPI-UHFFFAOYSA-N 471.333 0.996 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1sccc1-n1cnnn1 915274251 UAQAFVKEWQSTMY-UHFFFAOYSA-N 491.555 0.139 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(O)c(O)c1)c(=O)n2Cc1ccccc1 916333262 HFZJTRMCMLRAQL-UHFFFAOYSA-N 492.492 0.616 50 20 JCGD CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)COc3ccccc3C#N)cc2)CC1 916391010 WPNNWRWMYRBGGR-UHFFFAOYSA-N 450.499 0.855 50 20 JCGD O=C(NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)NNC(=O)[C@H]1COc2ccccc2O1 916649099 IJUDMXKPOHSYSS-OXQOHEQNSA-N 490.538 0.814 50 20 JCGD NS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)c1 917755520 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CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C[C@@H]1CCCN1C(=O)OC(C)(C)C)CCO2 1783933205 DYTSJHGZKWGKHY-MHECFPHRSA-N 495.621 0.979 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cn3ccc(Cl)cc3n1)CCO2 1783934345 FDRCGIWHSBKUIK-OAQYLSRUSA-N 462.938 0.804 50 20 JCGD O=C(CN1C(=O)COc2ccc(Cl)cc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1784965056 LEZLHQVADIUZNV-GKEYINFOSA-N 486.352 0.645 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(Br)cn3)[C@H]2C1 1785383015 SEBATLYFCSKYKF-WBAXXEDZSA-N 496.406 0.739 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(=O)O)ncn3)[C@H]2C1 1785643583 OLCNKEKMSSCZIW-ASHKBJFXSA-N 455.309 0.942 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(C)n[nH]c3C)C[C@@H]21 1787507587 GIFZXCBCYHXEFY-ZCQORZAUSA-N 469.546 0.683 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)Nc3cccnc3)C[C@@H]21 1787508882 ZXBCQULXVUTRBG-VOVAKLSQSA-N 481.513 0.134 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)c4ccccc4o3)C[C@@H]21 1788607731 CBQUCWVBWSNEKK-SDYXESRWSA-N 491.504 0.699 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(C)c1 1789675255 MRLVKTDJFBNXBG-JHVJFLLYSA-N 467.526 0.909 50 20 JCGD Cn1cc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)ccc2n1 1790351838 JGMJCLUYFTZXTB-XJABCFGWSA-N 462.315 0.160 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(c2ccccc2)CC1 1792906428 AOFSITKKPMLLCF-BBIADKPPSA-N 492.580 0.805 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792982363 AYBOGBIOPGBHJG-ZHCJQAHYSA-N 459.971 0.965 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl 1793117938 LFNHSOIUVJDZAH-XLWJZTARSA-N 461.943 0.681 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1793471798 UAGCCAKVDGYHEU-CWPLJXCYSA-N 490.513 0.886 50 20 JCGD CCn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c2ccccc21 1796021673 WVRVFRWKHMYOTG-UPHUGPLXSA-N 462.315 0.253 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc(Br)n1 1796691200 UHNABYLOQURNSH-WDAIWFPHSA-N 495.359 0.421 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc([N+](=O)[O-])c(OC)c1 1799252334 ZYZWMOWGZIEXHF-NXEZDXNNSA-N 455.895 0.989 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)C2 1799268425 SIHDCRNMHQCHCY-DBWAAGBOSA-N 459.971 0.821 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])c2c1OCO2)c1ccc(B(O)O)cc1 1799344083 NEVSSEYFPIXUGB-MUJYYYPQSA-N 467.243 0.569 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccccc1O 1800567394 UPFVFBNIWGTOFY-QCIWSRGXSA-N 453.499 0.658 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)Cl)NC(=O)NCc1ccccc1 1801154501 YNRKBOMHJVBXSZ-SCAQPMJSSA-N 473.908 0.754 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)n1cnnn1 1801438985 QHGZFDYUIQQRDR-SOVHRIKKSA-N 477.363 0.830 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1CCC(CO)CC1 1804217609 RJJSKPLQYMNJQF-ZDNGABSWSA-N 465.359 0.880 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C2CCC(CO)CC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369857 XJLYSHXCJQAKCS-XTNJDMASSA-N 465.359 0.880 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375445 OYBHYULFFIQCLG-FXAWDEMLSA-N 474.282 0.519 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CNC(=O)c2ccco2)[C@H]1c1cccnc1 1807591214 OBEBYEDFSBKCII-IIBYNOLFSA-N 491.508 0.423 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1 1810303259 RLSQYSRRWFYQCB-HRAATJIYSA-N 490.524 0.902 50 20 JCGD Cn1ncc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1Cl 1811168122 PYXWQRJAALITHR-VQIMIIECSA-N 467.722 0.782 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1 1811194262 UGDSONWMRUFLRE-PXNSSMCTSA-N 461.482 0.347 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1 1812142790 YSNFSTCWZAYULB-IERDGZPVSA-N 474.525 0.856 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1812864674 JZPAGTCEDJOBGO-DETPVDSQSA-N 452.309 0.423 50 20 JCGD O=C(CNC(=O)c1cccs1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336754 BXYIBOJSZSSRSE-CQSZACIVSA-N 484.368 0.540 50 20 JCGD CN(C)c1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nc1 1815355145 OUYACQRHKYHDCY-OAHLLOKOSA-N 465.344 0.824 50 20 JCGD CCc1[nH]nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1F 1815355178 QQYKEJRUQRNDHR-LBPRGKRZSA-N 457.296 0.787 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2cc(Cl)cn2)[nH]n1)c1ccc(B(O)O)cc1 1817471226 HSOMBOFECUMGTL-KRWDZBQOSA-N 456.699 0.946 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1819355078 IWGABOPRNHUQQG-ZFWWWQNUSA-N 450.544 0.482 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)COc2cccnn2)[nH]n1 1819404294 GGMVFGCMEBKTKY-INIZCTEOSA-N 465.474 0.583 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733489 NLBRMQHBANYRCH-KXBFYZLASA-N 459.858 0.712 50 20 JCGD O=C1CCCCN1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1831765811 UGYUKXYMUABGMW-OAQYLSRUSA-N 455.364 0.612 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCCS2(=O)=O)CC1 1831874928 ORBQUNBNVFRQRC-QZTJIDSGSA-N 456.609 0.556 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1834797312 CFXRTJLETSVFNE-UHFFFAOYSA-N 481.406 0.817 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798508 DPUXFOWOEXSLDF-UHFFFAOYSA-N 490.373 0.217 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c(C4CC4)c3F)CC2)CC1)c1cccc(B(O)O)c1 1834800025 QJHYYBLYFROMCU-UHFFFAOYSA-N 483.353 0.605 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1 1834818970 GSRCYJWABPDPMO-SFHVURJKSA-N 490.376 0.340 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@@H](N)c1cccnc1)CCO2 1835833120 DTFOXZWHMISYSL-WIYYLYMNSA-N 450.612 0.779 50 20 JCGD CCOc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)cnc2c1cnn2C 1836377940 CKAOSHCXJCVNHX-JTSKRJEESA-N 495.964 0.691 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1837178359 RXLNUUKFUBZUEE-UHFFFAOYSA-N 468.363 0.492 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccsc3)C2)C1 1837456429 HUFHIYKACIZWEQ-RDUCDJESSA-N 471.539 0.530 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ncsc3[nH]1)CCO2 1837754204 UBHWZZSUUNITII-HXUWFJFHSA-N 464.548 0.067 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCSC(=N)N)CC2)CC1 1837864995 HLJFARHQZGWAPK-UHFFFAOYSA-N 456.613 0.375 50 20 JCGD CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)n(C)n1 1838042467 YOPNKNJKPIPPQE-DZQSVEARSA-N 485.545 0.187 50 20 JCGD Cc1ncncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1838089132 FZPHPGOXCVZANP-JTSKRJEESA-N 497.980 0.987 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)CC2)CC1 1838395431 PSWSXNYKYQUOMN-INIZCTEOSA-N 495.584 0.826 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(C#N)c1)CCO2 1838906725 BUZDWLMVWDHRBK-FXZATJRASA-N 478.509 0.762 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cc1)CCO2 1838958474 BRMLUMNFDCIOAN-JOCHJYFZSA-N 458.707 0.404 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(OC)cc3C#N)CCO2)C1 1839132294 CMSGFIRFCZKDLU-UGKGYDQZSA-N 465.934 0.820 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CCO2 1839388241 LLCLKNJJWBUSES-LXIYXOSZSA-N 480.356 0.069 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622546 JUWPAHHPBWULEB-DYESRHJHSA-N 469.970 0.042 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CS(C)(=O)=O)C2)C1 1839962658 NBBVSMHYAUZUCJ-JKIFEVAISA-N 469.398 0.297 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1 1840035195 JMIAKBRHHUQWOW-KPZWWZAWSA-N 452.309 0.811 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)(C)C)n[nH]3)C2)C1 1840185323 KXPUCBGQDUYSCZ-JOCHJYFZSA-N 464.567 0.150 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)C2)C1 1840185907 ZXSFEUASZOKDCI-DEOSSOPVSA-N 498.621 0.574 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(NC(C)=O)cc3)CCO2)C1 1840728106 LAPWMBIAWQFTNR-NQIIRXRSSA-N 453.923 0.969 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1nc[nH]c1[N+](=O)[O-])C2)NC(=O)NCc1ccccc1 1845038812 WLPBJAXCLPLDIZ-UHFFFAOYSA-N 470.490 0.481 50 20 JCGD COCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)OCC(=O)NNC(=O)c1ccccc1 19420071 CRQLMAYTMKOQJO-DEOSSOPVSA-N 480.477 0.616 50 20 JCGD Cc1cccc2c(=O)n(CC(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cnc12 728213012 AFGOMUNBHHNADT-UHFFFAOYSA-N 470.555 0.784 50 20 JCGD Cc1sc2nc(CS[C@@H](C)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)nc(O)c2c1C 729276362 DEDGEIPHTOXREI-SCZZXKLOSA-N 461.591 0.721 50 20 JCGD CC(=O)N1CCC(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1 729624376 UAGOTNILSAAXBB-UHFFFAOYSA-N 451.549 0.674 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2ccc(N3CCCC3=O)cc2)ccc1Cl 731053157 IAPOJCTXXHYKFZ-UHFFFAOYSA-N 472.932 0.738 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1)C(=O)N1CCCC1 748246948 GQYDGRSAZIAUGK-CQSZACIVSA-N 473.349 0.372 50 20 JCGD Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1 769421760 AIMMQHORPWVIEV-LLVKDONJSA-N 475.321 0.947 50 20 JCGD Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 916136057 FQFMKSSTFBGXQF-INIZCTEOSA-N 460.495 0.659 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)c1 916577686 BOUSYXPKACOGLZ-LBPRGKRZSA-N 451.471 0.765 50 20 JCGD O=C(NCCCCn1ccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 918138916 DVHSUKWABCCMOK-UHFFFAOYSA-N 450.521 0.328 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1)N[C@@H]1CCS(=O)(=O)C1 919886716 ZCSQACAODLAXNM-GFCCVEGCSA-N 496.970 0.397 50 20 JCGD O=C(NNC(=O)c1ccccc1CS(=O)(=O)c1ccccc1)N[C@@H]1CCS(=O)(=O)C1 1318356202 HABIUEBURKQQES-OAHLLOKOSA-N 451.526 0.792 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)CC1 1778092431 ASRNUVFNCCDIBV-SJUPTTPXSA-N 487.557 0.978 50 20 JCGD Cn1ncc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)ccc21 1778708696 AUSYWRVNCWELFS-RCZVLFRGSA-N 476.342 0.694 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccco4)no3)CCO2)C1 1779030764 WVKGUEJFESXBCO-JOCHJYFZSA-N 466.454 0.690 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc(C)c1O 1779034555 RAGPPTBKAQPYLN-HSZRJFAPSA-N 453.499 0.765 50 20 JCGD Cc1ccn2c(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cnc2c1 1779037377 YMOQQZAEZHGUGS-QHCPKHFHSA-N 463.498 0.399 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1779073552 QEOLXFREEAOQEH-XEZPLFJOSA-N 453.261 0.002 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)c3cc(C)on3)C2)C1 1779126617 QNPFRNAGJCCYKW-UGSOOPFHSA-N 457.325 0.716 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)N(C)C(=O)OC(C)(C)C 1781037577 GTTANIBYKLFBQZ-MWTRTKDXSA-N 475.351 0.065 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(N4CCOCC4)n3)CCO2)C1 1783876042 UNPMLAAYQSHIKQ-IIBYNOLFSA-N 452.939 0.616 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc(OC)c1C 1785176626 ZHMAHJGZEOMVFM-XMMPIXPASA-N 468.315 0.449 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@H](N)C(N)=O)[C@H]2C1 1786893125 YSOSTVWCYFXDAI-KNTDACPZSA-N 475.496 0.444 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)on3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978629 FXQHBCKYJJGSLI-LEDOBFOHSA-N 475.310 0.929 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@@H]21)c1cccc(B(O)O)c1 1786982271 VWBCHPNUQJLMQV-YYWHXJBOSA-N 467.287 0.111 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3Cl)C[C@@H]21 1788611087 LIGXBDIAAPYSTI-SOUCHZLYSA-N 487.944 0.665 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)n[nH]1 1789726643 INDAIOHWACMMSK-BVSLBCMMSA-N 497.600 0.587 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21)[C@H](F)Br 1789922505 GYFMBIMCDUBISZ-ABHRYQDASA-N 470.361 0.082 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1789929160 JCBNDDUZFZHKFJ-YYFQZIEXSA-N 496.374 0.932 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1CCCN1Cc1ccccc1 1791466229 FCFFORPNFVVQJY-LFBFJMOVSA-N 491.397 0.624 50 20 JCGD CC(C)(C)OC(=O)CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793022618 OBYAGTVBRTWNMS-UPHUGPLXSA-N 460.336 0.082 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1793865378 ZFHDERGKGDWSBW-FCGDIQPGSA-N 457.336 0.628 50 20 JCGD Cc1noc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1 1795813816 UTGRHGCCQWYVJP-LOUJCGABSA-N 471.942 0.642 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796368022 AGMLCKXJNVTSAN-GBTLNWJISA-N 475.945 0.869 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N(C)C)nc1)C2 1796441355 CRSRYBTVIIZFQD-KEMUROEHSA-N 467.530 0.485 50 20 JCGD Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)ccc1C(F)(F)F 1796710538 DJJAGVIEVKCPTB-DPIQGUFMSA-N 480.447 0.559 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1csc2c1CCCC2 1797391496 KUFYXAREXDKXMO-VPTLXERWSA-N 454.357 0.824 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc(Cl)n1)C2 1797751706 PTSDIVROORGBAC-YQYWCBKUSA-N 479.324 0.904 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)n(-c2cccc(=O)n2C)n1 1797954857 LZHMVMLORJNSBZ-FAQVEIGNSA-N 487.633 0.934 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)ccc21 1798440368 KTDMJTUGPHLOAI-MUJYYYPQSA-N 477.525 0.441 50 20 JCGD CSc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1O 1798562366 FLBASKGPMLJRNO-CCWDJLKJSA-N 456.329 0.311 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CO)o1)C2)NC(=O)NCc1ccccc1 1799097577 PNYWUIAWLSZTSC-OPMZPASUSA-N 485.541 0.321 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)c(F)cc1F 1799513319 QPOPVCLFDPZEKL-XGISUXEOSA-N 463.416 0.619 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1800640067 UGBWOMSGSRUQGE-IQOUGMIPSA-N 475.365 0.215 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1CCC(CO)CC1 1804216845 PXHLHOGRBSHDMD-KUYBLMILSA-N 465.359 0.880 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(-n3ccnc3)ccn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361624 SGMYDJFLDOPOKU-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD Cn1cc(CCC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1807362185 FKLMVXCWZWVFQJ-OFNKIYASSA-N 461.331 0.447 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CC[C@@H]2CCOC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363765 BKVOOZNTKFZBMT-MONBJTKQSA-N 451.332 0.898 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365716 MAOQTHOGQGOOJC-AVRDEDQJSA-N 470.298 0.666 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1807373619 UHFAAVPSBPYMFV-IEBWSBKVSA-N 451.288 0.034 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccccc2-n2nccn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374259 YLFUZKCABMGUFK-HYBUGGRVSA-N 496.336 0.976 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CNC(=O)c2ccco2)[C@H]1c1cccnc1 1807597639 VFTJCEHDZHFXOV-VGOFRKELSA-N 470.530 0.483 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1 1809988171 UOIBFLRMHURGBD-KKSFZXQISA-N 474.525 0.856 50 20 JCGD O=C(NCC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)c1ccco1 1810136330 BQDXJANDEALZMT-UHFFFAOYSA-N 453.304 0.234 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1810156840 IRTGEOANWZDWCM-GWGVIPHVSA-N 462.359 0.421 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1 1810302015 DNXMKXHRIDCPBD-HRAATJIYSA-N 485.508 0.756 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1 1812353225 MDFJZGJPBQGATL-OPAMFIHVSA-N 471.518 0.035 50 20 JCGD CCC1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)COC1 1812490356 MMVQIHXOEWDTGD-APWZRJJASA-N 452.515 0.826 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1F 1813071861 YSYWSMOTYHPINB-UZLBHIALSA-N 459.526 0.955 50 20 JCGD C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1 1814779995 CXXBIISEVNTEDK-BXKDBHETSA-N 478.311 0.873 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1ccc(B(O)O)cc1 1815343947 YNSNHLJAKCUGHR-ZWNOBZJWSA-N 456.102 0.739 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1 1819029978 POGFKMOVDLUEDJ-GFCCVEGCSA-N 456.532 0.785 50 20 JCGD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)cn2[nH]cnc(=O)c12 1822414753 LHCDANWGXIRTHR-MRXNPFEDSA-N 483.533 0.733 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)sc2C1 1822628855 AYDHOTREPXZCEN-RBSFLKMASA-N 476.603 0.829 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2 1823032271 QMRGOBFJVIOILQ-WZRBSPASSA-N 476.983 0.931 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1 1824186207 PFAZFQDLURNJPH-GUDVDZBRSA-N 453.971 0.676 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CNC(=O)C3)sc2C1)NC(=O)NCc1ccccc1 1825203896 DGKHJANARXSVBO-HOTGVXAUSA-N 499.597 0.537 50 20 JCGD CC(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1828792034 JFYJSBBZHDMPHE-RUZDIDTESA-N 493.325 0.021 50 20 JCGD C[C@@H](Br)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](N)CN)C2)C1 1829330718 PEHLKTFZTONBLS-KUDFPVQQSA-N 496.406 0.508 50 20 JCGD CN1CC(C(=O)N2CCN(C(=O)OCc3ccccc3)[C@]3(CCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1829415931 NNHXIZNDFMEMMW-CVDCTZTESA-N 478.977 0.600 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCCc3ccccc3F)CCO2)C1 1830696090 UUBHHQVGCWPWSN-RUZDIDTESA-N 499.543 0.917 50 20 JCGD O=C(CCCN1C(=O)c2ccccc2C1=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724747 BJUHWWVWJVBWGG-MBSDFSHPSA-N 493.944 0.119 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830730748 CSMKKLGGORWIBF-FAPUVCABSA-N 493.960 0.390 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830738424 OTZCUPQCXKMBFU-JKSBSHDWSA-N 492.013 0.839 50 20 JCGD Cc1ncc(Br)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833394340 SFTIOSMWGWVIMG-YJBOKZPZSA-N 476.755 0.822 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCN3C(=O)C=CC3=O)CC2)CC1 1833615992 PTDWCIDALKMBHT-CQSZACIVSA-N 469.380 0.657 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833885958 PQXCQDRFTZMHTR-SFHVURJKSA-N 467.379 0.084 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)s1)CCO2 1834058790 KBSMOUSZYKPPLH-LJQANCHMSA-N 458.968 0.845 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cscn1)CCO2 1834254154 NMAJULKPYFVXOU-BTVXTAIASA-N 460.516 0.347 50 20 JCGD Cc1noc(C)c1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797374 HHEASSQSVDHXGE-UHFFFAOYSA-N 454.336 0.470 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2 1834823055 GYDCTVXHADGUDG-CLBJDOSESA-N 462.341 0.757 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)Cc3cccnc3)CC2)CC1 1835097821 UALBDTDCENNIBH-UXHICEINSA-N 451.999 0.777 50 20 JCGD C[C@H](Nc1nccs1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835107286 SMNIGVDDGFIWDZ-INIZCTEOSA-N 485.419 0.509 50 20 JCGD O=C(CS[C@@H]1CCCCO1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835756683 JJLSDWAVDOVQHM-HSZRJFAPSA-N 489.447 0.811 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836780726 GYRAPHBYEPETQB-XOBRGWDASA-N 453.927 0.104 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CS(C)(=O)=O)CC2)CC1 1836875422 IPJCSLVEQXIKLY-PBHICJAKSA-N 453.001 0.920 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836931781 VUHRPQUXIPRYDF-UHFFFAOYSA-N 488.589 0.460 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1837079626 UQMKPNACRLSCNK-HXUWFJFHSA-N 498.473 0.952 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)C2)C1 1837456705 PYVNXKLQAQLPLL-DFIYOIEZSA-N 497.527 0.698 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1837710305 ULXDDAGQQKNAKJ-NRFANRHFSA-N 464.595 0.119 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1 1837715527 VOHJIRRGNPAJHR-JOCHJYFZSA-N 452.624 0.993 50 20 JCGD Cn1nc2c(c1C(=O)N1CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C1)CCC2 1837715710 FVHCCXJXHVSTDJ-OAQYLSRUSA-N 450.612 0.830 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H](O)c3ccccc3)CC2)CC1 1837779405 QLHSCMFZWQATST-HSZRJFAPSA-N 466.343 0.712 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ncccc1C(F)(F)F)CCO2 1838142442 WLVCWKSRCRRNJB-NRFANRHFSA-N 493.247 0.164 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cccc1Cl)CCO2 1838870521 YJYKCNFEBACFSL-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD C#CCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054715 JTBMCMRXCANEHY-XMMPIXPASA-N 471.558 0.202 50 20 JCGD CN(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc1 1839197859 KEZZBAZVPBPNDQ-YJBOKZPZSA-N 459.316 0.908 50 20 JCGD O=C(c1ccnc(Cl)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200065 CPYHKCLGRUACDP-NHYWBVRUSA-N 451.680 0.891 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C#N)ccc1F)CCO2 1839420353 DIUDTJKTALRPPU-BATDETSNSA-N 496.499 0.901 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2 1839957853 JJDYKDDPWDOUMW-YLJYHZDGSA-N 455.349 0.831 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(O)nc3O)C2)C1 1839964414 QTMYGYFLEWCELN-SJCJKPOMSA-N 459.297 0.131 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1839966214 XSHAXAORAPQJJD-DJJJIMSYSA-N 499.387 1.000 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn2[nH]cnc(=O)c12 1840034306 HQDWDEMGWIMNOJ-YJYMSZOUSA-N 482.335 0.184 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CSC3CCCC3)C2)C1 1840182985 XZMREMFLDCDUPW-OAQYLSRUSA-N 456.609 0.492 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)C(F)(F)F)CCO2)C1 1840201717 ZHKAROINKBPHRK-XHDPSFHLSA-N 474.274 0.152 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3NC(C)=O)CCO2)C1 1840724683 FIMHMTXVVNJXTL-UTKZUKDTSA-N 453.923 0.969 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C[C@H]2C[C@H]21 1840912466 FZSYNBASZHZHRU-NZYYMUPHSA-N 487.981 0.440 50 20 JCGD O=C(c1cnc2ccc(Br)cn12)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014058 SUPVXUBKYCSVNI-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD CC(=O)c1cc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)n[nH]1 1845038593 WHTWIDVGXNSBBW-UHFFFAOYSA-N 467.530 0.776 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)COCCOCCOCc1ccccc1)C2 1846385962 PRDSULKXNRYLQW-UHFFFAOYSA-N 490.601 0.813 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CNC(=O)C(F)(F)F 1848098435 ASTCSPZEQLVWSS-SRVKXCTJSA-N 470.876 0.999 50 20 JCGD C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1 17197917 DKWUUJYLRRJEGK-UHFFFAOYSA-N 467.507 0.964 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c1cn(C)c(C)n1 726643503 QXLBTJLAKOHQIQ-UHFFFAOYSA-N 487.922 0.063 50 20 JCGD CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 728379404 JWATZDUOKHFQCC-SMDDNHRTSA-N 492.417 0.883 50 20 JCGD O=C(NCCCN1C(=O)CNC1=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 731117896 LTGFYJBQEDPCMM-UHFFFAOYSA-N 488.526 0.051 50 20 JCGD COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1 748246552 LIPRXCCTCOYXTL-UHFFFAOYSA-N 460.512 0.904 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN/C=C1\C(=O)NC(=O)c2ccccc21 783679689 MFHRIFDXXAXZKU-HKWRFOASSA-N 484.534 0.572 50 20 JCGD O=C(NNc1ncccn1)C1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1 913044276 HWRILRSTSRWISC-UHFFFAOYSA-N 491.530 0.765 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)c2ccccc2c1=O 913081575 UKMRPLVSKKOCGQ-SFHVURJKSA-N 461.482 0.859 50 20 JCGD CN1CCN([C@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2cccs2)CC1 915902658 YYNAUBIYNKWULW-QGZVFWFLSA-N 455.548 0.657 50 20 JCGD N#Cc1ccc(NCCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nc1 916521383 DLJMYUUMOHTBFO-UHFFFAOYSA-N 457.516 0.794 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1 916643437 IGQYLBWEQXFTCM-UHFFFAOYSA-N 483.591 0.977 50 20 JCGD O=C(NNC(=O)c1nnc(O)c2ccccc12)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O 918548418 DCNSTJHWWRARST-ZDUSSCGKSA-N 497.489 0.734 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 919473790 NBMUKGVWSOGAEU-HNNXBMFYSA-N 456.477 0.493 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)Cn2nc(-c3ccccc3)ccc2=O)cc1OC 919546474 WKILSLMFJXDILJ-UHFFFAOYSA-N 466.450 0.932 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br)N[C@H]1CCS(=O)(=O)C1 919883843 FYVGEAHJYRRHCP-JTQLQIEISA-N 495.377 0.021 50 20 JCGD CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)CC2)cc1 919885823 RXFNBTVJTANLHJ-QGZVFWFLSA-N 486.616 0.728 50 20 JCGD CNC(=O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1 920848923 JKETTYJVLWAYMP-MDWZMJQESA-N 459.304 0.957 50 20 JCGD Cc1nc([N+](=O)[O-])cn1CCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 921058302 CHXJLRBICCRHDS-UHFFFAOYSA-N 450.477 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3c1CCCC3)CCO2 1779030346 OILYIOFANIRTHH-QFIPXVFZSA-N 453.503 0.044 50 20 JCGD CN1CCC[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)C1 1780967880 AUXYVKOXSYWCPX-BWKNWUBXSA-N 486.617 0.504 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)cc2N1 1781411185 QBJXBEAIBDMWBB-ATIYNZHBSA-N 491.353 0.692 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1 1781997408 UWRILRMJFYKUTO-VMUDFCTBSA-N 468.414 0.612 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783022360 IHHHEZPXIJTQND-LLGFUMIMSA-N 481.391 0.415 50 20 JCGD COc1ccc([C@@H](O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1 1783768160 DFRPIERWODSFIS-JLEJFLCFSA-N 462.547 0.081 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1783936305 UDHHHTJHNVELQP-QHCPKHFHSA-N 459.547 0.390 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCNC4=O)C[C@@H]21 1783968268 SEDKPWMQSHZQOI-QCQGSNGOSA-N 468.352 0.251 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21 1784196722 KGHRFLOTIQVGIL-YYFQZIEXSA-N 451.923 0.776 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)C(=O)C1 1785669593 MVFDHEJWRGAVGH-FQEVSTJZSA-N 493.388 0.699 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1785725448 UFZMNRNHYIYVOK-SIFCLUCFSA-N 461.943 0.052 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cnccc4n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979579 AJXUFXSEEQVQDP-JLMWRMLUSA-N 460.299 0.217 50 20 JCGD CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c2ccccc21 1786979699 AQZMCAZMGLBUSU-XJABCFGWSA-N 476.342 0.643 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc4sccc4c3=O)C[C@@H]21)c1ccc(B(O)O)cc1 1786980112 KDYUFIUCWVWRKU-VDGAXYAQSA-N 495.366 0.036 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C[C@@H]21 1788609981 IXGORPWORBQVJI-PBQZTSCYSA-N 498.931 0.517 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c4c(nn3C)CCC4)[C@H]2C1 1790461287 JVGUHVBUXZRJOI-MDUUWBQSSA-N 481.557 0.636 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1791103201 POIIANLAPUKXRC-RBZJEDDUSA-N 491.969 0.022 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)C[C@@H]21 1791253383 AYWMYFNKHGTUHX-QQCJEOGWSA-N 489.997 0.448 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnccn3)[C@H]2C1 1791698702 NJJRKPNLZVGOMC-CERTZNHTSA-N 465.514 0.604 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccno1)NC(=O)NCc1ccccc1 1794740672 OSIIFFRBLZXSCK-XEMDLRDOSA-N 456.503 0.224 50 20 JCGD Cc1cc(Br)cnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1794964607 WAVHORBFNIBXIS-CCWDJLKJSA-N 488.147 0.349 50 20 JCGD CCn1c(-n2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](Cl)COC)C4)cc2C)cccc1=O 1795936246 QIRBUBKLVSPFBG-KYFSNAEOSA-N 491.976 0.819 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1 1797956717 WOKXIJMMCLHIEC-UNMKOGDSSA-N 485.654 0.799 50 20 JCGD CC(C)(C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccccn1 1801216898 NZBQBERHMWRBPK-CCWDJLKJSA-N 452.515 0.261 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803585324 QYPCIPRNNAZXRD-ALKREAHSSA-N 488.570 0.080 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CNC(=O)c2cccs2)[C@@H]1c1cccnc1 1804573821 HWNAJRWLGSXCRV-VGSWGCGISA-N 486.598 0.952 50 20 JCGD Cc1noc(C)c1CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365376 XJQIWHGXBPNAPR-AUSIDOKSSA-N 462.315 0.929 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374561 LIKIYZVPTGERMR-FZZFVWELSA-N 457.299 0.584 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1 1807377042 ZIBNNUPHDXKWFF-PGRDOPGGSA-N 475.314 0.584 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1808195406 FQIBAMGIDDZMKK-MWDXBVQZSA-N 470.954 0.573 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809978115 UVKRSPQBYJAPNB-LJQANCHMSA-N 489.378 0.097 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2CCCCC2)[C@H]1c1cccnc1 1810297755 DHOBNAMRLXBGNV-AVRDEDQJSA-N 465.558 0.886 50 20 JCGD Cn1ccc(=O)cc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1811367413 DAYUTIYTFODMLM-KKSFZXQISA-N 475.509 0.412 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1 1812868707 KEQUUBRWBHKXRM-NJZAAPMLSA-N 455.309 0.414 50 20 JCGD C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)[nH]n1 1814779464 QSHCCPVKPWWGGR-JQWIXIFHSA-N 455.313 0.985 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnc3snnc3c1)CC2)c1ccc(B(O)O)cc1 1815343566 AHGUKXCCHINJCR-CYBMUJFWSA-N 480.340 0.762 50 20 JCGD CCn1nc(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354636 OCJLXUAMGHVFKI-OAHLLOKOSA-N 453.333 0.887 50 20 JCGD O=C1COc2ccc(C(=O)N[C@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)cc2N1 1815357106 YRDRLSZPRBZJPY-HNNXBMFYSA-N 492.322 0.693 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)CC2)c1cccc(B(O)O)c1 1815361042 RVMVKOWTXOJWPZ-GFCCVEGCSA-N 455.261 0.599 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(=O)n1O)CC2 1817276688 AKTQHYYRSMKPIX-ZVYABZQBSA-N 483.510 0.902 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1 1817475617 WDUDKMQLPZAAMF-LJQANCHMSA-N 477.286 0.891 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)n1ccccc1=O 1817476073 DQKRCRCCYRFVFI-HNAYVOBHSA-N 463.303 0.818 50 20 JCGD Cc1nnc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)o1 1817534757 GRPXNNOACUUPKL-HNNXBMFYSA-N 453.463 0.648 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797943 PGAPKPADIDKUKK-MNOVXSKESA-N 457.516 0.058 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1819829017 UXVBTPMQYLTGCM-SWLSCSKDSA-N 466.332 0.339 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H](O)Cc1ccccc1 1822078760 COCMYLOHVVBEJS-LEWJYISDSA-N 462.315 0.999 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(O)nn2)CC1 1825711056 DILJQBNBFVCNEK-SFHVURJKSA-N 453.503 0.728 50 20 JCGD O=C(c1cc2n(n1)CCCO2)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057636 LMULHYLHBDVPRP-OAQYLSRUSA-N 466.347 0.893 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)C1CC1 1830066030 NIBNIJSPPPQXLD-HRAATJIYSA-N 475.970 0.442 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)C(=O)c3ccccc3)CCO2)C1 1831150827 SLYZEJFDEVVONK-KKSFZXQISA-N 482.375 0.998 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)CC1 1831897597 JZMTZHFMSHPIHQ-KRWDZBQOSA-N 469.269 0.278 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832251509 SFCQAZJOJRDNIJ-HNNXBMFYSA-N 474.480 0.650 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@](C)(O)C(F)(F)F)CC2)CC1 1833641963 RRKYNERPMJIBHI-IBGZPJMESA-N 465.517 0.244 50 20 JCGD Cc1cc(C)n(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1833836244 RWJMPVQYZWCZEQ-UHFFFAOYSA-N 467.379 0.065 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccsc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797988 TXGDJVXBAJQTHB-UHFFFAOYSA-N 455.389 0.856 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccncc3F)CC2)CC1 1835252803 JUEUQFSMCZWJBK-UHFFFAOYSA-N 469.521 0.718 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836679436 BHRZSXKRISZLDB-AREMUKBSSA-N 494.353 0.004 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)no1 1836717459 CDSWUYKQOKVCJR-INIZCTEOSA-N 456.927 0.910 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4occc4c3O)C2)C1 1837459579 KWLOGXPOOCFLAP-DEOSSOPVSA-N 495.492 0.521 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ncccn3)C2)C1 1837711918 WIPGRFYRWVCJFE-IBGZPJMESA-N 454.625 0.877 50 20 JCGD CC1=C(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)CCO1 1837993159 HYAMKTBVRMBFDA-UHFFFAOYSA-N 457.531 0.992 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838383140 AMFFYCRGKCBKCC-MRXNPFEDSA-N 468.599 0.066 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1839146451 OTKOBUXYCOEPBY-IIBYNOLFSA-N 479.921 0.766 50 20 JCGD CNc1nsnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839149742 QSGRJUVESHGWRN-HOTGVXAUSA-N 452.364 0.886 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1839387454 KGQRQRVQCSCJAQ-OXQOHEQNSA-N 475.615 0.137 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1839718840 QNBFUOQYXAISPX-RBUKOAKNSA-N 491.328 0.449 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN(Cc3ccccc3)C(=O)OC)CCO2)C1 1840083947 JQCNAUZASHTYQE-XXBNENTESA-N 497.976 0.965 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1840155488 DFIUAJWEEXXDQW-PTAUBWNISA-N 494.898 0.854 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(NC(C)=O)cc3)C2)C1 1840156817 UZYDFVDUKVBPFO-WIYYLYMNSA-N 453.923 0.969 50 20 JCGD COc1ccc(F)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1OC 1840185814 XTPBNXYRLUWENR-HSZRJFAPSA-N 496.536 0.286 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840276684 XAGLPMWHQPFUKU-DRSNIGMVSA-N 489.997 0.690 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2 1840862961 PXFOZZXQIUWUOR-HRJSYZDASA-N 477.587 0.720 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CCN1C(=O)OC(C)(C)C 1840961731 PNZBCIAGZVMZTP-FSTVOOFJSA-N 489.997 0.688 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844263190 CIJDTWQPJAYYLQ-JKSUJKDBSA-N 457.531 0.872 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1 13082427 JUPAIAAKAQHVOM-UHFFFAOYSA-N 471.495 0.910 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)CNC(=O)c1cccs1 725740067 AUQQYRATEXGZHM-ZDUSSCGKSA-N 488.588 0.865 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)c1 725870625 MNYSHKKMDOKAFI-UHFFFAOYSA-N 459.459 0.225 50 20 JCGD C[C@@H](CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NC(=O)C1CCCC1 727098664 OMKWLIWINRMELR-KRWDZBQOSA-N 494.614 0.873 50 20 JCGD CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 728379400 JWATZDUOKHFQCC-RISCZKNCSA-N 492.417 0.883 50 20 JCGD O=C1CC[C@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCN(Cc4ccccc4)CC3)cc2)N1 729837676 KTLBPYIEFYOCFV-HXUWFJFHSA-N 485.566 0.233 50 20 JCGD CS(=O)(=O)N1CCc2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc21 742634942 VWVNLRXIOFKITO-UHFFFAOYSA-N 462.440 0.535 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1 751205214 ZBTJNJVNUNIFRR-UHFFFAOYSA-N 459.484 0.018 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNC(=O)c2cccc(Br)c2)n1 758666528 JJEPGEBETYMJIL-UHFFFAOYSA-N 469.317 0.877 50 20 JCGD Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c(C)c1 912921643 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CNC(=O)C1)CCO2 1780098139 CYWMZLJFFZFXCR-LHSJRXKWSA-N 460.443 0.100 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)n1ccccc1=O 1782215085 RKQIPIXLOTUWEV-YZZKKUAISA-N 461.563 0.296 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c12 1782372336 GJTYKHGZOZWKNL-XMMPIXPASA-N 463.299 0.614 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1782671933 GDMKIHXKUAGFMK-CKFHNAJUSA-N 453.337 0.813 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@@H]1CCc2ccoc2C1 1784232951 BYISSKBEKNRNHT-NTPMHYTDSA-N 452.316 0.358 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1784633357 DFONAERBDVOZBX-CLOONOSVSA-N 497.600 0.929 50 20 JCGD NC(=O)[C@@H](N)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)Cc3ccccc3)C[C@@H]21 1786892856 PYJFNPWEKBKMEG-OYSTVDSJSA-N 495.418 0.565 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786982040 ZXYRIFAJSQVSKX-RRPUWOKSSA-N 474.326 0.664 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)[C@H]3SC(=N)NC3=O)[C@H]2C1 1787492701 KBRVGKZHBPEOQG-PMMQCXHCSA-N 475.409 0.800 50 20 JCGD CN1CCC(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CC1 1788607930 WHNLNLYLVHWIGA-VDGAXYAQSA-N 458.563 0.010 50 20 JCGD Cn1ncc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cnccc5C(=O)NN)[C@H]4C3)ccc21 1788611173 NPUPBQCRJSOUIS-ZRCAFCQKSA-N 477.525 0.479 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)N(C)C(=O)OC(C)(C)C 1789759199 SSWMYCGNNBDGHR-OWSLCNJRSA-N 483.610 0.595 50 20 JCGD COC(=O)C12CC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)/C(C)=N/NC(=O)c5ccc[nH]5)C[C@@H]43)(C1)C2 1791016994 RRFKNWLIVWMKOY-IYMWFAKISA-N 485.541 0.443 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)C1(O)CCC1 1792478979 TXTBQZQPNZFMJM-RPUPUWCGSA-N 487.601 0.473 50 20 JCGD 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N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303787 VSMNVKGRGOIOLR-KDOFPFPSSA-N 470.559 0.416 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCc2cnn(C)c2)[C@H]1c1cccnc1 1813070814 LAFFEVRERKLOEY-XXBNENTESA-N 455.563 0.827 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1 1813072861 HHYKSBVAXPENGB-IYDJIXBJSA-N 456.547 0.295 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CSCC(=O)O)[C@H]1c1cccnc1 1813088536 HLYPKVZWJSUZFC-FOIQADDNSA-N 451.549 0.278 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1 1813499819 WDCCWEKJGQQUSQ-HXOBKFHXSA-N 454.531 0.804 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1814171214 IJMQKGAGLKWYKN-QFBILLFUSA-N 482.541 0.989 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)c3ccco3)sc2C1 1815656561 WYFZBNZHPNELJI-GFCCVEGCSA-N 462.532 0.451 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1 1817148334 BXJFFXGXUCMIQA-KRWDZBQOSA-N 456.507 0.046 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc2nncn2c1 1819117664 PWSFBKKVLRYXAY-GOSISDBHSA-N 459.275 0.752 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401566 IJAHRZVUEGIZHI-LRDDRELGSA-N 456.507 0.629 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819418098 XDEFGOFRHGJQCZ-KBXCAEBGSA-N 463.307 0.686 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3ncccn13)CC2 1819797627 WMWUYMGWZODDCV-NSHDSACASA-N 477.510 0.724 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819799666 FJAFFRSGIVMWFW-OFFHKIPUSA-N 457.516 0.407 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1820026813 UYJIOKBJRYPSGZ-STQMWFEESA-N 488.574 0.037 50 20 JCGD CCc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)n(C)n1 1820631794 OGEJVUFWELGHGJ-HNNXBMFYSA-N 453.333 0.658 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCCS2(=O)=O)n[nH]1 1821834433 LHMXSQLPEMVKGC-HZPDHXFCSA-N 475.531 0.291 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOCC1)CC2 1826085141 GVDBBBXVOHTPNL-AWEZNQCLSA-N 452.581 0.150 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1828357745 NJXKMLYITRPRCD-ROUUACIJSA-N 464.028 0.877 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829640838 QYAHNZRUDUBOQV-NRFANRHFSA-N 451.332 0.612 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1830538119 WHFJHUJUAAWLGM-APWZRJJASA-N 462.385 0.196 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1830539446 GXKSJEDNRFHJNK-NHYWBVRUSA-N 475.258 0.579 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1830543590 VGTWSHPAQMVYFG-BUXKBTBVSA-N 473.320 0.904 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1832004576 HFRVPVJWDAZDEP-SIFCLUCFSA-N 479.933 0.613 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833024525 QNBGSILBJUOBGQ-WEBUEUPWSA-N 482.965 0.857 50 20 JCGD CN1CCC(CC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)CC1 1833135232 VERTZFYHLDVQDJ-UHFFFAOYSA-N 464.655 0.663 50 20 JCGD CN(C)C(=O)NCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1833144523 RHXVRPSSHRQBCL-OAHLLOKOSA-N 450.353 0.520 50 20 JCGD CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1833214221 NCHMBMMYBWMKIP-UHFFFAOYSA-N 463.970 0.868 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1CS(C)(=O)=O)CCO2 1833565472 MERDAVCQANKZAT-OAQYLSRUSA-N 499.662 0.548 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1scnc1C1CC1)CCO2 1833727406 GFQJVKBRFONAIW-JOCHJYFZSA-N 471.344 0.084 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)CC1 1834424016 VFVNCXYHRLRPGQ-UHFFFAOYSA-N 486.455 0.507 50 20 JCGD CC(=O)O[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(C)C 1834798689 YDMAHXCZSCCCML-QFIPXVFZSA-N 473.379 0.139 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccc2c[nH]nc12 1835007636 AXIFNTXCMWKUEN-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(F)F)CCO2)NC(=O)NCc1ccccc1 1835460138 IAHQKVNMIAYJQS-QFIPXVFZSA-N 483.516 0.444 50 20 JCGD C[C@H]1CCc2c(C(=O)N3CCC(N4CCC(NC(=O)c5cnccc5C(=O)NN)CC4)CC3)n[nH]c21 1835738103 SYFBECDHUHRCTA-HNNXBMFYSA-N 494.600 0.957 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1 1835836925 CNIXXFATZLWYTO-FQEVSTJZSA-N 485.654 0.904 50 20 JCGD CC(F)(F)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927105 FZXYARGHFAVWEE-NRFANRHFSA-N 454.279 0.118 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836719094 MSJHTCOXJUQISY-QGZVFWFLSA-N 470.910 0.355 50 20 JCGD COc1ccc(F)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461277 SENVIZXIQCVOGD-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn(C(F)F)c3=O)CCO2)C1 1837772061 JPHHLFFGBNNHEO-IFXJQAMLSA-N 463.865 0.567 50 20 JCGD C[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1838616274 NEIIQYVVSDAQIW-GOSISDBHSA-N 475.590 0.712 50 20 JCGD CCCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1839012195 UITBOCZUTDIHTM-VWLOTQADSA-N 497.552 0.858 50 20 JCGD O=C([C@@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1839198448 DTGDPZQMKWFWDU-PELKAZGASA-N 483.184 0.489 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)CCO2)C1 1839466957 DCZVUANPQJEEHZ-FOIQADDNSA-N 471.894 0.933 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCN(C)CC3)C2)C1 1839963426 JRYVQOBNXWWTDN-YLJYHZDGSA-N 475.428 0.254 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1 1839967639 SQLIZFFIOXUGSM-VQIMIIECSA-N 456.337 0.960 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)N3CCCC3)C2)C1 1840030822 XKSTVUZFQPTFBE-DNVCBOLYSA-N 460.369 0.629 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 1840187173 KVUBJQSFGLJAIX-QFIPXVFZSA-N 495.508 0.106 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187253 PIABXNBCHQLXPP-HSZRJFAPSA-N 480.537 0.206 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1ccnc1C)CCO2 1840491837 VPHGJYTVQQNGSY-KCCFIZEVSA-N 485.545 0.343 50 20 JCGD CCNC(=S)NCC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1845759863 CZJOTPXGOHGZSP-UHFFFAOYSA-N 475.619 0.020 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1n[nH]c3c1CCc1ncccc1-3)C2 1846385331 QRVAGJSIFYUZGH-UHFFFAOYSA-N 451.531 0.760 50 20 JCGD CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 9930642 LKMAQMSLRWNQNE-RISCZKNCSA-N 496.405 0.334 50 20 JCGD CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)c3csc(N4CCOCC4)n3)ccc21 15244859 FXMDOPLXIBZJPI-UHFFFAOYSA-N 465.557 0.902 50 20 JCGD COc1cc(C(=O)NNC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc(OC)c1OC 15792717 GBRSBEAWXGZLBO-UHFFFAOYSA-N 458.383 0.678 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 25166696 LCQDPEMMSBDLBZ-UHFFFAOYSA-N 495.579 0.505 50 20 JCGD O=C(Cn1cnnn1)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(C(F)(F)F)c2)c1 725906348 FKABLIIIUWQVFH-UHFFFAOYSA-N 469.405 0.954 50 20 JCGD CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1 727608977 FVKQVOYLYKESEF-LBPRGKRZSA-N 482.588 0.901 50 20 JCGD N#Cc1ccc(CS(=O)(=O)CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 728329225 LFAOQMBCAOJXEF-SFHVURJKSA-N 473.463 0.004 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3cccc(OC(F)F)c3)cc2)CCN1 728486898 PVYBMURDMCBHAN-UHFFFAOYSA-N 468.438 0.483 50 20 JCGD CN(C)c1ccc(NC(=S)NNC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)cc1 729690712 HHCJSEYLRJBHOP-CQSZACIVSA-N 452.562 0.236 50 20 JCGD O=C(CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)c1csc(N2CCOCC2)n1 749404247 XHAFXPVLFOGQGP-UHFFFAOYSA-N 456.484 0.826 50 20 JCGD COC[C@H](C)n1c(SCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nnc1-c1ccccc1 751063925 UZGISTQKRAAKJT-DZGCQCFKSA-N 467.573 0.827 50 20 JCGD O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)CNC(=O)c1cccs1 751210206 ZPTAVQSEJXHBQS-UHFFFAOYSA-N 453.498 0.261 50 20 JCGD O=C([C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1)N1CC[C@@H](B(O)O)C1 864232604 ANRLWVBVOSRLIV-WDEREUQCSA-N 451.173 0.987 50 20 JCGD CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1 912924783 NQWQGUFHMAUNRE-HOTGVXAUSA-N 456.565 0.400 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)cc1 913455273 XXIWVEHFYCTYQU-UHFFFAOYSA-N 467.301 0.825 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCNS(=O)(=O)c2cccnc2)c1 914612681 CXVVLLSCCJACLJ-UHFFFAOYSA-N 483.572 0.242 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@H]1CCCN(c2ncccn2)C1 916640524 LSTRFDMJHZXVJD-KRWDZBQOSA-N 489.558 0.111 50 20 JCGD O=C(Cc1ccc(NS(=O)(=O)c2cccs2)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 916659082 FSTRWFSRDLFGDU-CYBMUJFWSA-N 457.555 0.674 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1Br 918691462 BNUPBNJLXUXPBV-UHFFFAOYSA-N 490.361 0.464 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCc1cscn1)c(=O)n2Cc1ccccc1 921020772 FKZDIAZYNDEHQT-UHFFFAOYSA-N 481.538 0.665 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)n1 1778374240 AEMXLWAXDSWBLC-IQUTYRLHSA-N 456.883 0.726 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc4scnc4c3)C2)C1 1778641231 KSXBKFPLNAZSGM-QFIPXVFZSA-N 451.313 0.733 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028428 FEAXHELSVIGQLQ-IQMFZBJNSA-N 490.561 0.289 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1C 1779032142 BYEJPJCOSVTJAD-QHCPKHFHSA-N 453.499 0.759 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2 1779374532 NGGGJYHWFLDWSE-XRAJMZMQSA-N 498.584 0.214 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)N1CCN(C)CC1 1780639963 WNDCGLBTQOTWEF-MBOZVWFJSA-N 459.429 0.921 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968266 HOAHJNQXIQXOKT-VWLOTQADSA-N 497.600 0.745 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2)NC(=O)NCc1ccccc1 1780968273 AFDSPRHSDWRNLA-DNRQZRRGSA-N 487.601 0.714 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3cccc(Br)c3)C2)C1 1780968364 BAKYATZULLGOLL-IIDMSEBBSA-N 461.740 0.912 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782158484 CIFYJCSVBOKVJO-UWHHFBIGSA-N 484.358 0.249 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1782213621 ZVSMUYGSUZZIAW-ISTRZQFTSA-N 451.337 0.564 50 20 JCGD O=C(CN1C(=O)C=CC1=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1784116974 XBZDINDTPOSKJI-VGSWGCGISA-N 490.354 0.748 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3C(=O)Cc4ccccc4C3=O)[C@H]2C1 1784160847 HTEOLMXCGMUNQQ-FFGOWVMKSA-N 491.972 0.835 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CC3(C)CN(C(=O)OC(C)(C)C)C3)C2)C1 1785710793 YGXXWNWSLINQJH-DEOSSOPVSA-N 495.621 0.836 50 20 JCGD CO[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccccc1 1786662022 VKQWKMPDIQCBEL-QESAQDPVSA-N 452.316 0.347 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(C#N)c1 1786981708 HSODAYPTWNRVPM-TZYHBYERSA-N 477.326 0.083 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4c3OCCC4)C[C@@H]21 1787507746 OQQYKVIHUGBYCF-YKNBRYRPSA-N 483.529 0.393 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nn3)[C@H]2C1 1788836646 KGKFOTWURBNBNB-PJODQICGSA-N 459.894 0.036 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(Cl)cc(Cl)n1 1789050630 QIYHZGKLDDBOHQ-OWQGQXMQSA-N 478.141 0.975 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21 1791544068 OOCXKZRPFZRPFA-SVKXURNBSA-N 474.389 0.673 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)c(OCc3ccccc3)c[nH]1)C2)[C@H](O)CCl 1792975272 MRGRBVVBRNXNSJ-NNNWTRQLSA-N 475.929 0.757 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(S(C)(=O)=O)c1 1794318541 RKXHRSQKZACVNZ-OEYIWLLWSA-N 474.377 0.719 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(C)C)C(C)C 1795715423 SEYQLNWBAWFIMR-YJYPOECXSA-N 460.579 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1C(F)(F)F)C2 1797751859 WEKSDYIOUOCWNF-DRXBFXEBSA-N 478.431 0.616 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)[nH]n1)C2 1797752838 IPJBENMMHCIMAK-VPTLXERWSA-N 475.509 0.592 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ncccc1C(F)(F)F 1798226083 ZDJYSOWWKNDINS-XOIINTDNSA-N 463.221 0.297 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c(=O)cn1 1798634569 LDSZXRSKHAWPBT-DBWKPXFBSA-N 471.426 0.120 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C 1799366018 DKOSCVHRVMMTFI-USRAEIGSSA-N 478.384 0.635 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1799395689 VZQZAJUOEAOGHV-RPUPUWCGSA-N 488.589 0.723 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](C)Br)cnc2c1 1800757678 OAUHIWZCCSXVGT-ZJOBFFGXSA-N 463.332 0.990 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CNC(=O)N(C)C)[C@@H]1c1cccnc1 1802676610 HKNHYWIXPMIEBV-FIAMHUAMSA-N 482.545 0.493 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCNC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1804464573 XWUIGBBGBZFHBC-WZONZLPQSA-N 483.573 0.609 50 20 JCGD COc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1805599531 FIMGACCOYUVPML-GHTZIAJQSA-N 460.299 0.798 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1807360145 HJTYKPUMTRXEIY-MMKNMNOBSA-N 462.359 0.421 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1809227265 UQKSLEUGTHKPGI-CVDCTZTESA-N 461.331 0.664 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)N1 1812443364 LAPNOLIGRIDFJY-DTJSUFBGSA-N 497.980 0.802 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1CCC(O)CC1 1813193627 HTDXTHAPMQFYGI-LWOJGPERSA-N 451.332 0.632 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2cc(C)c(O)nc2=O)[C@@H]1c1cccnc1 1814037041 HJQVYOYUOJYCRP-RYRKJORJSA-N 463.922 0.612 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1 1815361761 QYVUXNIUYAHUNO-BBRMVZONSA-N 453.333 0.815 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)COCCO)n[nH]1)NC(=O)NCc1ccccc1 1820925389 FLRGQGPYMBMGRP-LJQANCHMSA-N 487.561 0.757 50 20 JCGD O=C(NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1cccnc1 1825088819 CKYHVLZRSNYVAD-QFIPXVFZSA-N 478.358 0.425 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](F)Cl)CC2)n(C)c1=O 1827609257 ZYUQHKZNRWYCBB-RHSMWYFYSA-N 482.944 0.588 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)CC1 1828861226 NYXQHYFYQKZKCH-SDCZFJSOSA-N 455.519 0.616 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828873082 WVINNYDTCFLUNF-JXFKEZNVSA-N 458.368 0.307 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nsnc3NC)CCO2)C1 1829758653 MJYASAJZTWKSNM-BDJLRTHQSA-N 462.370 0.823 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nsnc3NC)CCO2)C1 1829758655 MJYASAJZTWKSNM-MEDUHNTESA-N 462.370 0.823 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1830540241 PGYBVVSELVYUNY-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD COc1ccc(-c2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)n[nH]2)cc1 1830727691 BJAGPOVLERFLIZ-KNQAVFIVSA-N 478.933 0.755 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830735646 KHJOFYUJVNLKAG-RXVVDRJESA-N 488.990 0.079 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830736657 VVVOKTZLAUAMAA-NQIIRXRSSA-N 463.922 0.245 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)CCO2 1831110656 LZLAZIJQJGWQPR-JXALWOEJSA-N 493.988 0.745 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1831651480 PMJFPZWFSGAIMC-QYWGDWMGSA-N 467.954 0.459 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)CC1 1831900697 UDLLLXNMEPRAPJ-HNNXBMFYSA-N 463.501 0.658 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cncs3)CC2)CC1 1834294346 KDYBUGNFUMQMQO-UHFFFAOYSA-N 457.560 0.641 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)COc3ccccc3)CC2)CC1 1834469619 ZYEIKGMIVOCDAL-UHFFFAOYSA-N 480.569 0.949 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)/C=N/N3CCCCC3)CC2)CC1)c1ccc(B(O)O)cc1 1834798479 ARICTOWXSYOZNB-NLRVBDNBSA-N 469.395 0.023 50 20 JCGD Cc1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834799951 IAVROMCWDXSESU-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD Cn1ncc2c(C(=O)NC3CCN(C4CCN(C(=O)c5cccc(B(O)O)c5)CC4)CC3)cccc21 1835419107 OJZACKLQVCRCEI-UHFFFAOYSA-N 489.385 0.752 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4c(Cl)cccc34)C2)C1 1835932052 LKQSHPMJQWRHGU-XMMPIXPASA-N 497.744 0.885 50 20 JCGD O=C(CCc1cn[nH]c1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837158120 KMRPOORMMVSTCR-UHFFFAOYSA-N 454.336 0.335 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)n1 1837460692 JDRZITHFFDSIFH-VWLOTQADSA-N 496.568 0.400 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cn1 1837711274 BHYLNCYERCJSKK-OAQYLSRUSA-N 465.579 0.790 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc(Cl)nn3)CC2)CC1 1837919167 LZLMXXFHVZYFMV-UHFFFAOYSA-N 472.738 0.736 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccnc4c3OCO4)CC2)CC1 1837921316 YZDOFRHZGVXQNY-UHFFFAOYSA-N 481.314 0.416 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccc(O)cc1 1839169799 JYILTUFQIPQEJT-UPCLLVRISA-N 483.525 0.264 50 20 JCGD O=C(Nc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1)C1CC1 1839249460 PQRIZFSCNMNLSQ-XMSQKQJNSA-N 465.934 0.705 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)NCCC#N)C2)C1 1839963842 YEYGRSBQUPEDDB-DNVCBOLYSA-N 459.385 0.898 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840036684 PWMLWNMCBMLWGL-VQIMIIECSA-N 481.384 0.296 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4cnnc4)cc3)C2)C1 1840151892 QKIQVCCJVXMJAC-NQIIRXRSSA-N 463.922 0.591 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)cn1 1840182389 IARQCAAKWMUGLO-HSZRJFAPSA-N 461.563 0.152 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4[nH]ccc4n3)C2)C1 1840184590 WGANWRCQJCZJFD-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1[N+](=O)[O-] 1840185763 WYCJXXJVOKSLBC-QHCPKHFHSA-N 491.545 0.275 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CCO2 1840289061 LPEQWUNSSGPWHJ-DCLXLUIPSA-N 458.559 0.620 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840887175 YMEPWYUPHFFJJZ-APWZRJJASA-N 459.858 0.333 50 20 JCGD O=C(c1ccc2nc(Br)nn2c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013293 DASZUSYDRMLCQJ-UHFFFAOYSA-N 484.119 0.302 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CC(=O)Nc1ccc(F)cc1)C2 1844264789 IJZQNPDDMUDULC-UHFFFAOYSA-N 454.462 0.670 50 20 JCGD CCNC(=S)NCC(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1844693336 TXCDXFJYZMICIG-UHFFFAOYSA-N 463.516 0.821 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)[C@H]2C1 1846160768 LHWNDIYCUAKOJV-KLHDSHLOSA-N 457.955 0.671 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1 10774363 FQEXASPMNHKDPF-UHFFFAOYSA-N 498.945 0.537 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2)cc1 15409644 ATNMAWXWBYPLGF-FQEVSTJZSA-N 474.539 0.289 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)COc2ccccc2OC)c1 15668634 IZMCJLDYJQLPGW-UHFFFAOYSA-N 466.516 0.114 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@](O)(c1nccn1C)C(F)(F)F 105570217 JRHDNOPHENREPS-INIZCTEOSA-N 462.454 0.623 50 20 JCGD O=C(Cn1nc(-c2ccccc2)oc1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 725898559 KKZAPHDRBKAZSW-UHFFFAOYSA-N 471.495 0.749 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)C[C@@H](C)O1 726162025 AUIGYXDQVKBGOC-BBWFWOEESA-N 470.567 0.873 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)C[C@@H](C)O1 726162045 AUIGYXDQVKBGOC-ZACQAIPSSA-N 470.567 0.873 50 20 JCGD COc1ccc(OCCCS(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 727350494 OKLCHTTXXCOPJD-UHFFFAOYSA-N 471.557 0.979 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 728264299 FKRXPYWQMYZYRW-UHFFFAOYSA-N 459.933 0.785 50 20 JCGD CCc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1-c1ccccn1 728325158 LMJICOOUJQPNEF-GOSISDBHSA-N 451.439 0.974 50 20 JCGD COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1C 731180977 IWPPGTFRRMUYJG-UHFFFAOYSA-N 497.551 0.426 50 20 JCGD CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc(-n3cnnn3)cc2)c2ccccc2c1=O 747406708 JFXVSXXGQMNBHS-UHFFFAOYSA-N 454.472 0.576 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1 913962161 HKSBIKICSFNHPE-UHFFFAOYSA-N 450.477 0.797 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNc2nccc(OC)n2)c([N+](=O)[O-])c1 914762919 CEELDPIZPGARBM-UHFFFAOYSA-N 454.465 0.946 50 20 JCGD Cn1nc(C(=O)NNC(=O)Cn2cnc3ccc(Br)cc3c2=O)c2ccccc2c1=O 916123147 LNHAEPXAFNNKPY-UHFFFAOYSA-N 483.282 0.867 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1)N[C@@H]1CCS(=O)(=O)C1 919885862 OKOLWRHFJWHJNF-OAHLLOKOSA-N 470.504 0.758 50 20 JCGD Cc1nn(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1[N+](=O)[O-] 919969874 GRQOZWOWYOJPOA-UHFFFAOYSA-N 450.477 0.886 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1noc2c1CCCC2 1777865204 BFVQKFGVPIQESS-HYBUGGRVSA-N 467.331 0.675 50 20 JCGD Cn1ncc2c(C(=O)N3CC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)cccc21 1778030584 ZXEIMNJFKIVZCR-QHCPKHFHSA-N 463.498 0.329 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)cc21 1778380428 WNJRLJXVIIUSRN-SFHVURJKSA-N 454.325 0.245 50 20 JCGD Cc1nc2ncccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1778630337 CVHLRQWTERAXOW-NTKDMRAZSA-N 477.330 0.159 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnc3ccccc13)CCO2 1779030068 GIJWZWTWDSNXES-XMMPIXPASA-N 460.494 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nccn3c1)C2 1779372630 PYICKRBQOMKFNC-NTKDMRAZSA-N 477.525 0.774 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cncs1)CCO2)NC(=O)NCc1ccccc1 1780968667 DFXVEIIGBFQNIT-QFIPXVFZSA-N 472.571 0.933 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1781222389 TUMCPMCSATWAHG-FXAWDEMLSA-N 450.960 0.530 50 20 JCGD CC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1781786832 JVVSSSFRKNUFNX-OEIWHUPBSA-N 460.535 0.159 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c2n1 1782575235 IXKFCZNGFUMXEB-DEOSSOPVSA-N 477.525 0.707 50 20 JCGD CCN(CC)[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1782813764 IYFOCNZQUIMZCH-BVAGGSTKSA-N 479.386 0.893 50 20 JCGD Cn1cc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)cn1 1784573772 IWFIDAXWROUEBO-KKSFZXQISA-N 469.970 0.925 50 20 JCGD O=C(Cc1cc(F)ccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784925764 BWDFFPKJPACVMS-ZRCAFCQKSA-N 474.725 0.995 50 20 JCGD COc1ccc(Cl)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786986614 QPBSYKBAAWBUDI-ZRCAFCQKSA-N 472.734 0.936 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cncnc3)C[C@@H]21 1787508715 HHJBEIHZACJIET-NYLMZZAHSA-N 467.530 0.523 50 20 JCGD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)[C@H]1SC(=N)NC1=O 1788143960 ZOBQIEZISDRODL-SCLBCKFNSA-N 480.355 0.917 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(F)cc1 1789692342 RZZKRECHJWBWPT-UJCHZGTJSA-N 455.914 0.582 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H](C(F)(F)F)CC1)C2)c1ccc(B(O)O)cc1 1795736901 NRGFNMBKIOAZFA-ZNAOUKSVSA-N 468.281 0.938 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn[nH]c1C(F)(F)F)C2 1796441657 NSGYWHCEFSFADE-KYWHXAPBSA-N 482.423 0.161 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)CS(C)(=O)=O)C2 1796890751 KHAHYFXDMLVYFX-RCAJWXFUSA-N 451.549 0.439 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc2cc(Br)ccn2n1 1797570438 GAOKPPXZQIHPAK-OXUXUCFPSA-N 471.739 0.900 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2 1798439519 DXVDNUVYMLLOLS-ONIAQPFYSA-N 468.558 0.728 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2)[C@@H](F)Br 1799346601 DLHKSSZYEWTIQS-CABLIKTCSA-N 484.366 0.902 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1800944782 CGNBFBUEZKCKNC-XLWJZTARSA-N 499.989 0.438 50 20 JCGD CSCC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1801029277 VIAYWYPFQSRLLD-RCLSDMTESA-N 493.630 0.036 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807363103 OFWMUKBCRWAMTK-KNQAVFIVSA-N 477.330 0.238 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808430020 HBMCNROLNZWNNM-WIBUTAKZSA-N 467.530 0.267 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1 1809359078 YAMWSIXLDAPQDK-JTSKRJEESA-N 464.530 0.817 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@H]2C[C@@H](O)C2)[C@H]1c1cccnc1 1809505919 YWHRDSUBXIVCEY-ARTNPVLRSA-N 452.515 0.992 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCc2cncnc2)[C@H]1c1cccnc1 1810301863 DDHOQQXQTJRFNZ-AVRDEDQJSA-N 474.525 0.823 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](N)c2ccccn2)[C@@H]1c1cccnc1 1810303912 WOCZOMWGOYYYSC-ZLGUVYLKSA-N 474.525 0.495 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](COC(C)=O)OC(C)=O)[C@@H]1c1cccnc1 1810340669 KVPPZWPZFDAPJE-XWSJACJDSA-N 469.922 0.836 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)[C@@H]1c1cccnc1 1811516758 LZQGKLOZUFEIAC-LKUPVBHCSA-N 492.577 0.304 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnnc(Cl)c1)CC2)c1ccc(B(O)O)cc1 1815337112 MYKHQHZNIOAHDO-ZDUSSCGKSA-N 457.708 0.806 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1ON=C(c3ccccc3)O1)CC2)c1cccc(B(O)O)c1 1815356570 JJDDYPDBKZXHJR-OPAMFIHVSA-N 492.322 0.783 50 20 JCGD N#Cc1ccccc1OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361401 DIILHSXHFAGXJX-QGZVFWFLSA-N 476.323 0.999 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817471183 CLTNADAEQWZOKN-WMZOPIPTSA-N 468.348 0.422 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc4cccnn4n3)sc2C1 1821167720 CZXDJMULJYMEIL-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822416278 ZMDMHXIXKMONMD-ZFWWWQNUSA-N 450.544 0.482 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3nc4ccc(F)cn4n3)sc2C1)c1ccc(B(O)O)cc1 1824390526 UVZLDOWTNBEIFE-CQSZACIVSA-N 480.290 0.544 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCc4nc[nH]c4C3)sc2C1 1826622722 LHSZYSWKYYSJIE-RYUDHWBXSA-N 480.554 0.896 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1827401379 KYSHGZDDNGJMJA-DZGCQCFKSA-N 451.915 0.300 50 20 JCGD CN(C)CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548251 HAIFTBOOXYZUSR-PGRDOPGGSA-N 466.966 0.600 50 20 JCGD O=C(Cn1cccn1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551982 YQNLTPZSSJRAKY-XXBNENTESA-N 489.960 0.935 50 20 JCGD CN(C)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828927415 DMPCOUKBQSTLRI-AUSIDOKSSA-N 480.993 0.990 50 20 JCGD N=C(N)SCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828946180 ODMYYEVKNOGCMM-KKSFZXQISA-N 498.005 0.665 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)ccc1F)CCO2 1830192191 VIDNUPPWMZLHIS-NRFANRHFSA-N 470.929 0.922 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC=CCC1)CCO2 1830562989 XASFRWVRBAOHNH-YRBPKABKSA-N 457.531 0.933 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732226 WMFWWYPGLHAUTN-AVRDEDQJSA-N 452.935 0.610 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@H]1COc3ccccc3O1)CCO2 1831237408 UEPVIAXGYOZXIJ-UUOWRZLLSA-N 490.557 0.046 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c(C)c1F)CCO2 1833670086 GQVDESVRUVSZRR-PFRKPPGBSA-N 475.481 0.061 50 20 JCGD O=C(COc1cccnc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833759189 RKMDOZSJKQQIAG-UHFFFAOYSA-N 466.347 0.026 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnc(N)s3)CC2)CC1 1834768275 JHEDHHCGKSCJGB-UHFFFAOYSA-N 451.597 0.284 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1 1835753736 BZKYBJHNIVCBIZ-MRXNPFEDSA-N 466.362 0.857 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4cc[nH]c4cc3Cl)C2)C1 1835937410 UTIASWPMCLFULN-XMMPIXPASA-N 497.744 0.885 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)CC1 1837056436 DQYIVFHVSCJQDA-WGOQTCKBSA-N 499.572 0.727 50 20 JCGD NC[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccc1 1837895809 WULYNYSIPPIQAO-XMMPIXPASA-N 479.386 0.721 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3[nH]nc4ccncc34)CC2)CC1 1838049317 ISRKQEKNIBJHOW-UHFFFAOYSA-N 492.540 0.882 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3)C2)C1)NC(=O)NCc1ccccc1 1839054105 HAFVTBJLKMUOGL-VWLOTQADSA-N 496.568 0.498 50 20 JCGD Cn1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1Cl 1839200333 ITLHOXGYCMJPOP-NHYWBVRUSA-N 453.696 0.834 50 20 JCGD COc1ccc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839359603 MUFWCHWOBZPFAW-DEOSSOPVSA-N 483.525 0.386 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1ccccn1)CCO2 1839667776 IODPUMAKINTGSV-QYWGDWMGSA-N 497.390 0.830 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1839964427 RBTYKAQWVIUHBD-QAPCUYQASA-N 496.424 0.042 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1840180975 LPGQJHZEVPVGFF-FGTMMUONSA-N 455.335 0.295 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840897327 WPZYLHDTWCNAFN-BZNIZROVSA-N 480.406 0.087 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccnc2OCC2CC2)C1 1842270575 VSTCLWKSNSDRFM-UHFFFAOYSA-N 450.499 1.000 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014169 GFECHHYQGMCXFP-UHFFFAOYSA-N 467.243 0.331 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)C1 1847727294 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483.550 0.955 50 20 JCGD Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)c3ccc(Cn4nnc(-c5ccccc5)n4)cc3)cnc21 900861997 GFMOYSWLBSVJGK-UHFFFAOYSA-N 497.475 0.811 50 20 JCGD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1 913155948 JANYTJQBCUQHCA-UHFFFAOYSA-N 479.906 0.315 50 20 JCGD Cn1nc(C(=O)NNC(=O)N[C@@H](CN2CCOCC2)c2ccccc2)c2ccccc2c1=O 916216906 WPPHWXBCRFZWHH-IBGZPJMESA-N 450.499 0.951 50 20 JCGD C[C@H]1CN(C(C)(C)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@H](C)O1 916234418 DPZLJDQJNPAKEP-IRXDYDNUSA-N 483.639 0.532 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1 916391907 MXEGBXDGMJAONK-UHFFFAOYSA-N 469.498 0.567 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C)c2ccccc2c1=O 916622500 VVHQOFYCDNBZQP-UHFFFAOYSA-N 466.564 0.859 50 20 JCGD O=C(CN1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 917107850 XJKOEWWOHAVSQA-UHFFFAOYSA-N 462.444 0.784 50 20 JCGD C[C@]1(NNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)CCS(=O)(=O)C1 918218506 UTWMYGWCBNNDLZ-JXFKEZNVSA-N 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CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3csc(N)n3)CC2)CC1 1834752851 SAQOQQKKCMUEQJ-UHFFFAOYSA-N 451.597 0.284 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797801 HSPWTKUFTGUXHA-QFIPXVFZSA-N 456.396 0.036 50 20 JCGD Cc1c(F)ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1N 1835875025 MABSGAJBIYAXOJ-JOCHJYFZSA-N 465.526 0.159 50 20 JCGD CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1836395268 BLWGSTLPDMBNBJ-CQSZACIVSA-N 450.931 0.015 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1=NO[C@H](c3ccccc3)C1)CCO2 1836585898 GSYDEPOLSBDFNR-RDPSFJRHSA-N 487.557 0.333 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836780573 DOLPSQINXLLICJ-PMACEKPBSA-N 488.372 0.323 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)N1C[C@H]3C[C@H]3C1)CCO2 1837279182 NULWEDALXSFCFB-PANQXIRQSA-N 458.397 0.814 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1837715595 ZOSDTAKJELUECD-FQEVSTJZSA-N 451.552 0.732 50 20 JCGD N[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccn1 1837873036 HHEOARMMLDCCPL-QFIPXVFZSA-N 466.347 0.074 50 20 JCGD COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1 1837920217 IWYWPRHDBCOJAR-UHFFFAOYSA-N 467.331 0.696 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1837922077 IQXPZGCXSLJWKK-GOSISDBHSA-N 468.363 0.745 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838395335 DUSCMEHTUBHPGQ-GOSISDBHSA-N 467.954 0.551 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)F)C2)C1 1838528394 UXSZBMYMIUJHRW-IBGZPJMESA-N 457.386 0.855 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1839152441 ZEDUJHYUGJPRRU-ZWKOTPCHSA-N 486.418 0.105 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc(C)c1C(=O)O 1839479725 VMOIIDUDEDTBDX-HRAATJIYSA-N 454.907 0.671 50 20 JCGD CC(=O)NCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1839883154 RMGUNQTVKMNSMS-HRAATJIYSA-N 490.985 0.101 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)C1 1840150370 KEEUIIOEPRDOOL-WYLRSBHASA-N 457.867 0.911 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2 1840257498 XNWASMHHMQIAGO-RCZVLFRGSA-N 464.327 0.166 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnc(C)s3)CCO2)C1 1840399080 BQGYXJSSHBYBBU-BHSKHCGUSA-N 488.570 0.584 50 20 JCGD CC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CN(C(=O)OC(C)(C)C)C1 1840954985 RDURVCIDKZFNEO-ZHRRBRCNSA-N 489.997 0.690 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCCC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841352873 RCGKCGMNQKTLNJ-MRXNPFEDSA-N 477.986 0.738 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1841474638 GWMSQQOLAQMXGV-RBUKOAKNSA-N 471.363 0.877 50 20 JCGD COc1cc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc(OC)c1OC 1841785181 ORMAHYRXDWMDMI-UHFFFAOYSA-N 483.525 0.771 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1843953990 GBVMPCXBBMJGJJ-HSZRJFAPSA-N 490.536 0.851 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc([N+](=O)[O-])cc2F)C1 1845919052 PLOSYEOIUFBTNV-UHFFFAOYSA-N 456.434 0.792 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1847148169 WPVYJLWVLOMVEW-UHFFFAOYSA-N 452.272 0.049 50 20 JCGD CCCn1nc(C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)c2ccccc2c1=O 17163677 LGANEJOTRDKPNI-UHFFFAOYSA-N 471.539 0.973 50 20 JCGD COc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)cc1 728342292 LIWDHOQPSNWARP-JXFKEZNVSA-N 483.477 0.574 50 20 JCGD CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 728384517 MLMBWYIUXQDGQU-WMZOPIPTSA-N 467.569 0.725 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc(C#N)c1 728872477 NMDRYXCHCQBZEI-QGZVFWFLSA-N 498.970 0.754 50 20 JCGD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)c2cc(Br)c[nH]2)C1 728942049 ITGQURYDPXHRTI-LLVKDONJSA-N 458.313 0.865 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c2ccccc2c1=O 913597131 UXRUDXBVPLQEDV-UHFFFAOYSA-N 468.495 0.418 50 20 JCGD COc1ccc(C(=O)NNC(=O)Cn2c(=O)c3ccc(C(F)(F)F)nc3n(C)c2=O)cc1OC 915795040 KWSACXGHJRDSDP-UHFFFAOYSA-N 481.387 0.592 50 20 JCGD CN1CCN(c2cc(CNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccn2)CC1 916390722 WBZSDFRWWHQEFS-UHFFFAOYSA-N 475.575 0.228 50 20 JCGD O=C(NCc1ccnc(-n2cccn2)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916394515 XRIIJKQQFOVMHE-UHFFFAOYSA-N 485.526 0.432 50 20 JCGD O=C(CNC(=O)NCc1ccco1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 917902040 HJPCUWVJMOFSTL-UHFFFAOYSA-N 463.516 0.715 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2F)C1 1777755906 UIGJOWPEBRDQAL-XMSQKQJNSA-N 456.478 0.661 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)nc2N1 1777816096 KLYBGIJJGZPIKA-WHSLLNHNSA-N 450.923 0.694 50 20 JCGD CC[S@@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1779221809 KYHPFYAZABVQSA-MCZSLHIKSA-N 479.603 0.793 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)CCO2 1779298346 GFIRKVCORIEEIL-IBGZPJMESA-N 452.540 0.438 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@]2(C)CCCN2)C1 1780672408 WECYGJDDXRVJFM-CBSNMRRPSA-N 458.563 0.776 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C1=COCC1)CCO2)NC(=O)NCc1ccccc1 1780969787 PVIUXCZMDFFMFP-QHCPKHFHSA-N 457.531 0.467 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ncc[nH]1)CCO2)NC(=O)NCc1ccccc1 1780969931 OCYURZYYVRPDBM-QFIPXVFZSA-N 455.519 0.199 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1781242159 JQBZBHSYBDMHCU-QHCPKHFHSA-N 459.547 0.445 50 20 JCGD COc1cncc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1 1782208982 FIRYTRHESROBFP-HYBUGGRVSA-N 475.590 0.910 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2n1 1782574195 AQZWAGRZKDUJEY-DEOSSOPVSA-N 462.315 0.388 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1782865901 BIVUUGZRMMHIJG-QMLVJWNSSA-N 476.480 0.352 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1 1783872567 BPDVXWGFUVBMFD-LAUBAEHRSA-N 452.939 0.616 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CCO2)C1 1783876920 SOQQRKINPOFRIH-PXNSSMCTSA-N 458.964 0.716 50 20 JCGD COC(=O)c1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784201317 QURLNDKSJRHVGW-VJBMBRPKSA-N 494.353 0.379 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1CCc2ccoc2C1 1784233279 VSFPJHIPMXKYRB-JEEBJRHZSA-N 452.316 0.358 50 20 JCGD CO[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccccc1 1786465560 VKQWKMPDIQCBEL-JKLQHZFJSA-N 452.316 0.347 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)[nH]n1 1786981010 KYDOUHHHLOJBOM-IEZWGBDMSA-N 454.336 0.294 50 20 JCGD Cc1ncccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983606 SNHHHBBLGDFEKM-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@H]21)c1cccc(B(O)O)c1 1786984976 FRBVYKWDUNJHLJ-VHFSOBRXSA-N 493.285 0.058 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)C1 1788609718 CNYMKICDSSTPSO-ZGMAETJZSA-N 487.557 0.258 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789382493 LMQCWZHGUODWET-XERREHJYSA-N 483.573 0.932 50 20 JCGD CCO/C=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726707 OJWIVPSZYBWPCF-XILNNULGSA-N 473.574 0.863 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1c(F)ccc(O)c1F 1790209742 PMQWYJFEQSUTDB-YEWWUXTCSA-N 460.242 0.257 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790726730 NTWRXNHVPCUJQT-BWPZPKMVSA-N 468.334 0.978 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21 1791057302 SCRCIULZIPIXLD-SPTHLVQHSA-N 483.363 0.756 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1C(=O)C=CC1=O 1793617246 MCWPOKLLSCPWPB-CQCLGFCYSA-N 484.459 0.776 50 20 JCGD Cn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)cc1O 1794323126 NMFWHJZDAJIVJW-LMWOUKEDSA-N 471.942 0.461 50 20 JCGD COc1cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc(OC)c1OC 1796187995 RUJOEAHSBXQSOT-ACDBMABISA-N 482.342 0.887 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2[nH]ccc12 1796205400 QNKDTYXKXNHTAV-UTRJNVLQSA-N 463.498 0.900 50 20 JCGD CCOC(=O)C1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1796443667 AVKNSWYMEXNULP-MLYANYNQSA-N 459.503 0.053 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c1CCC3)C2 1796443963 SPQNDHYEOQYKCM-DHMDNZFNSA-N 453.503 0.167 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc(F)c1F)C2 1797753930 CYWZZPIRBACGGG-XGISUXEOSA-N 463.416 0.619 50 20 JCGD COc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)c1 1798107273 LCTHFEKRGSPBCA-BBIADKPPSA-N 496.568 0.640 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798522904 CROCPVQSLAHZIA-VLWCASSMSA-N 469.878 0.977 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnc(N)s2)[C@H]1c1cccnc1 1807275430 YVXKTSKYRKTRME-CXAGYDPISA-N 466.527 0.752 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(Cl)nn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362583 VYZOKBYSCVZPAH-UZLBHIALSA-N 465.706 0.838 50 20 JCGD CN(C)c1ncc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1 1807365621 ZEWGRYYLSMPYNX-FXAWDEMLSA-N 463.303 0.449 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807369323 GPZKQXODAIBXFP-NQSCKRDGSA-N 461.331 0.614 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374888 KTUXJTAGZJMEKU-YOEHRIQHSA-N 488.235 0.532 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)CC2)C1 1809973191 YKKAZQXVLXFCLB-SFHVURJKSA-N 450.348 0.739 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnn3cccnc23)[C@H]1c1cccnc1 1810303492 TZFBIWAOYGQXAB-JXFKEZNVSA-N 485.508 0.756 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1C 1811633369 GERYIVXMZZKYLI-QRWLVFNGSA-N 478.513 0.456 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812865116 UVIZZBYNVLDFSZ-XCRHUMRWSA-N 460.137 0.864 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1 1813072226 CFNVARACJNEKHS-HMRMIESSSA-N 457.579 0.932 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1 1813072808 GQJBLTDLKAJTNF-VGSWGCGISA-N 464.530 0.817 50 20 JCGD O=C(Cn1nnc2ccccc21)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815549847 YKGIWXIKWICARM-LJQANCHMSA-N 473.302 0.840 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(S(C)(=O)=O)cn2)n[nH]1 1816198341 ZUAFDAYNOYBAMI-KRWDZBQOSA-N 491.574 0.887 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472788 YBBOFWCLYCLPEN-GOSISDBHSA-N 454.292 0.905 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nccc3nc[nH]c23)[nH]n1)c1cccc(B(O)O)c1 1817475149 KWFZMDZMGKYAFZ-KRWDZBQOSA-N 459.275 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3nc4ncccn4n3)sc2C1 1818306743 QHVFFOMQRREWCA-JTQLQIEISA-N 478.498 0.119 50 20 JCGD CC(=O)Nc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)o1 1819784470 AKBOTWXZWJYXEE-CQSZACIVSA-N 468.300 0.914 50 20 JCGD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)N1CCN(C)CC1 1819797608 GIQAZXWZWRGJEI-KGLIPLIRSA-N 486.602 0.003 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccnc2c1OCO2 1820123161 OPGWNHSSNGIDDD-KRWDZBQOSA-N 463.259 0.833 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)C(=O)C(=O)O 1823009348 NWQYHJHQLVZHOV-LDWIPMOCSA-N 451.274 0.289 50 20 JCGD O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830734918 AFWHECAYFBVKDR-AVRDEDQJSA-N 476.917 0.519 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cnc1C 1833298968 WOTXSVBCARTJJD-HSZRJFAPSA-N 468.514 0.081 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798880 GLCRQGZKTDZUIF-LJQANCHMSA-N 478.402 0.825 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)nc3)CC2)CC1)c1cccc(B(O)O)c1 1834801073 JFDHAYLQNFUUAP-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1 1834825524 ZVKWKCNTONFDRE-SFHVURJKSA-N 452.309 0.813 50 20 JCGD O=C(CCc1ccc(F)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835925943 BWHHYGSBTVORPR-DEOSSOPVSA-N 488.296 0.347 50 20 JCGD O=C(/C=C/c1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935457 FUAHBULZRJAGEO-GTCGAKFVSA-N 450.300 0.150 50 20 JCGD O=C(CCCCn1cccc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937914 BEALXGXZWYAWGC-XMMPIXPASA-N 469.347 0.108 50 20 JCGD Cc1cc2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)[nH]c2cc1C 1835938573 ZNCRBJDUZXBMEL-RUZDIDTESA-N 492.341 0.243 50 20 JCGD O=C(c1ccc(Cl)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939309 LVPCPAACSIUCKL-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD O=C(c1cc2cn[nH]c2cn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837199223 CJWUXEVNPZRJFX-YOEHRIQHSA-N 456.272 0.718 50 20 JCGD Cc1cccc2c(C(=O)N3CCOC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)n[nH]c12 1837460032 QXGAWEGVAMKEDH-DEOSSOPVSA-N 493.524 0.254 50 20 JCGD CCc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)co1 1838135026 OPLCSGZANMGDOK-BHSKHCGUSA-N 472.502 0.441 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1839151707 AZUKBQUNQFQFIU-RTBURBONSA-N 462.330 0.702 50 20 JCGD O=C(CSc1ncccn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199748 SWTYQHJKPDRSHH-BBRMVZONSA-N 463.329 0.716 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)ccc1C 1839402965 SVJWMBHCFLZDKY-RUZDIDTESA-N 495.341 0.017 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1839667123 XYOXYDGQRFMOLJ-JTSKRJEESA-N 478.622 0.508 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N4CCN(C)CC4)cc3)C2)C1 1840149703 YIUVNKUICRXMPI-QPPBQGQZSA-N 495.020 0.762 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)C2)C1 1840149887 ALGMNRRPDGRFSE-JXFKEZNVSA-N 473.885 0.987 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840187343 UFYFNAFDTFXKGF-HSZRJFAPSA-N 475.546 0.088 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2c1 9930932 GEQPRFJECXUXLC-GFCCVEGCSA-N 484.556 0.167 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 11309297 XYODMVJFIWUDBS-INIZCTEOSA-N 468.871 0.888 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)[C@H]1COc2ccccc2O1 21191521 RPZNZZGLVZFZPC-MAUKXSAKSA-N 495.941 0.861 50 20 JCGD CCNc1nc(NCC)n2c(SCC(=O)NNC(=O)c3ccc4c(c3)OCCO4)nnc2n1 108206048 JNISPXKIHVYWBI-UHFFFAOYSA-N 473.519 0.707 50 20 JCGD CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)c1 725871377 GYNAYKGWONHWEX-UHFFFAOYSA-N 453.546 0.695 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)COc1ccc(C#N)cc1 726000195 MVRAKFRKZARCMD-GOSISDBHSA-N 492.941 0.971 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CN(C)S(=O)(=O)c3ccccc3)cc2)CC1 728213544 DZUSYSWCEOXUPZ-UHFFFAOYSA-N 481.600 0.387 50 20 JCGD CCNS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 728329520 BMCPDMJVRXGVJH-QGZVFWFLSA-N 481.458 0.268 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)NCc1cocn1)c(=O)n2Cc1ccccc1 730909261 BXZTZYLJFUWKLW-UHFFFAOYSA-N 494.512 0.583 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1)c1ccc2c(c1)OCO2 751267773 XOVMBTBYKGSGJX-UHFFFAOYSA-N 481.430 0.879 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)N[C@@]3(C[C@@H](C)CC(C)(C)C3)C2=O)n1 763949544 QSRBMESOEHEWCT-LAJNKCICSA-N 479.559 0.821 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1 913531855 ZCTPOLRIHPQLGS-UHFFFAOYSA-N 465.484 0.605 50 20 JCGD COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1C 916133373 JTXLOFLSHJSUTF-UHFFFAOYSA-N 472.907 0.810 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)cc1 916197549 XAMBHNBZZFZWFE-CQSZACIVSA-N 483.572 0.355 50 20 JCGD C[C@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919887083 XKEBBDDFPXMGQD-YUMQZZPRSA-N 453.340 0.146 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCN2CCN(C)CC2)cc1 920852806 WTHZTDTUVHTMQY-XDJHFCHBSA-N 465.558 0.705 50 20 JCGD CCNC(=O)CN1CCN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CC1 920853844 TXQATYHMKNGUHJ-XMHGGMMESA-N 493.568 0.621 50 20 JCGD C[C@@H](Sc1ncccc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)N1CCCC1 1325540911 ZSAKKCZJLFEVEA-OLZOCXBDSA-N 455.562 0.316 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc2c[nH]nc12 1777884557 UQJBRPAZBDBBCJ-HYBUGGRVSA-N 462.315 0.684 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc2c[nH]nc12 1779037089 NJCPOTJVLMWWNX-QHCPKHFHSA-N 463.498 0.627 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(n1)OCCO3)C2 1779373181 LCVNLPLBYPMXIX-NTKDMRAZSA-N 496.524 0.293 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccccc1O)C2 1779375366 LZARVXUCFCHMRV-HYBUGGRVSA-N 467.526 0.761 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1779403178 DMFKRCSHGWEJRA-LUXYFRNMSA-N 481.315 0.686 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1 1780416145 OQQDCLCYLBOZHA-VMHRPQTGSA-N 457.447 0.500 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)nn1C 1780435085 QTLNDRBHZQRXCC-DEOSSOPVSA-N 499.572 0.218 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1nccn1)C2)NC(=O)NCc1ccccc1 1780559601 VOQDUAMMWWSHTE-HYBUGGRVSA-N 498.588 0.138 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1780887662 IAHDVBBEAZUAQU-DEOSSOPVSA-N 474.363 0.568 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccncc1O)CCO2)NC(=O)NCc1ccccc1 1780968552 NREXQTBOPZWUAB-DEOSSOPVSA-N 482.541 0.577 50 20 JCGD COc1ccc(CC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C#N)c1 1781176646 LJIVXZANPRBTMH-QHCPKHFHSA-N 457.531 0.312 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC3(CC1)OCCO3)C2 1782213223 FRMXWIKLBIQMAT-AUSIDOKSSA-N 480.606 0.807 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc[nH]n3)C2)C1 1782789298 ARVFCIWMXMQOTN-YWZLYKJASA-N 455.943 0.914 50 20 JCGD O=C(CN(CCO)CCO)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1783261368 IKVYAOPHAARYQP-DENIHFKCSA-N 498.418 0.109 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1783355142 LEYDZYIBGAOBLR-YLJYHZDGSA-N 495.411 0.686 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1 1783535700 BRJBFQDXGVLKKV-HXPMCKFVSA-N 480.319 0.905 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CCO2 1783536673 HRIWMKRMWPBKFX-PRXAMGSTSA-N 450.330 0.443 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784093654 CYRQIZYSTHEQSN-WOYTXXSLSA-N 459.971 0.965 50 20 JCGD CNCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786853692 AAIALBRPMSNQQV-ACRUOGEOSA-N 474.606 0.312 50 20 JCGD CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc(=O)n4[nH]cnc4n3)cc2)CCC1 1788139252 GOKHLAGRCPRNKD-UHFFFAOYSA-N 466.502 0.538 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3cc4n(n3)CCCNC4=O)CCC2)cc1)c1ccc(B(O)O)cc1 1788141060 GPHNQLCBBCHGAD-UHFFFAOYSA-N 487.325 0.758 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3cc(=O)n4[nH]cnc4n3)CCC2)cc1)c1cccc(B(O)O)c1 1788143942 YHDHWBPOBRZLDV-UHFFFAOYSA-N 472.270 0.159 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(OCCCO)cc1 1789235904 SVQREVRYTFSLON-VJBMBRPKSA-N 482.342 0.035 50 20 JCGD C/C(=C\c1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791606619 VITXRSHTGNOCCE-DCPWPXLHSA-N 464.526 0.777 50 20 JCGD CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1792782991 LIBOMFWLVBCGFD-MUJYYYPQSA-N 450.001 0.513 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792983998 WPTAVRLNAUDHRM-VMKVGTKNSA-N 457.955 0.645 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOc1ccccc1 1795119527 MANNUBLIKHHJFI-VPTLXERWSA-N 453.499 0.357 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cnccc3n1)C2 1796442101 QVYFHTDJDOVPRW-WNICUGFOSA-N 475.509 0.967 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(F)cccc3n1)C2 1796443974 SSHFCHWVIJRETQ-DFZQMDCHSA-N 481.488 0.811 50 20 JCGD Cc1cc2nnc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)c(C)n2n1 1796927425 VNJJLEKUNWRNLZ-JLUCKKNBSA-N 455.288 0.635 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(O)[nH]1)NC(=O)NCc1ccccc1 1798866127 LBVITMHXSVCJIJ-BJWYYQGGSA-N 455.519 0.713 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)CCC(=O)NN(C)C)CC2 1801012682 FWHJDTRZAAWACA-RGKFVRLKSA-N 472.586 0.763 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1802862595 JLNAWFDSCXEWIS-LDQXTDLNSA-N 496.373 0.994 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1803162085 ZLHNOBOORBXQAQ-FCEUIQTBSA-N 450.348 0.565 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@@H]1COc2ccccc2O1 1804198961 YSPBVDJZHCGVEJ-IGKWTDBASA-N 487.321 0.921 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(Cl)nn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362580 VYZOKBYSCVZPAH-OXQOHEQNSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2n[nH]c3c2CCCC3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365595 YEUMEAGTMYIWKO-JPYJTQIMSA-N 473.342 0.997 50 20 JCGD N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807371139 QTSSDDKNHYTCPF-VQIMIIECSA-N 455.349 0.098 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375289 RUYVODPKDQNGJO-QUCCMNQESA-N 467.331 0.670 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c2ccccc21 1809978741 MKWDYRGOACYRKC-UHFFFAOYSA-N 490.369 0.565 50 20 JCGD O=C(C#CC1(O)CCCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810326795 IZDYKDUXJRFLOM-QPPBQGQZSA-N 475.354 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1 1811614704 ZNUKNWAYDLOMSX-AUUYWEPGSA-N 478.469 0.950 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCC3=O)sc2C1 1814594159 OBQQWIUXHINCCK-UQJRAWQTSA-N 471.543 0.812 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(-n2cnnc2)cc1 1814702460 KNGAYKUXZMBRSQ-KRWDZBQOSA-N 488.338 0.943 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1Cc3ccccc3CN1)CC2)c1ccc(B(O)O)cc1 1815340610 NEXLJQAHKPCEIU-QUCCMNQESA-N 476.367 0.763 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ccccn3n1)CC2)c1ccc(B(O)O)cc1 1815341298 WHBDSYJGFZKEAM-CQSZACIVSA-N 462.300 0.405 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cccc(=O)n1O 1816146602 NOMAZEWIYWKQAQ-MRXNPFEDSA-N 451.248 0.108 50 20 JCGD CC(C)CNC(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1817324979 AXZLCRHTSVRHMK-NSHDSACASA-N 459.532 0.140 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2[nH]nc3ccncc23)[nH]n1)c1ccc(B(O)O)cc1 1817471760 ZQYIAHVKQHCQKD-SFHVURJKSA-N 459.275 0.981 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)[nH]n1 1822410641 MYCVCQDERLLERO-OAHLLOKOSA-N 461.483 0.580 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)sc2C1)c1ccc(B(O)O)cc1 1822623952 WQUONSFFIGSLRW-DJIMGWMZSA-N 482.371 0.450 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1ccc(B(O)O)cc1 1823004892 WPXSGZDLBDVFEZ-GXFFZTMASA-N 456.102 0.739 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccnc2C(N)=O)CC1 1825398472 QYECSTJXCRFBGR-IBGZPJMESA-N 479.541 0.726 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1830538922 VNHIXJFQQXWZOZ-SYNHAJSKSA-N 469.380 0.439 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1830539100 AZABNYBHCBJNJH-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1O 1830735665 LIHRFAWHDICVCC-PXNSSMCTSA-N 455.895 0.020 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COCCOCCOCCOC)C2)C1 1831658527 WEEUPRDWRHEALP-DENIHFKCSA-N 495.013 0.547 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnc(N)s3)CC2)CC1 1834766404 DMHMHIRWIJHJMH-UHFFFAOYSA-N 472.575 0.223 50 20 JCGD N[C@H](CC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccnc1 1834800968 FJHMEDIZLPQVRA-HSZRJFAPSA-N 479.390 0.037 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n[nH]1 1834922705 DOERTAYQPWURPI-UHFFFAOYSA-N 453.352 0.151 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(s3)CCC4)C2)C1 1835929122 ARKJKGYRMQFHQL-QHCPKHFHSA-N 470.356 0.300 50 20 JCGD COc1cc(C)ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835933932 JCTDIZMXMVIEPV-XMMPIXPASA-N 468.315 0.067 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C2)C1 1835939938 PMTMZWONOREAOC-DEOSSOPVSA-N 498.772 0.822 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cc[n+]([O-])cc3)CC2)CC1 1836051933 ZHRVGACGFZMKJI-WPWMEQJKSA-N 481.557 0.639 50 20 JCGD CC#CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1837612757 LODZIECLNMDHLO-IGKIAQTJSA-N 490.365 0.634 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837948759 HPYMWEGGYALHPV-MSOLQXFVSA-N 461.302 0.481 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)nn1 1838831308 CSGYIQGJCYJBOP-PBHICJAKSA-N 461.288 0.636 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1)CCO2 1838850468 ZAWPUYPGSTXVCA-QADUPLGGSA-N 453.499 0.891 50 20 JCGD CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1838990056 JJGRNIXFUKHRPN-DEOSSOPVSA-N 452.316 0.313 50 20 JCGD COC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054246 OJWQFRHCYVLTOX-DEOSSOPVSA-N 491.589 0.214 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C3(C)CCC3)C2)C1)NC(=O)NCc1ccccc1 1839054426 YUQXMMAJCTUUFO-RUZDIDTESA-N 487.601 0.979 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(-c3cnco3)c1)CCO2 1839365616 VUDLLQQBCZTOPQ-VWLOTQADSA-N 491.309 0.405 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1839716333 GEFOKLBIIPKIOT-XXBNENTESA-N 497.976 0.148 50 20 JCGD CC(=O)NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802000 JQFMRLUYXDWVOY-SIKLNZKXSA-N 496.402 0.975 50 20 JCGD CCOc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn1 1840031394 ODMVWBVNQXTPDC-FZKQIMNGSA-N 457.325 0.729 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1840033352 AZZNCSSVDSVIAJ-KPOBHBOGSA-N 482.331 0.961 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1 1840154994 MDIWRMQEOCWNTR-KKSFZXQISA-N 451.907 0.505 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc(OC)c1C 1840755622 XLZYZCBGPZAUIT-VWLOTQADSA-N 498.341 0.076 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCCNC(=N)N)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841351079 FQEAMGAKFYYEPO-GJZGRUSLSA-N 489.017 0.336 50 20 JCGD O=C(c1ncsc1Br)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013702 BZLSGXGAWWUTFR-UHFFFAOYSA-N 450.123 0.716 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1843849175 WJGMABGEGOZYCR-KRWDZBQOSA-N 493.316 0.828 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@H]1COc2ccccc2O1 1847753827 XQEULZTXZMKMID-WBAXXEDZSA-N 451.483 0.731 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1848099646 XQYZHYISMSQBAI-QAETUUGQSA-N 489.953 0.815 50 20 JCGD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 17407205 AJGQXVPYOHXYBU-HNNXBMFYSA-N 498.583 0.139 50 20 JCGD CCN1CCC(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 726277890 HADCCDHOVKZHKP-UHFFFAOYSA-N 453.565 0.383 50 20 JCGD COC(=O)c1ccc(F)cc1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 727351313 IULDHQSUEOSJNY-UHFFFAOYSA-N 458.493 0.837 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1 728177925 NPYZQFKPBQWRER-QGZVFWFLSA-N 459.590 0.782 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccccc2O)ccc1Cl 728203744 MWTRTIISYVCRNW-AWEZNQCLSA-N 466.903 0.759 50 20 JCGD COc1ccc(OC)c(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cccc(C#N)c3)CC2)c1 728954921 SOGFFODHUNHDLB-UHFFFAOYSA-N 473.511 0.936 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)Cn1ccc2ccccc21 729540703 MCCPXSBRSWYQHJ-UHFFFAOYSA-N 458.496 0.929 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCS(=O)(=O)N1CCSCC1 730579243 CWCIZDVZWAYTGN-GFCCVEGCSA-N 495.421 0.925 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1 744895292 KJGBBSAPMFHSMY-UHFFFAOYSA-N 469.564 0.587 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)COC[C@@H]1CCCO1)N(S(C)(=O)=O)CC2 746385814 KFFSVYDFWNBMDO-DOTOQJQBSA-N 485.559 0.296 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1OC 770425012 QJJHLTXLHOXNLX-UHFFFAOYSA-N 451.457 0.215 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)cc1OC 787407261 XGGWVUWWQORDLC-DEOSSOPVSA-N 496.476 0.402 50 20 JCGD O=C(COC(=O)CNC(=O)c1ccc(Br)o1)NNC(=O)c1ccc([N+](=O)[O-])cc1 802264766 MFETUEXBQQBENP-UHFFFAOYSA-N 469.204 0.685 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)c1 825786567 RJYITPMTXQYBRA-UHFFFAOYSA-N 478.527 0.598 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cn(C)c(=O)nc3O)c2)c(C)c1 916097584 VPGBTEJHBLEEDK-UHFFFAOYSA-N 471.495 0.978 50 20 JCGD Cc1nc2ccnn2c(C)c1CCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 917316624 QEVPQMLFPPXEBO-SFHVURJKSA-N 453.455 0.809 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1)N[C@@H]1CCS(=O)(=O)C1 919884390 FZMAHLICKJFJIF-MRXNPFEDSA-N 478.552 0.569 50 20 JCGD CSC[C@@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1C(=O)[C@H]2CCCC[C@H]2C1=O 933651701 JLTCWBPJQLWMQY-XHSDSOJGSA-N 471.539 0.601 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778116934 JANUVXJZJNMYJU-IBGZPJMESA-N 461.657 0.339 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2 1778818212 UKVUTMOUAQVEHL-DRKDIEANSA-N 451.549 0.109 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3c1CCCC3)CCO2 1779030339 OILYIOFANIRTHH-JOCHJYFZSA-N 453.503 0.044 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)C1 1779034082 LVISDMNPKQQZCZ-LNPFQXMTSA-N 473.530 0.108 50 20 JCGD Cc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cn1 1779371053 LBDHZBTZFAOJRJ-XMSQKQJNSA-N 453.503 0.225 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780059747 HAJALRPCXNFTKZ-RBUKOAKNSA-N 454.314 0.769 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1 1780711780 CZAJZOQIQSEWKT-XHSVMWQWSA-N 454.351 0.801 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(O)c([N+](=O)[O-])c1 1780873717 ZPEAWKMBHXJMFA-NFBKMPQASA-N 483.286 0.422 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)C#N)CCO2)NC(=O)NCc1ccccc1 1780968852 KCFQNYSDYCHLAL-HSZRJFAPSA-N 456.547 0.712 50 20 JCGD O=C(COCCO)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1781319384 WQBCZSDIBZBQCM-YLJYHZDGSA-N 455.349 0.831 50 20 JCGD N#Cc1ccc2[nH]nc(C(=O)N3CC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c2c1 1782195498 WNJCLNOCWXFUHD-HSZRJFAPSA-N 474.481 0.190 50 20 JCGD O=C(c1nc2c(Br)cc(F)cn2n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1782559744 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C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](O)N3CCOCC3)sc2C1 1819892036 WLCNJWCERAUSDB-SEHCQNQUSA-N 451.376 0.942 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)sc2C1 1822627414 GCFPGVVZYWWWJM-BFHYXJOUSA-N 497.581 0.768 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1ccc(B(O)O)cc1 1823004889 WPXSGZDLBDVFEZ-GWCFXTLKSA-N 456.102 0.739 50 20 JCGD O=C(c1nc2ncccn2n1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053031 SXYORSCBSKIYDJ-LJQANCHMSA-N 462.319 0.351 50 20 JCGD C#CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCN2C(=O)OCc1ccccc1 1829134321 ZGUYDYUDOYIVPM-VWLOTQADSA-N 490.520 0.384 50 20 JCGD CC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](N)CN)C2)C1 1829221073 JVYIKMIELATVLC-SPEDKVCISA-N 465.982 0.742 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c2cc(O)ccc2n1 1830732164 VLIIMVHDCQBZAH-UGKGYDQZSA-N 463.918 0.919 50 20 JCGD CC(C)[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1830842534 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O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1 1835927221 MOJHWEDPFJHSAF-OFNKIYASSA-N 456.279 0.147 50 20 JCGD CC(F)(F)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934084 MSXHCQFUYKICSC-OAQYLSRUSA-N 454.279 0.118 50 20 JCGD CC(C)(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cn1 1835934528 XBOVCFUXOFNUDT-RUZDIDTESA-N 481.358 0.443 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3csc(C(F)(F)F)n3)C2)C1 1835938099 KYNFUBADBVTOGJ-IBGZPJMESA-N 499.276 0.226 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1ccnc1 1836778361 PYDSSDOKJJRPKS-INIZCTEOSA-N 469.546 0.755 50 20 JCGD O=C(c1cc(Cl)c2nncn2c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837367777 UYVLPAZTWATAPR-KBXCAEBGSA-N 458.302 0.052 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](COC(C)=O)OC(C)=O)CCO2 1837503472 VJBAQGDAASTLJH-BXWFABGCSA-N 493.351 0.111 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1837710352 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O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2 1840257499 XNWASMHHMQIAGO-RDGATRHJSA-N 464.327 0.166 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCc2cnn(C)c2)C1)NC(=O)NCc1ccccc1 1843033693 ISVOTWSJCJVAHY-UHFFFAOYSA-N 467.574 0.902 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CNC(=O)c1cccs1)C2 1843415552 WUOVASGCLAJXSM-ZVHZXABRSA-N 456.528 0.815 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cn3ncccc3n2)C1)NC(=O)NCc1ccccc1 1843770631 UOPICFPMMFQQGF-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H](C)N2CCN(C)CC2)C1 1845099359 QYAPLKHJZGMTCC-INIZCTEOSA-N 473.530 0.973 50 20 JCGD CN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1845123654 JFKBUEDQIKRYDP-GJZGRUSLSA-N 474.986 0.551 50 20 JCGD CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1847865389 QTOJCEMILGBERX-IHRRRGAJSA-N 450.927 0.043 50 20 JCGD O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)C(=O)NC1CC1 9889565 SAWDLZKQYRSPFT-UHFFFAOYSA-N 464.931 0.957 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1 726091528 MZSDMCFUZUZPNN-UHFFFAOYSA-N 479.584 0.970 50 20 JCGD O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1)C(=O)NC1CC1 726615419 NUVCWINXGHQESR-UHFFFAOYSA-N 460.468 0.298 50 20 JCGD COc1nc(C)cc(C)c1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 727605174 BDBPJMGPYCLFMI-UHFFFAOYSA-N 463.564 0.864 50 20 JCGD O=C(CSc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 728378249 QPPGHMNGLLBIBL-GDBMZVCRSA-N 497.574 0.937 50 20 JCGD O=C(NNC(=O)N1CCN(C(=O)c2ccccc2O)CC1)C1CCN(c2ncccn2)CC1 728959772 PGKNSXGXXGNPEU-UHFFFAOYSA-N 453.503 0.597 50 20 JCGD NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1 729231109 UNWYHQUVRABWQM-UHFFFAOYSA-N 478.513 0.819 50 20 JCGD Cn1c(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nc2ccccc2c1=O 729989943 UQZVOAZUNHSYAO-SFHVURJKSA-N 466.450 0.397 50 20 JCGD Cc1cc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1OCC(=O)O 748689973 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Cc1ccccc1NCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031765 XHXXHAUPURIVGY-HSZRJFAPSA-N 452.515 0.549 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccnc2C(N)=O)C1 1779941838 UFMZZTZFFDSHTC-ZUSMLRIVSA-N 458.346 0.939 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1780158252 WQKQHTPRRQGBKY-LAUBAEHRSA-N 454.907 0.533 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782158873 DJSDQCJIDDBIAL-FBROZUCGSA-N 484.358 0.249 50 20 JCGD CC(C)(C)OC(=O)N1CCc2nc[nH]c2[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1782849523 HOVOTTDEHPAXMQ-LBUQITIBSA-N 497.980 0.674 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)CC1 1782914381 LUGSGQSCGYRUQJ-MNQDVBFDSA-N 459.503 0.294 50 20 JCGD NC(=O)NCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783021150 ATHXYMXGUMQTHS-HNAYVOBHSA-N 453.337 0.491 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC34CN(C(=O)OC(C)(C)C)C4)C2)C1 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482.379 0.810 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ncccn4n3)C[C@@H]21 1790961455 JZMXABCJQDYIRN-FQUUOJAGSA-N 451.325 0.891 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1791054969 BZYCXFMJKPHCAB-QTVXIADOSA-N 478.384 0.635 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791290919 SCCFWBGTEYHNLV-BQFCYCMXSA-N 485.545 0.406 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2)[C@H](O)CCl 1792980982 BTXSJEMFBLKSLE-USYVTKNRSA-N 451.951 0.077 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1C(N)=O)NC(=O)NCc1ccccc1 1794564131 BXQYAXFLNDGQMW-REPLKXPHSA-N 493.568 0.779 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737772 RFZNSQNZMIEPDN-RMFSNUHRSA-N 489.378 0.265 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c(Cl)c1 1795740970 UBXZMCXBOXGPBB-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1796301502 VJBMRKSNNLGYIP-XFMPKHEZSA-N 464.357 0.247 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796444039 VTSVGQZUOJZGHL-LHGZKFJMSA-N 463.491 0.272 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1797279252 HMZRLEWGRUSLKX-MTCCJSQRSA-N 463.934 0.525 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1[C@@H]2Sc3ccccc3[C@H]21 1797762978 HYHCACHCKXDHOF-ZSQJQDDOSA-N 464.352 0.458 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3cccnn13)C2 1799276825 MFXQILKMPZWJMP-FIXGWNCBSA-N 454.314 0.529 50 20 JCGD CCOc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1OC 1800858018 FWMMAEVEHSZDAD-NHKMSHSESA-N 482.342 0.220 50 20 JCGD C[C@H](Cn1cccn1)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1804724205 ZXZZTDGIQKTEKH-JUXOCIIHSA-N 455.563 0.993 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373759 FZZVUCVPOBMSCI-BAGYTPMASA-N 466.347 0.386 50 20 JCGD Cc1ccn(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810294506 LNBQAUYUEBTODU-LAUBAEHRSA-N 462.514 0.605 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810295689 VNEHBQAKVFUJFJ-CTUFNNTOSA-N 477.525 0.258 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303266 RRQGKVSQADFRKP-PTSWNOGYSA-N 465.514 0.090 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1 1810350527 CKJAOMQZNIJUPN-CIWUYKSXSA-N 459.374 0.974 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1 1811270054 LXAGSPONLIGMNP-VGOFRKELSA-N 464.530 0.817 50 20 JCGD COc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1OC 1811644112 ITWZWGFAPGXRHA-GCJKJVERSA-N 490.325 0.807 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnc(N(C)C)o2)[C@@H]1c1cccnc1 1813069769 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CC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CNC(=N)N)C2)C1 1829220660 BTROYOBXACVUNV-JTSKRJEESA-N 478.981 0.939 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1830352553 PXYYIIKXSJOTSO-IOFRSVQKSA-N 471.913 0.157 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1830539551 IFRMZHCVLSMQIB-SGTLLEGYSA-N 471.308 0.276 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cccnn3)C2)C1 1830546172 PUYCKOIFAHTSEQ-KBXCAEBGSA-N 457.325 0.343 50 20 JCGD O=C(c1cc2ccc(Cl)cc2nn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830727764 DFTNCUXMCXQHJY-XLIONFOSSA-N 469.325 0.953 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1831654383 KQPMTKRKUKFSDH-HRAATJIYSA-N 485.006 0.755 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832072485 HCPWFJPMPPBINB-QHCPKHFHSA-N 492.259 0.096 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(O)C(F)(F)F)CCO2 1832166257 KYAYJVXMRBRKFW-TUKIKUTGSA-N 461.275 0.930 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)COc2cccnn2)CC1 1832192311 WXUNNIVGURYZKN-HXUWFJFHSA-N 452.320 0.469 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cn1 1833310538 MOVNWSVYBRIDQR-LJQANCHMSA-N 487.022 0.411 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n1 1833338886 AKQQQLYKVKHFCG-YJYMSZOUSA-N 469.336 0.893 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833400430 SQICASGYJYKYJD-OALUTQOASA-N 494.397 0.791 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(N3CCOCC3)cn1)CCO2 1833614825 KIKLFNDPTJHCFJ-QHCPKHFHSA-N 492.649 0.840 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3CCC(O)CC3)CC2)CC1)c1ccc(B(O)O)cc1 1834798963 JBLOJFSYJCDFQQ-UHFFFAOYSA-N 457.380 0.103 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834799878 KQCZSQZUGDVUMO-GOSISDBHSA-N 467.379 0.084 50 20 JCGD NC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1 1835817503 FHTWNDOSEAXJHU-BXWFABGCSA-N 458.328 0.876 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1 1835927219 MOJHWEDPFJHSAF-NFBKMPQASA-N 456.279 0.147 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@H]1SC(=N)NC1=O 1836718090 RQOPMYYADRUGMR-TUKIKUTGSA-N 460.984 0.387 50 20 JCGD Cc1cc2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)[nH]c2cc1C 1837342048 RKKLPOLDGWUSBF-UWJYYQICSA-N 450.923 0.849 50 20 JCGD COc1cc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460313 AUWNFOYGCHFXBC-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1 1837655694 TWHNHDWNWBOHCJ-BEFAXECRSA-N 462.330 0.824 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1C 1838942992 LNOPFAYKPWDWNP-XMMPIXPASA-N 452.316 0.367 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)CCO2 1839075600 BAQLGQLQIHQHTK-VWKPWSFCSA-N 477.986 0.952 50 20 JCGD O=C(Cn1cc(Cl)cn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199101 JDGSGUNEEHTAPR-HIFRSBDPSA-N 453.696 0.683 50 20 JCGD O=C(c1nccc2nc[nH]c12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199452 OIUZELZSUYMDTH-YOEHRIQHSA-N 456.272 0.718 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3C1)CCO2 1839992327 FVLHDXPEHWDMPZ-RXFWQSSRSA-N 493.564 0.560 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840105516 OCDCOHPFKOZYML-OALUTQOASA-N 450.363 0.692 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cc3F)C2)C1 1840182815 JIKIHZWGHRDKAU-NRFANRHFSA-N 470.929 0.922 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)[S@@](=O)c1ccccc1 1840186086 ZGRAZGRSDCCWHY-WKLFCCHUSA-N 494.614 0.012 50 20 JCGD O=C(/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)NCc1ccco1 1840188738 ZRUUYLOFUWWCIR-RTLBZRNLSA-N 460.314 0.712 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)C1CC1 1841139917 KZDVFYQMBQNGQS-UHFFFAOYSA-N 457.336 0.583 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CCCC13CN(C(=O)c1cccc(B(O)O)c1)C3)C2 1847095017 UHPLKUKFXZSSIV-SLFFLAALSA-N 483.374 0.971 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccccn1 14049431 LHDAHDSXCJTVMN-SHRNQRGKSA-N 466.541 0.236 50 20 JCGD O=C(COC(=O)c1ccc(N2C(=O)CCC2=O)cc1)NNC(=O)[C@H]1COc2ccccc2O1 104489099 WZSGFOQZJAGNOO-QGZVFWFLSA-N 453.407 0.484 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1 725874117 XLEYMOMKFHMYDJ-UHFFFAOYSA-N 459.937 0.440 50 20 JCGD COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)CC2=O)cc1 726523177 DPJWFDXOMPKBFB-QGZVFWFLSA-N 474.539 0.755 50 20 JCGD O=C(NNC(=O)N1CCN(C(=O)c2cccc(O)c2)CC1)C1CCN(c2ncccn2)CC1 728961161 AREKZLFMFUKUIX-UHFFFAOYSA-N 453.503 0.597 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1 751209852 WIMUAGAELVTVPB-UHFFFAOYSA-N 451.530 0.121 50 20 JCGD C[C@@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OCC(=O)NNC(=O)c1cccs1 811679319 ARVFRCJVMIBTOK-GFCCVEGCSA-N 482.540 0.121 50 20 JCGD O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2)CCN1 916391571 DISBTRXYFGXUCG-UHFFFAOYSA-N 477.481 0.294 50 20 JCGD CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 916486029 UBWZKPSNJOZJSZ-UHFFFAOYSA-N 495.583 0.523 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(S(=O)(=O)N(C)C)CC2)N(C)c2ccccc21 919709216 BNALZRIIQXTBND-UHFFFAOYSA-N 460.560 0.608 50 20 JCGD Cc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)NCc1ccccc1 919885103 MUZHOPCJLGMZLB-QGZVFWFLSA-N 480.568 0.605 50 20 JCGD C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)C1 919886392 WDNKOWYLRNINLS-DZGCQCFKSA-N 458.562 0.238 50 20 JCGD NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 920031326 COJWEEXLJOHLQP-GNJLHFKMSA-N 498.565 0.544 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC[C@H]1CCOC1)N(S(C)(=O)=O)CC2 1319045935 CIFKHJXXMSTWET-CJNGLKHVSA-N 470.548 0.320 50 20 JCGD O=C(CN1CCC(CO)CC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 1336957600 WCDRYTVACXYRKM-UHFFFAOYSA-N 460.556 0.630 50 20 JCGD CC(C)(C)OC(=O)N1CCn2ncc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2C1 1778375891 DYWFTDWRKNRLCK-HTAPYJJXSA-N 497.980 0.677 50 20 JCGD Cc1cnn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1 1779373443 RYWOJKPQTYXUSJ-XMSQKQJNSA-N 455.519 0.018 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]cc3I)C2)C1 1779544871 MEBSLSZORAGLJK-BONVTDFDSA-N 482.706 0.712 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968151 AXNOHNYGWQZCFA-NBGIEHNGSA-N 497.600 0.695 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(N4CCOCC4)c3)C2)C1 1781737355 OCVBIBASRYVALH-DEOSSOPVSA-N 473.574 0.340 50 20 JCGD CC(C)C(=O)Nc1nc(O)c2ncn(CC(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)c2n1 1782885704 KLENDDRDQBDQRF-VBKZILBWSA-N 497.915 0.491 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)c2c1 1785179869 KNDWCHMMUMHLPN-OEOAZWSVSA-N 475.354 0.992 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979633 FXEDPFLSGRBCJR-USKVXJDGSA-N 479.342 0.223 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)c3ccccn3)C[C@@H]21 1787508559 AQLYYEIUXCPEEO-AQKJHKAUSA-N 467.530 0.195 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)n3nc(C)ccc3=O)[C@H]2C1 1788733532 YVCDESLATXPYBJ-QAETUUGQSA-N 454.955 0.520 50 20 JCGD CN(C)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726756 UHFBZNKUBSAKIU-ACRUOGEOSA-N 474.606 0.264 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cnc[nH]3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726844 XFZNYODNQFXHRF-JALQXSOPSA-N 495.584 0.749 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C#N)nc3C(F)(F)F)C[C@@H]21 1791289209 NVVTYXZSVBFUBU-JQFCIGGWSA-N 496.490 0.938 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791291365 UCSXSYZBCNFXLT-JYJNAYRXSA-N 462.576 0.671 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)C2 1794142786 QEYDGIZNQBRTHR-OPDFLTKYSA-N 494.940 0.197 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796192623 NMXSJYHIMXPNBO-REPLKXPHSA-N 459.352 0.923 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)[C@@H](O)C1 1797309080 ZGSSPGLKWKZMTJ-WHDKQWSOSA-N 489.997 0.184 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc([N+](=O)[O-])c1)C2 1797748658 QLZIGOUWBDEVAS-VPTLXERWSA-N 482.497 0.429 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(Cl)Cl)csc2n(C)c1=O 1801017197 BEQXPVIVEBODOX-GNXNZQSNSA-N 489.381 0.235 50 20 JCGD CCCNC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1803440682 WOCXIQNCKQKWPJ-AUSIDOKSSA-N 466.347 0.387 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803585338 QYPCIPRNNAZXRD-OGWOLHLISA-N 488.570 0.080 50 20 JCGD 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N=C(N)SCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551723 TUELMJIWNOGSQT-IERDGZPVSA-N 498.005 0.665 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830538581 KDPCAYOCGOLAOD-HNAYVOBHSA-N 473.368 0.631 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1830540391 PSTQJKZSZZCLMY-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD C[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830728612 WFPYGVYDLQZXAI-STXHMFSFSA-N 463.959 0.346 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737013 CJTRRAOHVFSYJQ-ZOCZFRKYSA-N 475.970 0.512 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737492 FFZXBBAMDGNXLQ-MDOVXXIYSA-N 463.959 0.346 50 20 JCGD O=C(c1cnccc1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1834108675 HDIVHNICZFYORH-RHSMWYFYSA-N 451.829 0.770 50 20 JCGD Cc1oncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834240988 AUUIHHVNIWZAFG-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1834823297 MZZXFZLHSUPGMJ-SFHVURJKSA-N 452.309 0.584 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834988448 UDXJERMOTJURPQ-UHFFFAOYSA-N 462.551 0.051 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)n(C)n3)CC2)CC1 1835118303 MHEVARZTZVTGDB-CVKSISIWSA-N 484.561 0.445 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(=O)CNC(N)=O)CC2)CC1 1836107440 MWJDZYKDEVBCKC-UHFFFAOYSA-N 490.517 0.374 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)C1 1836712290 RRFASRWFWQUJOP-MOPGFXCFSA-N 486.374 0.568 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccn3)CC2)CC1 1837411473 DWXYPTGKKOABCZ-UHFFFAOYSA-N 453.503 0.401 50 20 JCGD C[C@@H](Cc1ccco1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837461616 ZZHMDUGJLDTFCG-HJPURHCSSA-N 471.514 0.227 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc[nH]n3)C2)C1 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COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1840154996 MHXNDWZBXBULRL-IFXJQAMLSA-N 455.874 0.192 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccc(C)c34)C2)C1 1840155279 VWMLIZFICOYZIC-DYESRHJHSA-N 450.923 0.967 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1 1840184783 BHQDTGZMKDQZRY-NRFANRHFSA-N 481.481 0.177 50 20 JCGD NC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1840921546 DUEGXNIMFMLUQX-OXJNMPFZSA-N 483.363 0.117 50 20 JCGD CC(=O)c1cc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n[nH]1 1842336809 IXYWLRGWGBGOLJ-UHFFFAOYSA-N 467.530 0.776 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)C2)C1 1843012341 FEGNSAYSQKYMHE-UHFFFAOYSA-N 483.374 0.831 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2(C)CN(C(=O)OC(C)(C)C)C2)C1 1843948788 ZGQCPLDXWKRMSN-UHFFFAOYSA-N 451.568 0.820 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CCCC23CN(C(=O)CCBr)C3)N1 1845873665 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Cc1ccc(Cn2nc(C)c(C=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)c2C)cc1 730570318 HMCODNYORPQKCM-UHFFFAOYSA-N 455.544 0.891 50 20 JCGD CS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1Br 749162005 SPTMDQWCMNGHHB-UHFFFAOYSA-N 465.289 0.903 50 20 JCGD CNS(=O)(=O)c1ccc(-c2ccc(/C=C(/C#N)C(=O)c3c(N)n(C)c(=O)n(C)c3=O)o2)cc1 810209505 GBBGFACWLQYJQB-RAXLEYEMSA-N 469.479 0.624 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccncc1 821887171 NHWYXZZPOVRYIQ-DZXKJOIRSA-N 466.541 0.236 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1c(C)nsc1NC)c(=O)n2Cc1ccccc1 901388714 WQHYMXNXMMKOKL-UHFFFAOYSA-N 496.553 0.696 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(S(=O)(=O)NC[C@H](C)O)cc1 915474835 DDAXNXFVFSYWGV-LBPRGKRZSA-N 499.929 0.626 50 20 JCGD O=C(CCS(=O)(=O)C1CCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 915685864 OWCYISWDRVGNET-UHFFFAOYSA-N 457.574 0.980 50 20 JCGD O=C(CS(=O)(=O)CC(=O)Nc1cccc(Br)c1)NNC(=O)c1ccccc1O 916148262 PZBSVEMNPVSJCI-UHFFFAOYSA-N 470.301 0.969 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)c1 916253741 JIOZDSACJYDQBL-UHFFFAOYSA-N 475.593 0.133 50 20 JCGD COc1cc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccccc2)cc(OC)c1OC 916295079 HSNGGXJRJCVJBI-UHFFFAOYSA-N 452.489 0.635 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc1 920309553 XKFNTRRTDLTQIQ-UHFFFAOYSA-N 493.560 0.168 50 20 JCGD COc1cc(F)c(S(=O)(=O)NNC(=O)CC(C)C)cc1S(=O)(=O)NNC(=O)CC(C)C 920757359 AKBWECZVOWQNBN-UHFFFAOYSA-N 482.556 0.546 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1COc2ccccc2O1 1317697942 BBEPTWNNDWSLHK-HXUWFJFHSA-N 475.523 0.628 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1777705326 ZRZMUGRSRYIWCU-XZZBMYDMSA-N 493.524 0.633 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1ccco1)C2 1778091097 MYAJQCXOCGGEAN-KBDRGJQMSA-N 498.540 0.657 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnncc1C(=O)O)C2 1778092620 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C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F)n1cnnn1 1800334661 VUBLSCMBCBANAD-DVFMFOFASA-N 457.441 0.709 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CC(=O)OC)NC(=O)OC(C)(C)C)C2 1800981412 MREZJHJYZOBXND-LBKYZSNHSA-N 491.969 0.286 50 20 JCGD O=C(CNCP(=O)(O)O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1807021073 FYXOSYCZTFJYCT-XJKSGUPXSA-N 463.269 0.597 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807372102 AKTICLRODGYDFG-PHLAKWFUSA-N 450.304 0.121 50 20 JCGD CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808228790 HTHNVAHKYSWPAM-GCMWRYGPSA-N 482.545 0.668 50 20 JCGD COCCn1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1808653101 OPDLUEJJKGQRDO-DENIHFKCSA-N 477.330 0.238 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1)[C@@H](F)Br 1808679429 XYOLHFIHKNEHTG-USXIJHARSA-N 461.332 0.065 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1 1809778039 ZSXIRKPPFHMFGZ-OXQOHEQNSA-N 485.508 0.756 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302601 MABFFAOUSUTWMW-UTKZUKDTSA-N 492.540 0.556 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1810438092 ZLVSBKLWHJJQMV-OXXUSNJHSA-N 460.922 0.296 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1 1813072212 BRPIYWYDEGVWGT-RDTXWAMCSA-N 473.452 0.566 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H]2CCc3nc[nH]c3C2)[C@@H]1c1cccnc1 1813326892 VPXZKPLOIKQKEK-JIGPKXGUSA-N 488.552 0.928 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1 1813497166 SMYILFMLNMRRIM-AOMKIAJQSA-N 475.509 0.743 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]nc3ncccc13)CC2)c1ccc(B(O)O)cc1 1815340374 LAEXLSUZTGKTBX-ZDUSSCGKSA-N 462.300 0.634 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1nc(O)n3c1CCCC3)CC2)c1cccc(B(O)O)c1 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O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4)CCCC3)C2)C1 1835934404 YPHBVCFYBGYJFC-SANMLTNESA-N 492.381 0.948 50 20 JCGD COc1ccc2oc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2c1 1835936773 CJKFFNROQVVDHO-VWLOTQADSA-N 494.309 0.505 50 20 JCGD CCc1c(Br)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)nn1C 1836276441 OOESMSSXWLLWGY-FZKQIMNGSA-N 493.786 0.415 50 20 JCGD O=C1COc2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)cc2N1 1836994591 QREIACXEBZINKN-LJQANCHMSA-N 458.298 0.891 50 20 JCGD Cc1ccncc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837456001 APYFHNFSHILIPS-DEOSSOPVSA-N 482.541 0.091 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)N1CSCSC1)CCO2 1837573967 KFODYZPDRDLHBL-RLFYNMQTSA-N 468.041 0.740 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)NCc1ccco1 1837637205 WHQGTNXEUQDBGO-PABLAQFASA-N 488.310 0.599 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920755 BODGPGGEJJCPLE-GOSISDBHSA-N 481.358 0.841 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cc[nH]c3cc1F)CCO2 1838571964 GLPWKRUUCWQTNJ-DEOSSOPVSA-N 481.289 0.371 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(N(C)C)cc1)CCO2 1838962918 YEMKONCLJRSBRY-RPUKTSEFSA-N 496.568 0.957 50 20 JCGD CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839138009 BGAMYBTUEZSZDD-FSTVOOFJSA-N 492.013 0.982 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C2)C1 1839198309 BWTMVOJLPYWWDH-LIVBEALHSA-N 490.370 0.924 50 20 JCGD COc1cc(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1839254640 GPHIGNVNCBOXIP-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1 1840184939 CKKSDUADIMYGKD-RUZDIDTESA-N 498.584 0.374 50 20 JCGD CSc1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185884 UYRJQNXZZLEJJM-OAQYLSRUSA-N 465.576 0.247 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840392948 AMVIMSBIOQYSHY-VGOFRKELSA-N 479.603 0.392 50 20 JCGD COCCOCCOCCOCC(=O)N1CC2(CCCN2C(=O)[C@@H](C)CBr)C1 1841289436 ADXLEIVUBCBRSS-INIZCTEOSA-N 465.385 0.917 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039019 UXHOSXAAJXZKNE-KRWDZBQOSA-N 473.578 0.244 50 20 JCGD C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H]2CSCN2C(=O)[C@@H]2CCC(=O)N2)C1 1845873464 UEULWSHCBBMDNO-HZSPNIEDSA-N 487.420 0.401 50 20 JCGD COc1cccc(-n2c(CC(=O)NNC(=O)CCNC(N)=O)csc2=NCc2ccco2)c1 726185401 KTIRIHTXFCLUCS-UHFFFAOYSA-N 472.527 0.990 50 20 JCGD COCC[C@H](C)NC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 726261945 XWRAUWQYIYMZSR-BBRMVZONSA-N 472.564 0.708 50 20 JCGD Cc1noc([C@H](C)NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 726278125 GQHUYABAPWOFGH-ZDUSSCGKSA-N 466.520 0.423 50 20 JCGD CC(=O)NC(C)(C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 726768643 LAYHNFMGMOQJMB-UHFFFAOYSA-N 497.556 0.126 50 20 JCGD CCOc1cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)ccc1OCC(=O)N1CCCCC1 729276990 QMLXBYLVXQUYMO-AWEZNQCLSA-N 470.548 0.175 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)s1 729614971 VFTLFTLBKIATSP-MRXNPFEDSA-N 452.624 0.702 50 20 JCGD O=C(COc1ccc(OCc2ccccc2)cc1)NNC(=O)NCCS(=O)(=O)N1CCOCC1 748111802 NLKGUOUVHHABKJ-UHFFFAOYSA-N 492.554 0.637 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1 831688166 KWXQRHQBVIHEQY-UHFFFAOYSA-N 482.902 0.581 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ccc(-n2cncn2)nc1 861630928 RANHLKANPQMXNA-UHFFFAOYSA-N 455.500 0.912 50 20 JCGD N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccc(Br)cc2)cc1 913457355 ASPCJCNIXNEEAH-UHFFFAOYSA-N 467.301 0.825 50 20 JCGD CCOC(=O)N[C@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)C 915059767 UAMJYSGXSYAVPO-IBGZPJMESA-N 484.575 0.558 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)c1 916295692 RVGLYVHJAOIODF-UHFFFAOYSA-N 474.948 0.666 50 20 JCGD N#Cc1ccc(NCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nc1 916520945 PROVIKAPSZFUMU-UHFFFAOYSA-N 457.516 0.794 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc2c(c1)NC(=O)CO2 917510608 VGHAHYLHTVXLPG-UHFFFAOYSA-N 488.522 0.432 50 20 JCGD CC(=O)Nc1ccc(O)c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 919805739 LEBMGBVTLKPPQC-UHFFFAOYSA-N 490.538 0.765 50 20 JCGD CCOc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1OCC(=O)N1CCCCC1 919883020 AAIURJRBJMDXRP-MRXNPFEDSA-N 482.559 0.608 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc2c(c1)OCCO2 920428146 ATCVWDPCOWUTDT-UHFFFAOYSA-N 450.429 0.496 50 20 JCGD CS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 1115878586 CCWRZSPLCHHKQJ-UHFFFAOYSA-N 453.546 0.669 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)CC2)o1 1317874849 WWWCWNMAUTYUIO-HNNXBMFYSA-N 491.588 0.349 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778114285 BFUSVRKTBSZXED-ROUUACIJSA-N 470.419 0.724 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1 1779031221 NXOGSQSWCBPPJG-HSZRJFAPSA-N 476.497 0.023 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)C3=Cc4ccccc4NC(=O)C3)CCO2)C1 1779032447 KAZXKRUAYKPIEF-VWLOTQADSA-N 490.520 0.554 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1n[nH]c2c(F)cccc12 1779095642 ODWDCXNWNRXXDP-NTKDMRAZSA-N 480.305 0.823 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969936 OMQYJVHBGCMPSQ-GTCGAKFVSA-N 487.557 0.282 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(F)cc([N+](=O)[O-])c1 1780993788 HCTPLSSEZKOJLB-NFBKMPQASA-N 485.277 0.855 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCCN3C)C2)C1)NC(=O)NCc1ccccc1 1781030806 CQPHARCOHUYRFI-SQJMNOBHSA-N 486.617 0.647 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccncc1=O)C2 1781904940 GTGWNWKJCQMUJR-QMTMVMCOSA-N 455.353 0.931 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783940670 YMEUPDFFWGRKFO-GAZXMLTASA-N 493.605 0.659 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1785598580 RMGQEPMSLBHYSK-IHPCNDPISA-N 498.584 0.853 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCS(=O)(=O)c3ccccc3)[C@H]2C1 1786585258 AMFDUZWATTTWSZ-IHPCNDPISA-N 494.614 0.203 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1 1786981926 GWMVCYIKHYCMNR-NYVOZVTQSA-N 465.315 0.232 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CS(=O)(=O)C4)[C@H]2C1 1787152460 NCYSRAOLOOKYLN-XEZPLFJOSA-N 470.624 0.283 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccn4n3)[C@H]2C1 1787261858 IWSLJKRWHUEQII-HRZAHRDASA-N 478.513 0.457 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791290656 HMFSIUHKLOYRAY-ULQDDVLXSA-N 469.583 0.252 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794111269 KHQNMRXMBOGASZ-JNZVMSIHSA-N 483.363 0.756 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1794405050 QEBGLHXQJUYBHH-JLUCKKNBSA-N 478.340 0.520 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(C(F)(F)F)(C1)C3)C2)c1ccc(B(O)O)cc1 1795732744 FYBSADQSJOPUDP-KYNXIJSSSA-N 452.238 0.302 50 20 JCGD CN(C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)c1ccc(Cl)cc1 1795736706 GNSDKEDEXBUALH-GMQQQROESA-N 485.777 0.526 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OCc1ccccc1)C2)[C@H](F)Cl 1796370393 HZELMWFYAFYSCY-QSMSVPEVSA-N 483.924 0.882 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccccc2n(C)c1=O 1797524081 QOYDESUKQJJOQM-MUJYYYPQSA-N 454.531 0.558 50 20 JCGD Cc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)n1 1799094972 MRERYBLUTNFSRC-JHDGKUDLSA-N 480.569 0.939 50 20 JCGD COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c(OC)c1 1800418652 XERHVGFYMOSTPM-MRSFGVLCSA-N 476.574 0.599 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1800714856 DNUFOTMZRROJHU-GAMODTGLSA-N 471.982 0.823 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cncc(C(F)(F)F)c1)C2 1801012084 AXYFUPPFRVUEGN-VPTLXERWSA-N 485.507 0.996 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801964234 UGRVURKADJWNGG-LTCOOKNTSA-N 490.561 0.192 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1803035811 BNWTXXPDVCOGDR-VVLHAWIVSA-N 470.954 0.573 50 20 JCGD CN(C)c1ncc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)o1 1805340917 KECSJJSLADTQLQ-BEFAXECRSA-N 478.513 0.768 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cc(=O)n2[nH]cnc2n1 1807352333 FDUPANCAARIDFU-DYVFJYSZSA-N 474.319 0.917 50 20 JCGD N[C@H](CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccnc1 1807364207 PIWGWVBCLOXPNS-BKULYWANSA-N 473.342 0.566 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377263 ZUUKAMSWXIHWJG-NZQKXSOJSA-N 496.336 0.976 50 20 JCGD O=C(CSc1ncccn1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807571289 NFRGZDJFJFPFRP-WIYYLYMNSA-N 477.355 0.663 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1808250191 IOGYWNJKDSRXHK-LNLFQRSKSA-N 456.996 0.835 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1 1808285424 BOKGIKXOMNRFPM-CXAGYDPISA-N 476.440 0.510 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cnnn2C)[C@@H]1c1cccnc1 1808409941 PZIJNPJSTJXUJN-CPJWQURSSA-N 463.502 0.664 50 20 JCGD CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1808446706 BHPHUHPOHQUJSO-LPHOPBHVSA-N 467.530 0.172 50 20 JCGD Cc1nc2ncccn2c1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1809303058 VORFBSWOYQWSMN-DENIHFKCSA-N 484.325 0.746 50 20 JCGD O=C1Nc2c(C(=O)NC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)cccc2C1=O 1810026216 JNYQYWWCEUVLLJ-JTSKRJEESA-N 498.304 0.530 50 20 JCGD CC(=O)c1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n[nH]1 1810298723 LZIXZYYECGNXRH-QRWLVFNGSA-N 476.497 0.639 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1 1810303844 ZBVWQBPVJZDAET-IERDGZPVSA-N 474.525 0.856 50 20 JCGD Cc1ncncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810973623 LVJABIUQDGIQPD-JXFKEZNVSA-N 460.498 0.812 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](COC(C)=O)OC(C)=O)[C@H]1c1cccnc1 1813030267 AIDLXVSXVKEJOA-VJANTYMQSA-N 469.922 0.836 50 20 JCGD COc1nccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1825507404 IYAAPKBLVVBGJP-IBGZPJMESA-N 452.320 0.712 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](C)NC=O)C2)C1 1829340828 PUGTZVAZJPDBDZ-HFJQGTKSSA-N 494.976 0.827 50 20 JCGD O=C(C(O)O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc1ccccc1 1829360230 ZBSLOIUQTLBAIF-LJQANCHMSA-N 460.314 0.553 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccnn3)C2)C1 1830546173 PUYCKOIFAHTSEQ-KDOFPFPSSA-N 457.325 0.343 50 20 JCGD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726170 OPBGMPXISCDPHU-GHTZIAJQSA-N 480.905 0.606 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CCN3CCCCC3)CC2)CC1 1834529533 GOULORXGFYSPGF-UHFFFAOYSA-N 464.655 0.807 50 20 JCGD COc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1O 1834798075 RBFXYVITWFGNEK-UHFFFAOYSA-N 495.385 0.509 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834800362 DIVUOHCWBLNBEF-UHFFFAOYSA-N 492.385 0.824 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1C 1835736974 DEWAWOMZXSMOQV-UHFFFAOYSA-N 468.562 0.226 50 20 JCGD O=C(c1ccc(Cl)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932135 PVEMIXAAZQCLGP-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD O=C(c1ccc(C(F)(F)F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939119 FYVGZOACCTYVAC-JOCHJYFZSA-N 492.259 0.769 50 20 JCGD N#Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(Cl)c1 1835939353 NHFPDLLLXIKYRS-QHCPKHFHSA-N 483.717 0.275 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(=O)C(=O)N(C)C)CC2)CC1 1836107392 IOVGLGCITCWPPJ-UHFFFAOYSA-N 489.529 0.794 50 20 JCGD C[C@@](O)(C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(F)(F)F 1837020796 SPTKNOXJRKOWHO-HXUWFJFHSA-N 472.269 0.292 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4scnc4c3)CCO2)C1 1837064802 OMXPBKIWAIZAAI-HSZRJFAPSA-N 496.549 0.679 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)CCO2 1837471241 XURCRMYLYWGWMK-OACYRQNASA-N 452.960 0.930 50 20 JCGD Cc1noc(N)c1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1837860629 KCKZGQJGORHLFF-UHFFFAOYSA-N 450.540 0.550 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838394687 NFUZNARSAIALTB-MRXNPFEDSA-N 460.579 0.638 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049609 MGQZDWJPTBLRNI-IFXJQAMLSA-N 466.336 0.512 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1839203280 HJDGFMYRJIKELY-MRAWALMUSA-N 459.316 0.662 50 20 JCGD COc1cc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(F)c1 1839333223 WHEHZDSWNXBTOZ-HSZRJFAPSA-N 490.268 0.037 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1OC 1839374527 QMUGPNUDAVPMBD-JLTOFOAXSA-N 460.886 0.513 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839651424 DHUMJTRQRWSMKT-ACJLOTCBSA-N 457.325 0.355 50 20 JCGD O=C(O)C#CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839801764 CAAUJPRAHXIQSR-DYESRHJHSA-N 479.327 0.537 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1839938162 VXRKEMYFAWVNNB-VWLOTQADSA-N 481.553 0.696 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3OC(C)(C)C4)C2)C1 1840184020 NTPJAROVWMJZKI-RUZDIDTESA-N 488.585 0.843 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1840187203 MFWJRLXAAPTQEA-NRUKRLKBSA-N 484.597 0.938 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc(C)c(O)nc3=O)CCO2)C1 1840805973 LJTULZLPENJGHZ-YWZLYKJASA-N 456.927 0.121 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@H]1CCCS1(=O)=O)C2 1841925246 CIUHYJQXMKPDSU-UONOGXRCSA-N 463.984 0.899 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843011924 KSUCOLJGPVITIE-HSALFYBXSA-N 499.373 0.208 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CN1CCSCC1)C2)NC(=O)NCc1ccccc1 1845038208 DYXOUHWNZPCVLH-UHFFFAOYSA-N 474.631 0.585 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)c[nH]c1C 1847663228 REECDNPGZDFJKL-PMACEKPBSA-N 467.331 0.628 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 16128137 VHRBCTVAVYFYGB-UHFFFAOYSA-N 467.525 0.533 50 20 JCGD O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1 726867547 NBNGOMWCESPUBG-UHFFFAOYSA-N 455.496 0.842 50 20 JCGD NC(=O)[C@@H]1CC(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)=NN1c1ccc(F)cc1 728209981 NJHGZPCGUARMIJ-SFHVURJKSA-N 460.491 0.830 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCN3C(=O)[C@H]4CCCC[C@@H]4C3=O)cc2)CC1 728214103 XZIMQAOMCACBTO-OALUTQOASA-N 477.587 0.631 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NNC(=O)Cn1ccc2ccccc21 729494412 PXLRBONJBXXAPL-UHFFFAOYSA-N 457.516 0.918 50 20 JCGD N#Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2N2CCOCC2)cc1 747175324 PSSRZMJPKHATGO-UHFFFAOYSA-N 499.549 0.491 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 751204099 CRELFGVTOIZGAG-UHFFFAOYSA-N 474.539 0.746 50 20 JCGD C[C@H](C(=O)NNC(=O)CNC(=O)c1ccco1)N1C(=O)c2ccc(Br)cc2C1=O 751205148 XQNCTEYKKJDMDT-SECBINFHSA-N 463.244 0.604 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C2CC2)c1 879409759 YUDILBFNSPVJOU-UHFFFAOYSA-N 472.483 0.157 50 20 JCGD CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)Cc2csc(N3CCOCC3)n2)c1 916112794 KEZPIPTYZNPWGX-UHFFFAOYSA-N 484.629 0.790 50 20 JCGD COc1cc(CNC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)ccc1OCC(N)=O 916640775 KTFFGURNEKGNAH-UHFFFAOYSA-N 482.497 0.994 50 20 JCGD NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 916828317 VPMKKJDAMOLNRR-UHFFFAOYSA-N 459.572 0.626 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(CS(C)(=O)=O)cc2)cc1 918102223 QZBFCPMJIBUOJT-UHFFFAOYSA-N 482.584 0.691 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncccn1)C2)NC(=O)NCc1ccccc1 1780558737 IHIQMAAPAVRHCE-CJFMBICVSA-N 495.584 0.950 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781335015 TVHGNCRYCRHSEN-FZKQIMNGSA-N 484.282 0.813 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1781382824 BTFNFYJAEILMEY-YLJYHZDGSA-N 495.411 0.686 50 20 JCGD Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc(C)c1C(=O)O 1782171580 DUCSEOKRDBWUSM-DEOSSOPVSA-N 466.299 0.439 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)nc1F)C2 1782210249 JUTDWDODEXWYON-QVKFZJNVSA-N 453.490 0.860 50 20 JCGD CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782213357 MFLIISITJGSSBO-YCRNBWNJSA-N 453.628 0.851 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)C1 1782256540 SPZBHDOLLZDPMK-LGFFLQIISA-N 489.997 0.472 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3CCC4)C2)C1)NC(=O)NCc1ccccc1 1782319713 MHFHFEFSJJPOCB-RUZDIDTESA-N 495.584 0.619 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC34CN(C(=O)OC(C)(C)C)C4)C2)C1 1783451509 ABAJQOXCXYFGJS-MZNJEOGPSA-N 493.605 0.446 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)CCO2)C1 1783876851 XTWDXBKBYQNJJY-KGWSRGFLSA-N 475.970 0.440 50 20 JCGD Cc1c(Br)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)nn1C 1783935407 QVAGRHRMDFCAHN-IBGZPJMESA-N 485.383 0.308 50 20 JCGD CC(=O)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)n[nH]1 1787508604 CIUYAIDKQIJPDB-GRLNEQDSSA-N 469.502 0.340 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCC(F)(F)C3)C[C@@H]21 1788607921 VRZJEFWLTUVVFO-OQUILHJVSA-N 451.474 0.714 50 20 JCGD COc1ccc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(F)c1 1791130502 OINCDHCLOPZPJK-CBMMCEQISA-N 482.317 0.821 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791288810 VQZRFFPFDFEAPY-WDSOQIARSA-N 489.573 0.613 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1792258664 LLLLPUHZNZELQB-OKYOBFRVSA-N 493.605 0.256 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(Cl)cc1Cl 1792413977 DLJZOHRNQLZNBF-DPIQGUFMSA-N 458.346 0.965 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792972796 VRKPTUJRODUIMM-KWCBCURJSA-N 489.997 0.184 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(C(F)F)c1 1794271269 DXEDXNYSJHWEQM-FVCICTRLSA-N 460.441 0.535 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)[C@@H]2C1 1796192043 DRFLQMKLZCYLGO-AEUURAPJSA-N 483.374 0.731 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798524987 WUJQEHHWUUPPHV-NFWAQSGPSA-N 491.501 0.431 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1Cc1ccccc1 1801190690 DVUSQQAJESHHBM-YDLSIGKMSA-N 492.580 0.553 50 20 JCGD Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn2[nH]cnc(=O)c12 1803141023 KGJLWZOXOZYKMM-KYJSFNMBSA-N 458.906 0.645 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CC1 1803462419 BNBOOUOJKWDNCH-WOZUAGRISA-N 485.390 0.850 50 20 JCGD CCC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1803690364 NOKVNOXMTHCDTM-GRDNDAEWSA-N 458.910 0.935 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1804074760 CTZXYYTXEHOJSH-RDGPPVDQSA-N 459.352 0.922 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1807075841 AFEOTSANDUYCQR-SOHDHNSJSA-N 453.547 0.773 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccn(C(F)F)c2=O)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359791 DTHKBSCZJKHWGR-YLJYHZDGSA-N 496.279 0.952 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361735 CVPMEHOBQHMOAG-QFBILLFUSA-N 460.137 0.866 50 20 JCGD Cc1[nH]nc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1F 1807365401 XOJLVQJMEFXVNO-JXFKEZNVSA-N 451.267 0.565 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CSC(=N)N)[C@H]1c1cccnc1 1808414654 KYZWZHVQVIACHR-FRXQJERCSA-N 470.559 0.848 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)CC2)C1 1809980155 KWRSZHIYLHXKGR-HSZRJFAPSA-N 474.370 0.977 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccncc1=O)CC2 1817282881 NLWGJZMEVPSKQV-NSCUCBQXSA-N 482.526 0.446 50 20 JCGD CN1N=C(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)CCC1=O 1817469656 COBRSCKIUKHZGW-KRWDZBQOSA-N 452.280 0.004 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCc3nc[nH]c3C1)CC2 1819801226 HAMXCEMNCOVDGW-NWDGAFQWSA-N 480.554 0.896 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(C(N)=O)cc1)CC2 1819801959 VZSRCPUYZKHOLV-ZDUSSCGKSA-N 479.522 0.780 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)CC1 1825505513 BURMAFKZUDKHEB-GOSISDBHSA-N 460.535 0.781 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cncc(S(C)(=O)=O)c1)CC2 1826080560 QUKKREGXZQRXNZ-CYBMUJFWSA-N 494.599 0.540 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)nc3sccn13)CC2 1826088285 VVCGCGATMDJPEJ-LLVKDONJSA-N 489.583 0.811 50 20 JCGD CC(C)(CCl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](N)CN)C2)C1 1828517446 BFXJXIONOBXWMA-MBSDFSHPSA-N 480.009 0.990 50 20 JCGD O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830730892 FPIDYHWKJRHZDF-FDDCHVKYSA-N 475.929 0.313 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832552115 XOOIYTYMRVUERT-SIFCLUCFSA-N 498.404 0.829 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)C(C)C)CC2)CC1 1833347618 NJCFAXAJXPSNIK-RHKYMZEHSA-N 460.579 0.709 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nccc4nc[nH]c34)CC2)CC1)c1ccc(B(O)O)cc1 1834798695 YJNHAWGLPCLPCP-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1 1835831418 PEEMPWVDLKUHPM-WPAVATOWSA-N 497.556 0.062 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccn1 1835915934 RKHSAOSGAORZTN-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD C[C@H](Sc1cccs1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930769 YWEUNRGUIDCNHB-KSFYIVLOSA-N 490.412 0.679 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(Cl)cccn34)C2)C1 1835935420 DUVKINJBGLMUSZ-HSZRJFAPSA-N 498.732 0.051 50 20 JCGD CO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1836343918 QKQRFMCNTFMPBJ-IBGZPJMESA-N 488.633 0.939 50 20 JCGD COc1ccc2oc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc2c1 1836819122 SMWDJGFMAFOGER-RUZDIDTESA-N 494.309 0.505 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837459966 PRXNXCZOPSQUPE-QHCPKHFHSA-N 453.499 0.377 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461574 YSZUPAAFNPTYRA-RUZDIDTESA-N 481.553 0.615 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnncc1C(=O)O)CCO2 1837947521 PVNTVMDJJBUFEJ-LJQANCHMSA-N 452.540 0.096 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838110714 DQHLYZCNGVOCOI-KXBFYZLASA-N 462.330 0.803 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc4ncnn4c3)CC2)CC1 1838351738 NBBOZBHMWOJQFF-UHFFFAOYSA-N 471.562 0.715 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838499022 LIMVIKZJOFJGKT-YCRPNKLZSA-N 463.922 0.567 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)nn1C(F)F 1838709441 NUDKBTJPBPVCIS-FQEVSTJZSA-N 472.493 0.030 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839154923 CEQUYOSCCISDOI-LSTHTHJFSA-N 490.388 0.150 50 20 JCGD CN(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc1 1839197857 KEZZBAZVPBPNDQ-MAUKXSAKSA-N 459.316 0.908 50 20 JCGD COCCn1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1 1839201024 PXINYFQUUNAIRZ-WMLDXEAASA-N 463.304 0.290 50 20 JCGD CC(=O)C[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1840129042 HGPPARWSOIZBIB-VJMCXDQNSA-N 461.519 0.192 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@](C)(O)CC(=O)O)CCO2)C1 1840182151 XUPUYFSWGLXCBN-VHSSKADRSA-N 465.341 0.232 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3Br)C2)C1 1840185602 PXTAARWHEBFZIL-HXUWFJFHSA-N 498.378 0.287 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c(C)n1 1840185975 VCLDWIPXEBOLQE-DEOSSOPVSA-N 475.590 0.460 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1 1840648608 VATBVYMVSNPDJA-DJJJIMSYSA-N 454.321 0.639 50 20 JCGD Cc1cc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840777931 ZQGQTVNTSGYAHO-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD CN(CCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)C(=O)OC(C)(C)C 1840910487 BTQBODIWPSZJSN-HRAATJIYSA-N 477.986 0.690 50 20 JCGD O=C(c1cn2c(Br)cccc2n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011596 UIICMYWGPSPAFF-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)C1CC1)C2 1843428701 LBNKQHNVPFSLOB-IBGZPJMESA-N 471.363 0.416 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)c2ccc[nH]2)C1 1844406976 FPGLEGPNJUCXHM-FQEVSTJZSA-N 496.373 0.648 50 20 JCGD NC(=O)COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1 28196985 SHVVBCFDDWDLEX-UHFFFAOYSA-N 460.512 0.800 50 20 JCGD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CNC(=O)c2cccs2)c1 725740216 CANCCRAEBLZUCJ-UHFFFAOYSA-N 474.948 0.517 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 726612578 GMHMDCTWGXCTNE-UHFFFAOYSA-N 462.484 0.544 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)cnc21 727162848 YDUKLPUDBXBXOG-UHFFFAOYSA-N 471.275 0.744 50 20 JCGD Cc1ccc(OCC(=O)N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)cc1 728962111 ZCNRSYFMNCHJEI-UHFFFAOYSA-N 481.557 0.965 50 20 JCGD CCOc1cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc1OCC(=O)N1CCCCC1 729276991 QMLXBYLVXQUYMO-CQSZACIVSA-N 470.548 0.175 50 20 JCGD O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 730516681 MAYZPVBVDLCMIP-UHFFFAOYSA-N 470.449 0.291 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2cc3c(cc2Br)OCO3)c(=O)n(C)c1=O 730569095 NCESJKWBOWOOMD-UHFFFAOYSA-N 456.278 0.213 50 20 JCGD O=C(CCOc1ccccc1)NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 747181101 JPIWQIMFXVCURL-UHFFFAOYSA-N 488.566 0.916 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1CCCN(C(=O)C2CC2)C1 749469176 KIPAQQGCGBQZSK-IBGZPJMESA-N 492.598 0.436 50 20 JCGD CC[C@H](C)[C@@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)N1CC[C@@H](B(O)O)C1 864233724 JUTOZRKLKAKMTN-OGHNNQOOSA-N 473.788 0.810 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CNC(=O)c1c[nH]c2ccccc2c1=O 915357487 OKCPKNLDOQWMHN-UHFFFAOYSA-N 470.511 0.321 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(O)cc1O)c(=O)n2Cc1ccccc1 916330799 AVJORLSQUAVURD-UHFFFAOYSA-N 462.466 0.989 50 20 JCGD O=C(CS(=O)(=O)Cc1cccc(Br)c1)NNC(=O)c1ccc(-n2cnnn2)cc1 919838827 MACCGJWIAFXDLL-UHFFFAOYSA-N 479.316 0.801 50 20 JCGD Cn1nnnc1SCCC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 920079600 DJRALIPOUYZOKB-UHFFFAOYSA-N 464.511 0.912 50 20 JCGD Cc1cc(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC(C)C)n(Cc3ccccc3)c2=O)no1 920444453 HNWLEXBGPFCALL-UHFFFAOYSA-N 479.497 0.822 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)c(C)n2n1 1777784282 FPWKPAFDDNZTHX-WMLDXEAASA-N 455.288 0.875 50 20 JCGD COC(=O)C12CCC(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)(CC1)CC2 1778305573 CGEIPLAXUARVSQ-KXTRFFEISA-N 478.590 0.703 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1 1778314611 ZXNMGJKEEBFCPP-DEOSSOPVSA-N 487.362 0.067 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1778720909 UFEGWANEOFISKT-OAQYLSRUSA-N 469.527 0.460 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1780695898 IWJXXDXGYRFORS-GCKMJXCFSA-N 477.986 0.641 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCOC1)CCO2)NC(=O)NCc1ccccc1 1780968591 FJGYPGKBHRTNPF-CVDCTZTESA-N 459.547 0.199 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)C1 1782468661 BFDHPNSUKIWFEV-NEYJZJCJSA-N 453.971 0.988 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)CCO2)C1 1783874262 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0.799 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1799353193 KWBTWAWVLCCBMH-HLPPOEQASA-N 478.384 0.637 50 20 JCGD Cc1ccc(C)c(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1800602658 FXAFJXZLMCAEKK-OPMZPASUSA-N 451.527 0.748 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2 1800638085 PTAZRNRHKDKCGY-AICCOOGYSA-N 478.384 0.635 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1800957161 YAWJZMDHQZXRBL-CFAUTMRTSA-N 485.541 0.465 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2 1800971477 ZYCNHSPRHTYAPR-NPJQDHAYSA-N 463.959 0.106 50 20 JCGD CCCNC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1803439394 KCSLOYIZQQWUOI-CVDCTZTESA-N 466.347 0.387 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@H]1c1cccnc1 1803997370 DCIVCSZFEUOEKR-BJZITVGISA-N 459.469 0.774 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)C[C@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1806342604 OTVBLPWENHYTCK-ZENOOKHLSA-N 452.309 0.471 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC2(CCN(C(=O)CNC(=N)N)CC2)C1 1806757266 VRDUDTRPTVJZHW-AWEZNQCLSA-N 458.991 0.833 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ncc(Cl)cn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361289 FTYLTSJHQIXQGL-LPHOPBHVSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365870 ZLUZSVCNEOXCRS-AVRDEDQJSA-N 475.314 0.374 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369334 HAKKDVULAOPRAL-GBXCKJPGSA-N 478.358 0.484 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373928 VHWFBCHQKLMGRY-BSIFCXSSSA-N 452.320 0.882 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1)[C@H](F)Br 1808661266 HOVLZBMPZUNNNK-CQDKDKBSSA-N 478.282 0.823 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1 1809743755 VSEYYBJYOWKZEV-UZLBHIALSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1 1810054779 IPRVGDMUCDHZRR-IERDGZPVSA-N 485.508 0.756 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810248815 OBCBBVUYVZVJFL-SESVDKBCSA-N 451.332 0.654 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(CO)on1)CC2 1817281608 KELGVOPDMQHRCC-DLDHGHKKSA-N 471.499 0.983 50 20 JCGD NC(=O)c1nccnc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2 1821040848 MNGBGTUIQYVJOG-KSBSHMNSSA-N 457.285 0.948 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830156400 AKPDOXMREXPWPY-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1F 1830723877 SNBWYWOOFRZWEW-MPBGBICISA-N 478.876 0.652 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(C#N)c1 1830732761 AFZQRURVESXTDG-GHTZIAJQSA-N 451.907 0.165 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830733411 LIVKGPCJHKNUFT-HOIFWPIMSA-N 489.997 0.690 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](S)C(C)C)CCO2 1831487577 QCTQIVVUGNYTOY-NYYYDFRBSA-N 465.576 0.531 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@@H]1COc2ccccc2O1 1833714825 NVIYGDUNXVGCBU-XLIONFOSSA-N 451.951 0.998 50 20 JCGD CC[C@@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834686997 AXCUQIHMFCSXFH-FOIQADDNSA-N 459.595 0.244 50 20 JCGD COc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834798371 MZTJVTKANGZVMN-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD Cc1nc(C)c(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)o1 1834798459 YLNYYQRWKMJYOY-UHFFFAOYSA-N 454.336 0.470 50 20 JCGD Cn1cccc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737189 UUYHIFDVKVAGFG-UHFFFAOYSA-N 453.547 0.523 50 20 JCGD O=C(Cc1cccc2ncccc12)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927255 NBLUOVJCKWFXEW-AREMUKBSSA-N 489.337 0.227 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835932205 TWIJCMGMRSPYHJ-IQGLISFBSA-N 484.333 0.454 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)CCO2 1836380976 QCDZGIZTXVXSHL-OAQYLSRUSA-N 499.662 0.548 50 20 JCGD O=C(c1cc2n(n1)CCCO2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836972285 UUNTYWMRENPORZ-YOEHRIQHSA-N 461.288 0.426 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1 1836972571 DICKCDGCMBBDTA-AUUYWEPGSA-N 471.352 0.909 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)NC(=O)c3cnccn3)CCO2)C1 1837609187 OOVQBKVYQQMEIF-BXTJHSDWSA-N 453.927 0.069 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(Br)c1)CCO2 1837812343 YLZXRMQLWGLBPO-HXUWFJFHSA-N 498.378 0.287 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccn4cncc4c3)CC2)CC1 1837919338 ZLMLZSXXCFAXQW-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920808 HQHZAOMQTBDJNF-GOSISDBHSA-N 481.358 0.841 50 20 JCGD Cn1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(C(F)(F)F)n1 1837957901 RVJAIOYIHCWPRO-BLLLJJGKSA-N 454.833 0.109 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1838403766 BSTOELJNVFULBE-FXAWDEMLSA-N 476.412 0.809 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1 1838795774 OZTNWTQKDUNCHX-UTKZUKDTSA-N 463.922 0.591 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc([N+](=O)[O-])c1OC 1839470450 PMWPOEIVZIFSBQ-MGPUTAFESA-N 487.893 0.282 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1839964099 GTQKBGAKULZXHL-SCLBCKFNSA-N 458.309 0.736 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840006966 ZTEQGRGSSTZMOY-ZMPRRUGASA-N 487.981 0.300 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)C2)C1 1840149888 ALGMNRRPDGRFSE-OXJNMPFZSA-N 473.885 0.987 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@](C)(O)CC(=O)O)CCO2)C1 1840176963 KNPUIDVWIZDSOR-BVGQSLNGSA-N 465.341 0.090 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1840685367 AEQFIAZZWVYGQQ-HSZRJFAPSA-N 487.488 0.217 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840903232 XKCVUVHTYWASKD-DKICVRJWSA-N 486.338 0.952 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012382 JSQLAWBUMHUVSD-CJAUYULYSA-N 483.374 0.831 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1846129326 KKYAYASVVANANQ-IQGLISFBSA-N 483.374 0.831 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC2(CCCN2C(=O)[C@H](Cl)COC)C1 1846363906 KSEREJYWEYLGMH-QGZVFWFLSA-N 450.960 0.530 50 20 JCGD Cn1c(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nc2ccccc21 6094767 VVSALKVOSQIIGL-UHFFFAOYSA-N 457.512 0.598 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)CC2)cc1C 16785943 OZSBHLUISUPTCR-INIZCTEOSA-N 457.574 0.286 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)cn1C 726769883 CHNCIMRZTZCFHE-UHFFFAOYSA-N 462.454 0.946 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1 728213738 OTGDNCPRVIAPFE-UHFFFAOYSA-N 476.515 0.404 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(F)ccc3Br)c2)CCN1 728549924 VNHVEIBUOXADBU-UHFFFAOYSA-N 499.318 0.784 50 20 JCGD COc1cc(I)c(Cl)cc1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 729274901 HBWTZMVKRQPETE-ZCFIWIBFSA-N 475.692 0.652 50 20 JCGD NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)COc3ccccc3O)c2)C1 731118779 VPVCLRUYYJSTOB-GOSISDBHSA-N 455.515 0.999 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)c2ccccc2c1=O 748464739 JLIXFHIPXQLTET-UHFFFAOYSA-N 478.557 0.968 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1ccc2c(c1)OCCO2 770419505 NVFDEIKFWOFJJJ-UHFFFAOYSA-N 477.495 0.562 50 20 JCGD O=C(COC(=O)CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 785403790 LCXYJVSQFMFCNV-KRWDZBQOSA-N 481.458 0.025 50 20 JCGD O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1csc(N2CCOCC2)n1 912852228 UEKHNRBHEOYLDV-NRFANRHFSA-N 470.511 0.134 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)CN(C)S(C)(=O)=O)cc2)cc1 914747702 FSMZEICBBDNOJR-UHFFFAOYSA-N 482.584 0.468 50 20 JCGD O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1)c1ccc(-n2cnnn2)cc1 916144788 ZFGKOBNCPIBNAK-OAHLLOKOSA-N 461.529 0.728 50 20 JCGD CC(=NNC(=O)CN1CCCC1=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1 916357960 UUVYTYIPMXJYDD-KRWDZBQOSA-N 450.517 0.777 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)NC[C@@H]1C[C@H]1C)c(=O)n2Cc1ccccc1 916640672 OXEQXTNHLMMOAH-WBVHZDCISA-N 483.529 0.041 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)COc3ccc(-c4ccc(C#N)cc4)cc3)n(C)c2n(C)c1=O 919688751 FMLRYAGINKBQFI-UHFFFAOYSA-N 486.488 0.954 50 20 JCGD COc1cc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccn1 1779028932 PVNSUEASZJPMEM-HSZRJFAPSA-N 468.514 0.165 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)n1 1779505888 QYEQLVNNBQDSNU-GCKMJXCFSA-N 454.955 0.400 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1779557079 XCCAQNXWKWGJAE-QDEZUTFSSA-N 452.321 0.342 50 20 JCGD COC(=O)NCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780098057 AFKWXCIHMGDLIC-HXUWFJFHSA-N 464.431 0.320 50 20 JCGD CC(C)O[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969059 UQNTUEAIAILUSY-DVECYGJZSA-N 475.590 0.976 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781333531 ICOOMCWFHSSHTK-BBRMVZONSA-N 461.244 0.277 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1781861240 PAIRXIRZKUTCQQ-NXOUGTEYSA-N 454.351 0.896 50 20 JCGD CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1782026055 XNLVPGATCWHKFJ-CRAIPNDOSA-N 480.370 0.755 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCO2 1782869727 IIKOAWISFRWGDF-KYWWFEPUSA-N 489.370 0.909 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](CC1CC1)NC(=O)OC(C)(C)C)CCO2 1783937048 DZRBTIGHHSNZIZ-KOSHJBKYSA-N 495.621 0.883 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn3C)[C@H]2C1)NC(=O)NCc1ccccc1 1785893447 NODPKFUQMSPMBA-ONTIZHBOSA-N 482.585 0.965 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(C(F)(F)F)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786984037 KYHSPDWTCJCOPV-JVPBZIDWSA-N 477.248 0.687 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)n1cccc1C=O 1786995610 IZAFLQLMVUDFMI-QBTDHISASA-N 468.514 0.154 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)ccc12 1787149458 BQIMJJFQIGJUAQ-LAQRGFTBSA-N 478.933 0.704 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787506814 OLZOGSXROYFFHI-CCYFIYGFSA-N 474.562 0.262 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCSC(=N)N)C[C@@H]21 1787508585 AVKZYGONSIKANP-HVEJOWRVSA-N 463.564 0.117 50 20 JCGD O=C(CCN1C(=O)C=CC1=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788145107 MQENPPQDDWARGP-UHFFFAOYSA-N 461.283 0.429 50 20 JCGD CCS(=O)(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1 1789221087 UKIGKJRETBTRQX-FNHZYXHNSA-N 497.526 0.548 50 20 JCGD C=CCO[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724655 IKNDSBOPIRSBPQ-GBAJDQEWSA-N 487.601 0.903 50 20 JCGD COCC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)CC1 1789725120 YDRFWWLSEIVBMC-ACRUOGEOSA-N 487.601 0.739 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1790316069 LJFCKZKAQALIIE-HARLFGEKSA-N 489.341 0.163 50 20 JCGD C[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)Oc1ccccc1 1790698300 XVCBXNPOVHZSCV-UJFGGOPNSA-N 466.343 0.817 50 20 JCGD Cc1occ(C(F)(F)F)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1796630376 RREPJTMANZFHIF-ZSBFGKGUSA-N 466.221 0.804 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@H]1CCCCO1 1797811175 KAURNFVUNPGLTB-AMLCSUFCSA-N 474.518 0.239 50 20 JCGD Cn1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(C(F)(F)F)n1 1798787531 RQFFBZWOIJEPHW-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1799041299 ZZVBDDAJRMTBKZ-CCWDJLKJSA-N 489.573 0.646 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccccc1)C2)NC(=O)NCc1ccccc1 1799094998 PCRQOTQFQUBJOU-IUTQVRIDSA-N 493.564 0.805 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2 1800977433 OISYEBKDSGZKFA-DGADGQDISA-N 463.959 0.106 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803137061 ZWPNZFRVDXVHCO-ZJPYXAASSA-N 484.981 0.963 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(=O)c1ccccc1 1806234444 DLDINGUJJBZINB-IRLDBZIGSA-N 457.295 0.964 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC2(CCCN(C(=O)CN3CC(=O)NC3=O)C2)CC1 1806689940 ZPLKFNVEBVDUBO-HNNXBMFYSA-N 499.996 0.902 50 20 JCGD CN1CCC(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1807362119 ZOVRHLRTSSYEFF-RBBKRZOGSA-N 450.348 0.423 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363863 RATMXWOKWTZTKW-GOEBONIOSA-N 497.210 0.436 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808451132 ZRNMEJCFHPFIOL-DYESRHJHSA-N 480.525 0.909 50 20 JCGD Cc1cc2nnc(C(=O)NC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)c(C)n2n1 1809193029 ZZYIZDLEBWDDDD-FDDCHVKYSA-N 493.572 0.829 50 20 JCGD Cc1ccn(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810294509 LNBQAUYUEBTODU-UTKZUKDTSA-N 462.514 0.605 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1 1810303643 UFPMNVVLXQFQHE-UZLBHIALSA-N 485.508 0.756 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n(C)n1 1813070739 LOMNYOCOIJXGPL-IERDGZPVSA-N 457.535 0.516 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)CNC(N)=O)[C@@H]1c1cccnc1 1814231749 VSVPRSYWALKYBR-QRWLVFNGSA-N 484.469 0.903 50 20 JCGD COc1nccnc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354713 BMUJAOUHPKVYAD-ZDUSSCGKSA-N 453.289 0.161 50 20 JCGD O=C(CCC(=O)N1CCCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815637858 BRGLXWOALPFXFH-LJQANCHMSA-N 467.335 0.798 50 20 JCGD CC(C)(NCCC#N)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1817318285 QPMHYZSITFFXKJ-QGZVFWFLSA-N 467.534 0.996 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470075 HSFFJEFFMOJZCF-CXAGYDPISA-N 462.337 0.076 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797526 WDQLMSFFXIBWDL-PWSUYJOCSA-N 459.532 0.234 50 20 JCGD O=C(CN(CCO)CCO)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1 1822026459 HRBZAMBZRYDRSV-SWLSCSKDSA-N 450.309 0.379 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)CC1 1825504907 TUIVZMWAHCXNBG-LJQANCHMSA-N 481.513 0.720 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059865 XRJRTHFDTJXEMW-GOTSBHOMSA-N 464.375 0.565 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2 1832231451 GXMVPHVFYYMHER-IFMALSPDSA-N 450.511 0.527 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833306021 JOSRHRNHOAWGLA-QZTJIDSGSA-N 491.029 0.433 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)CNC4=O)CC2)CC1)c1ccc(B(O)O)cc1 1834798574 MFDLQOZLCWOEBC-UHFFFAOYSA-N 490.369 0.109 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccn4cncc4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798683 XMTYOHILWVKHCN-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)CC1)c1cccc(B(O)O)c1 1834799977 KSNWYDNFQAFBCL-XMMPIXPASA-N 477.370 0.555 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1 1834823441 VJZAXKZDJNJDLH-PMACEKPBSA-N 482.331 0.963 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccc(N2CCOCC2)n1 1835197590 ICKJFXPSPIZTRY-FQEVSTJZSA-N 480.009 0.703 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3nn(C)c4c3CCC4)CC2)CC1 1835398393 QEKAPRMJSBUHNO-UHFFFAOYSA-N 473.622 0.467 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCN(C)CC3)CC2)CC1 1835483721 JJKYMPNXFCJBJE-INIZCTEOSA-N 458.445 0.589 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C3CC(F)(F)C3)CC2)CC1 1835734699 PWJNWAOQCAPMCX-UHFFFAOYSA-N 464.517 0.916 50 20 JCGD O=C(c1cnc(Cl)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930656 SFJPCEWWWZKDAM-NRFANRHFSA-N 494.140 0.452 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2s1 1835939613 VFNZOUKQPXDFKK-QHCPKHFHSA-N 483.355 0.601 50 20 JCGD COc1cnc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c(F)c1 1837321331 PHZZMWXGJDDKKQ-UHFFFAOYSA-N 485.321 0.835 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H]3CNc4ccccc4O3)CCO2)C1 1837356009 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COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c([N+](=O)[O-])c1 1839232522 MPENLMYDZKMESQ-YLJYHZDGSA-N 471.894 0.202 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1839965791 LJPKXYZBMBCYHU-XLIONFOSSA-N 487.439 0.396 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCOCCOCCOC)C2)C1 1839966519 HYDVGQVHRZIECN-XLIONFOSSA-N 495.411 0.686 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1840153556 SGBXNTVXUDSODL-OQBWYENPSA-N 469.922 0.162 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCNC(=O)C1)CCO2 1840234311 WKYYWQDCAYIODG-TUXSKGRZSA-N 488.491 0.854 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cccnn3)CCO2)C1 1840409824 GMRUAYITBIEIAV-KBXCAEBGSA-N 457.325 0.485 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840887176 YMEPWYUPHFFJJZ-LPHOPBHVSA-N 459.858 0.333 50 20 JCGD Cn1cnc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1C(F)(F)F 1843519707 FXRPTRBZAAQBLR-UHFFFAOYSA-N 451.409 0.568 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)NC(=O)CO3)C1 1844080205 UOHYIOGBSQWOEL-UHFFFAOYSA-N 450.455 0.147 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@H]2CCNC(=O)C2)C1)NC(=O)NCc1ccccc1 1846423618 NROGVHSQEMDXEV-SFHVURJKSA-N 456.547 0.062 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1847068779 IKNMGASSHLVNBR-GOSISDBHSA-N 455.320 0.100 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3c(C)nc4ccccn34)cc2)CC1 14841883 ZIJZPWBQFIKABS-UHFFFAOYSA-N 484.538 0.570 50 20 JCGD COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 27193347 DNRCDBQLDAYDLS-UHFFFAOYSA-N 483.572 0.288 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1OCC(=O)NC(C)C 107910508 XZXXLUMLOACBKE-UHFFFAOYSA-N 492.554 0.924 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)c1 728208361 SPHXKLGJVKSBCL-UHFFFAOYSA-N 464.280 0.161 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2C[C@H](O)CN2C(=O)c2ccc(F)cc2)n1 728730627 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KAGRBIGJMLIKEK-VWLOTQADSA-N 477.521 0.961 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2cn[nH]c2cn1 1779193837 MVAMOWBHUVJBGF-NFBKMPQASA-N 463.303 0.079 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)n(C(F)F)n1 1780165367 WPNBVWOHBYJOGG-XMSQKQJNSA-N 476.289 0.708 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@H](O)CN3)C2)C1 1781048508 RUGQXPOOLKRFBK-YMSBAQSPSA-N 489.370 0.909 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1 1783336674 SGYCPTQUKHKCHI-HYQBQJDPSA-N 467.526 0.554 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1783534245 GYVICLHGFJBHMC-CJNGLKHVSA-N 452.371 0.025 50 20 JCGD COc1cccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1C 1783637620 GENZLGNYJQULFK-DEOSSOPVSA-N 452.316 0.370 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784084041 KMKXLXHJAWCRPB-WNHJNPCNSA-N 452.935 0.985 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784093347 XKAIPIFHHWVEIA-JONQDZQNSA-N 463.959 0.107 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1784197693 SNLYQWBMXRTZTE-SRQBIAJPSA-N 473.954 0.144 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1785700629 GUCQTWNVZGVAEP-NRUKRLKBSA-N 460.339 0.932 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCN(C)CC3)[C@H]2C1 1786729388 DZYFDJDYENPOIK-XSLAGTTESA-N 459.429 0.777 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786979449 KHBJORSIQPQHET-SNRMKQJTSA-N 457.723 0.630 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)c(F)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979495 PRJNIVDRECGJEC-MDKPJZGXSA-N 458.270 0.481 50 20 JCGD CCCc1onc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982904 HEZDPFYUKRVERJ-QRFRQXIXSA-N 455.320 0.522 50 20 JCGD 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CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS(=O)(=O)N1CCCC1)C2 1800639675 MAFLSVVFOXCNCZ-HLPPOEQASA-N 466.398 0.175 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cc1F 1800660388 VRTMUTBZXIDTIL-VTEUUUEMSA-N 459.453 0.409 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc3[nH]ccc3c1)C2 1801012381 WOQLBSCGTBLNSI-OPMZPASUSA-N 456.547 0.458 50 20 JCGD C[C@H]1[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)CCN1C(=O)OC(C)(C)C 1802249375 XYAHVZRDKGWHKZ-CURYNPBISA-N 495.621 0.595 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1 1804948959 ILGKYJBFJUJUAV-RKRZQOSRSA-N 491.508 0.934 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnc(N(C)C)o2)[C@@H]1c1cccnc1 1805344837 BXVGZFZTJZLUFA-UZLBHIALSA-N 457.535 0.828 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1 1805958227 NABYDAMTJJVQRS-FLVDCRJSSA-N 494.618 0.679 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(Cl)ncn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361470 QFBKHLSMMCGPNG-JXFKEZNVSA-N 465.706 0.838 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(=O)OC(C)(C)C 1807362410 GYDNXQNSONSXES-KNQAVFIVSA-N 496.373 0.948 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807363195 NXZGHLOZWQHVJJ-ZNLUXHQJSA-N 461.331 0.614 50 20 JCGD COc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc1 1807373793 AZSGYVWDUJLTJO-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2C)[C@@H]1c1cccnc1 1808416715 QOJMSRDMBMHJPE-GHMZSNGMSA-N 479.541 0.842 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1ccccc1=O 1810302047 FDJPYOMYQOBEFI-CDMIOBSGSA-N 489.536 0.823 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCN2CCOCC2)[C@H]1c1cccnc1 1810302144 GWHPLRGBUAZQDT-GCJKJVERSA-N 481.557 0.122 50 20 JCGD CCC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1815104601 SOOLXYRWHHUCHR-WBMJQRKESA-N 456.507 0.629 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348092 DEDXBXFGNCIQPY-YESZJQIVSA-N 483.355 0.804 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)c2cccnc2)n[nH]1 1815786543 STMMBGMXUFPJSI-QGZVFWFLSA-N 470.534 0.600 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3c(n2)OCCO3)[nH]n1)c1cccc(B(O)O)c1 1817474478 GXPPFPNBQLTQJO-SFHVURJKSA-N 477.286 0.875 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)[nH]n1)c1cccc(B(O)O)c1 1817476800 QWZZBCVQUBFXNB-CYBMUJFWSA-N 477.212 0.846 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc(=O)nc2sccn12 1820082705 ZMRADHKNLCBUPZ-MRXNPFEDSA-N 492.326 0.779 50 20 JCGD COCCOCCOCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2 1825774967 BMZSOESSMCXPAU-OAHLLOKOSA-N 485.607 0.498 50 20 JCGD CC(C)(CCl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](N)CN)CCN2C(=O)OCc2ccccc2)C1 1829044629 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1834057560 OASYAABDSANDDK-UHFFFAOYSA-N 465.986 0.688 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834799833 GFHDRXLRMSHBRQ-UHFFFAOYSA-N 473.379 0.283 50 20 JCGD CC(=O)Nc1cc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)ccn1 1835262151 WBHMLFUCHOVUAC-SFHVURJKSA-N 451.955 0.825 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc43)C2)C1 1835934556 YNZHYVUXBJILIN-DHLKQENFSA-N 464.327 0.166 50 20 JCGD O=C(CC1CCOCC1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837809567 FVQGPTJYUOZJLW-UHFFFAOYSA-N 458.364 0.795 50 20 JCGD Cc1cnc2c(C(=O)N3CCC(OC4CCN(C(=O)c5cccc(B(O)O)c5)CC4)CC3)cnn2c1 1837920142 DRWKFERWIXPXJA-UHFFFAOYSA-N 491.357 0.644 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cccn3)C2)C1 1838528059 CCTYEYUVZBIGJG-QFIPXVFZSA-N 487.469 0.487 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)Nc3c(C)cccc3C)CCO2)C1 1839158013 MSARZOLOMJUWGG-HTAPYJJXSA-N 467.950 0.952 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1839203279 HJDGFMYRJIKELY-HNJNHCNJSA-N 459.316 0.662 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCCC3=O)C2)C1 1839966703 NPMVRDODDPZBSY-HNAYVOBHSA-N 460.369 0.629 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1840034255 GGWNOERTHAXGOR-KPZWWZAWSA-N 485.360 0.609 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840045232 YRAIIRASFOZPJM-DRSNIGMVSA-N 489.997 0.832 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1 1840153519 RDQQMRPPEQDWIW-UTKZUKDTSA-N 463.922 0.591 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840182947 XGFIGCGKPMRIEJ-XMMPIXPASA-N 476.574 0.512 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840437019 MBXZRADQRWXQMH-WMZOPIPTSA-N 461.332 0.726 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1843427564 UXERGJDSXQFRFQ-QGZVFWFLSA-N 458.563 0.403 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1nc3ncccn3n1)C2)NC(=O)NCc1ccccc1 1845038894 DVHRHWRBHNGBEE-UHFFFAOYSA-N 477.529 0.288 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1847723248 DVWVOGKOZRXCRW-OALUTQOASA-N 475.351 0.113 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C[C@H]1C=CCC1)c(=O)n2Cc1ccccc1 10161464 VKYHDXWKPOEGFY-INIZCTEOSA-N 450.499 0.932 50 20 JCGD Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)CC2)c(C)c1 16786077 RTNWHGWRJHQJHK-KRWDZBQOSA-N 471.601 0.595 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCOC(C)(C)C2)c1 726262594 KVOUPHVDMXKWSY-UHFFFAOYSA-N 455.581 0.772 50 20 JCGD Cc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1S(=O)(=O)NCC#N 726883602 BXZVHQFABJQGMB-UHFFFAOYSA-N 464.529 0.165 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)Cc1ccccc1F 731344619 WEDLRFRGQYZXGA-QGZVFWFLSA-N 471.532 0.297 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C[C@H](C)O1 912924885 XDRLYOQXPFXCEV-ROUUACIJSA-N 482.603 0.287 50 20 JCGD COc1ccc(CC(=O)NNC(=O)NC2CCCCC2)cc1S(=O)(=O)N1CCOCC1 913449426 XVUUFNODKKOWQR-UHFFFAOYSA-N 454.549 0.922 50 20 JCGD CC(C)OCCCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 915887918 CQOUHYPTCUDRLL-UHFFFAOYSA-N 456.565 0.786 50 20 JCGD COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 917409643 IZQISEZXTVMPCA-UHFFFAOYSA-N 470.529 0.547 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCN1C(=O)c2ccccc2C1=O 919788659 SIQBNLCLSQXVQN-UHFFFAOYSA-N 458.500 0.528 50 20 JCGD CCN1C(=O)C(=CNNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C(=O)N(CC)C1=S 920975406 GBVJYGKEDJRDFZ-UHFFFAOYSA-N 479.584 0.585 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccccc1=O)C2 1778091245 RXYGZYVNHIBJJU-HNZACBBNSA-N 482.541 0.496 50 20 JCGD Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c2cc(O)ccc2n1 1778425519 HCZDFCYLVFLMPF-RUZDIDTESA-N 475.310 0.686 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1 1779034094 MGUOWXVTQVVGOB-QHCPKHFHSA-N 452.515 0.547 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3ccnn3c1)C2 1779374608 RYTDTPUOFRXSPV-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)C2)[C@H](F)Br 1780777694 YTLUDDLSKNMZSH-OLUVUFQESA-N 462.238 0.869 50 20 JCGD CC[C@@H](NC)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970039 QKWKNNGOBDILKT-XXBNENTESA-N 460.579 0.161 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)Cc3cscn3)CCO2)C1)NC(=O)NCc1ccccc1 1780970616 YMAPSWMRYFRSRC-QHCPKHFHSA-N 486.598 0.862 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1782170363 JNNNPTSMZGZPLH-ZXYWRSMDSA-N 474.967 0.219 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cccc4nscc34)C2)C1 1782414443 LCYDXNGZEUVWPA-JOCHJYFZSA-N 451.313 0.733 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1782866028 IFJZOFWVNDDEAJ-JSBFAPMUSA-N 478.452 0.766 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1 1783876818 XMVPHPSAVDVZSC-LPHOPBHVSA-N 459.952 0.324 50 20 JCGD COC(=O)N(CC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)Cc1ccccc1 1783936347 GNINMZWQDABMJO-XMMPIXPASA-N 489.573 0.458 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1 1783966278 CIKRCUYGRCTPTF-SJTFNBSGSA-N 477.352 0.492 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)C1 1784080293 BZTYLBGDIPNHMK-HVNKAIIDSA-N 487.557 0.689 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3ccccc3C#N)C2)C1 1785378439 CNIRZQGIRZZLIK-FXZATJRASA-N 478.509 0.901 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(S(C)(=O)=O)c3)[C@H]2C1 1785589416 OYOCPMDEDKPPHK-STECZYCISA-N 459.952 0.332 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1C 1786983340 NTVKYWFOCQIYGS-RRPUWOKSSA-N 466.343 0.519 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1788705929 DODRTGUNSVLTSU-ZCRGAIPPSA-N 472.315 0.265 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)C[C@@H]21 1791249104 FHVWROMNDBUFJD-CISPMOHPSA-N 481.977 0.399 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791490363 RCFYGYREAGJGIU-DBXVSBKESA-N 451.332 0.234 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(=O)N(c2cccc(OC)c2)C1 1792428615 FTMIJFBAQWTQOO-GGTBVAQXSA-N 479.961 0.892 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(CNC(=O)OC(C)(C)C)CC1 1792547833 GYYBAWOELJJHDO-HGKCTWBKSA-N 481.594 0.254 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn(C)c1=O)NC(=O)NCc1ccccc1 1793786362 WKZDDRIGHLHKOU-ACDBMABISA-N 480.569 0.983 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)n(-c2cccc(=O)n2C)n1 1795112372 BGTBHCOLBZAGQZ-YVWYUNDQSA-N 492.374 0.868 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796192855 UPTDUAIKMZHYQK-BJESRGMDSA-N 481.333 0.505 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nc(O)c1 1796376154 OYWMRFJYNWQJFI-WVNFENISSA-N 454.487 0.433 50 20 JCGD COCc1oncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796440327 LIEOMNRXFBKURL-POKDIBPUSA-N 458.475 0.158 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc(Br)c1F 1799497838 JADGXTATZNPMSU-HBCWATKFSA-N 491.122 0.785 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1799956511 SJPXHTUAYWYWPI-HBCWATKFSA-N 481.488 0.297 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cnc2c(c1)CCNCC2 1800245038 HNFKVZXSKQNYPT-FSDCSDTHSA-N 455.328 0.664 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F 1800332574 VQLYEUBBJQXERL-CZXMPRJFSA-N 496.536 0.789 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)C2 1800981766 RIOOZWUGYUNUFK-LSIGDULCSA-N 471.982 0.943 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnn(C)c1 1801420193 SXOLLYPBOAVGHC-VPTLXERWSA-N 471.470 0.700 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(=O)c1ccccc1 1806234430 DLDINGUJJBZINB-IFMALSPDSA-N 457.295 0.964 50 20 JCGD O=C(CN1CCCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1806883115 IMNMGIGRPYFSJE-REWPJTCUSA-N 450.348 0.567 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360587 LJBXVCVRYZIPQK-AVRDEDQJSA-N 459.315 0.538 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361041 OGGCPOFOTOHCAT-VGSWGCGISA-N 470.298 0.666 50 20 JCGD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc(O)n1 1807375885 QTPPNOVSXHKKNP-XMSQKQJNSA-N 460.299 0.804 50 20 JCGD O=C(CNC(=O)c1ccco1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807587882 LCPZOTILZRNHIH-XMSQKQJNSA-N 476.298 0.104 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccc1-n1nccn1 1811469716 JJLYTFPDRJPFEV-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1C 1811629442 VKAGIEMMTYYFIA-LAUBAEHRSA-N 463.303 0.137 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344309 SLZHYQOBCSTFMH-WFASDCNBSA-N 458.349 0.354 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ccccn3n1)CC2)c1cccc(B(O)O)c1 1815354722 QVZAJHUPKBKCKM-CQSZACIVSA-N 462.300 0.405 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)N1 1817133445 GKXKTOPNNDQVOJ-KMUQISDUSA-N 489.982 0.770 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1)[C@@H]1SC(=N)NC1=O 1818100046 BIPGEDDLDHSUEX-FSBGKCOPSA-N 499.557 0.517 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc4[nH]ncc4c3)sc2C1 1818951355 FVFUQHKQHVCGCN-LBPRGKRZSA-N 477.510 0.953 50 20 JCGD C[C@H](CN)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822518358 NKOWETYFASJSSF-GDBMZVCRSA-N 473.603 0.996 50 20 JCGD CNc1nsnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1823741133 QEPFFLYECIYVTF-QGZVFWFLSA-N 457.365 0.807 50 20 JCGD O=C([C@@H]1CCCS1(=O)=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060637 WAIZUCWWGBEORG-PMACEKPBSA-N 462.377 0.177 50 20 JCGD CC(C)CNC(=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1827703526 FHJZYVYAZDVEPH-IBGZPJMESA-N 458.563 0.691 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1829114540 ALVIHUVRVRIKOM-WOJBJXKFSA-N 474.562 0.070 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1 1830539245 FNFCRLHGUNKWMV-WKWJGNFBSA-N 459.385 0.946 50 20 JCGD Cn1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(C(F)(F)F)c1 1830727938 LDHVKSSVPYATAF-PBHICJAKSA-N 453.845 0.714 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)C(=O)c3ccccc3)CCO2)C1 1831150818 SLYZEJFDEVVONK-HRAATJIYSA-N 482.375 0.998 50 20 JCGD Cc1cc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C)c1 1831166934 AAEQNQNOYZIPJZ-AREMUKBSSA-N 496.369 0.441 50 20 JCGD O=C(CCCN1C(=O)c2ccccc2C1=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832540812 IXWNFLRXLGXFRD-JPYJTQIMSA-N 493.944 0.119 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3C(N)=O)CCO2)C1 1833316442 PIRNSMAJMLKISG-IFXJQAMLSA-N 469.336 0.424 50 20 JCGD CC(C)c1nc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)co1 1833926397 DXPLJGLFYKIMOW-UHFFFAOYSA-N 468.363 0.977 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C(=O)c3ccccc3)CC2)CC1 1834381128 FKVWEMVGSPNJEK-UHFFFAOYSA-N 457.575 0.814 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cc(CO)on3)CC2)CC1 1835117579 AFZROZBRLLQBDQ-CVKSISIWSA-N 485.545 0.486 50 20 JCGD Cn1c(=O)c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nc2ccccc21 1835369462 SDZLLHBZRRGYSO-LJQANCHMSA-N 475.977 0.718 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835709479 QBQZSTSWJLBYEW-IUODEOHRSA-N 464.380 0.956 50 20 JCGD O=C(Cc1ccc2ncccc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926962 AIELCCRSCVGGIP-AREMUKBSSA-N 489.337 0.227 50 20 JCGD CC(C)c1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939926 PCQWZPNQSGNAQI-AREMUKBSSA-N 480.370 0.803 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@]3(F)CCCC=C3F)C2)C1 1835940863 CCEUOQMAUUFNGB-YADHBBJMSA-N 464.274 0.182 50 20 JCGD Cc1ccccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461068 MYUBEQWVDYAAOA-RUZDIDTESA-N 481.553 0.696 50 20 JCGD C[C@@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)c1ccccc1 1837461338 USIUWHIHEFWFAI-BVZFJXPGSA-N 481.553 0.949 50 20 JCGD O=C1CC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)=Cc2ccccc2N1 1838443267 GXEZIGXLWZICTJ-GCJKJVERSA-N 463.918 0.468 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838490910 LEKBOSOLYNAOOB-QRWLVFNGSA-N 465.894 0.110 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838499053 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Cc1ccc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840664231 DMENNHIEVZEGOI-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD C=CC[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1840795795 CIGIRXIGRGTEJY-HYFFOGBASA-N 489.997 0.902 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)CC2=O)c1 1841008970 SURNHRLFYCRQCZ-INIZCTEOSA-N 492.536 0.564 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc(C(F)(F)F)n1 1843014214 KWGZESGXFQBQBP-UHFFFAOYSA-N 463.221 0.920 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1 1843363422 CVJXGEMTYAWHQM-DLBZAZTESA-N 497.760 0.540 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)COCCOCCNC(=O)OC(C)(C)C 1847645445 AJXMNDOFGUFJAU-ULQDDVLXSA-N 477.986 1.000 50 20 JCGD O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)c1ccc(-n2cnnn2)cc1 23690328 HUCNTBJZSMSYNB-UHFFFAOYSA-N 483.286 0.986 50 20 JCGD CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2S1(=O)=O 108787273 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COc1ccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(OC)c1OC 1830886901 MCVNEFBFRBFEMK-ADMRXCGISA-N 498.960 0.782 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@@H]1COc3ccccc3O1)CCO2 1831237406 UEPVIAXGYOZXIJ-KOSHJBKYSA-N 490.557 0.046 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1834972750 JTMMJCDVQOQRLE-OAHLLOKOSA-N 464.958 0.405 50 20 JCGD CC(C)c1nc(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)no1 1835737080 KYMMTXKZRMKLOO-UHFFFAOYSA-N 498.588 0.619 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1835938046 HABMVHSBKGJZJS-HXUWFJFHSA-N 481.236 0.097 50 20 JCGD Cc1cc2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)[nH]c2cc1C 1835938574 ZNCRBJDUZXBMEL-VWLOTQADSA-N 492.341 0.243 50 20 JCGD CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1836005204 JDEXDROGLDLDOB-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD CCc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1Br 1836281449 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CCC(=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528367 TVDFCJVLNQADBV-OAQYLSRUSA-N 463.443 0.569 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)[C@@H](O)C1 1839109524 JXCKHYNTYUGXQH-PJSUUKDQSA-N 496.388 0.474 50 20 JCGD O=C1CC[C@@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](Br)Cc4ccccc4)CCO3)C2)N1 1839801939 IOLUXFMWDDVFPX-NPPFBWRTSA-N 494.386 0.728 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](C)Br)CCO3)C2)C1 1840030419 LNWGAYFITUTGEH-XTDOFWJNSA-N 461.353 0.816 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccc(F)cc3)C2)C1 1840154314 RYULPGAOAMDPFA-LZFQIVBZSA-N 485.940 0.654 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1 1840155322 XQUVNQBOBKPMFM-UWJYYQICSA-N 450.923 0.897 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)C1 1840218782 PADUQNAQMSJPST-VOBQZIQPSA-N 479.933 0.349 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1840897344 XXQYQQRNCGCOBR-HNNXBMFYSA-N 456.373 0.107 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843015234 UZLGAALQEIIMIW-QGZVFWFLSA-N 471.363 0.831 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CN(Cc3ccccc3)CCO2)C1 1843925368 FCXLFMPACOVLGA-HXUWFJFHSA-N 457.575 0.464 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CNCP(=O)(O)O)C2 1844692410 UIIVXCADVJRBIU-UHFFFAOYSA-N 470.375 0.062 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2[nH]nc3c(Cl)cccc23)C1 1845023924 PUXAIMAYRPXJMJ-UHFFFAOYSA-N 452.707 0.956 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1846124620 WAKYAQJUFPSZAO-XMMPIXPASA-N 489.353 0.923 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1847007625 FMSWVWGYICALGC-HXUWFJFHSA-N 472.590 0.841 50 20 JCGD C[S@](=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847446763 GLOVLTGWVXEQSZ-UQPQLIOHSA-N 466.000 0.450 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(F)cc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1 16128110 NNHNQOURLRBVFW-UHFFFAOYSA-N 461.468 0.609 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc3c(c2)CC(=O)N3)cc1 26318723 LEIUZRMXJNJASI-UHFFFAOYSA-N 452.514 0.120 50 20 JCGD COc1cc(C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc(OC)c1OC 26956908 LILHBTGRHDWPSB-UHFFFAOYSA-N 451.501 0.879 50 20 JCGD N#CCCn1cc(/C=C(\C#N)C(=O)N2CCN(C(=O)Cn3cnnn3)CC2)c(-c2ccccc2)n1 727391995 LRSBREONDVGQDX-CPNJWEJPSA-N 470.497 0.728 50 20 JCGD CN(C)S(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=O)c1cccc(Cl)c1 728704089 BCAGIJLCYMOTEX-UHFFFAOYSA-N 452.876 0.959 50 20 JCGD Cc1nc(-c2ncccn2)nc(O)c1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1 729257724 OMYNEGSCDIVWQS-UHFFFAOYSA-N 456.488 0.244 50 20 JCGD CCOC(=O)c1sc2[nH]c(CSCCC(=O)NNC(=O)c3cnn[nH]3)nc(=O)c2c1C 729455787 ACRUJGFUNSULPG-UHFFFAOYSA-N 465.517 0.672 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1sccc1C#N)c(=O)n2Cc1ccccc1 748053004 AYBYAFJNYRDUGR-UHFFFAOYSA-N 477.506 0.822 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cnc(C)cn1)N(S(C)(=O)=O)CC2 913161517 NCFZXPIZGQDOHD-MRXNPFEDSA-N 463.516 0.512 50 20 JCGD COc1c(F)cc(CC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1S(N)(=O)=O 915636380 SAOAJIOZFOQMTC-UHFFFAOYSA-N 491.501 0.776 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)cc1 915880790 ZEIUPODDKDUOLQ-SFHVURJKSA-N 494.595 0.947 50 20 JCGD C#CCNC(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 915908106 BZQWOVCEUQSTTH-UHFFFAOYSA-N 451.487 0.028 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC3CCN(C(=O)c4ccco4)CC3)nc2)CC1 916243982 YPSRDUKYHHGWAP-UHFFFAOYSA-N 491.574 0.542 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 916830680 OWGULURIXZELDH-UHFFFAOYSA-N 476.511 0.611 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCS(=O)(=O)c3ccccc3)nc2)CC1 918229785 QUPUHEFPOHVZCG-UHFFFAOYSA-N 482.588 0.118 50 20 JCGD CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 918409233 HIUFCDUNJRZPEO-UHFFFAOYSA-N 473.511 0.924 50 20 JCGD CC1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)CC1 919883812 FQHAFLWGSNTENJ-OAHLLOKOSA-N 458.562 0.238 50 20 JCGD C[C@@H](OC[C@H]1CCCCO1)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 921146171 MAEIKRCGZLNSLU-IEBWSBKVSA-N 483.587 0.762 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ccncc13)C2 1778090939 IIGYWPIUCOHORZ-BMIDIIHHSA-N 492.540 0.991 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Br)CC)C2 1779201034 QDBGDWKRDSGRAE-SCGCMHLBSA-N 464.357 0.738 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1NC(C)=O 1780215980 UZDSZPQNEKHKOO-HSZRJFAPSA-N 475.546 0.470 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(O)nn1)C2)[C@H](F)Br 1780776291 BRKDQSIMSOUIRR-XQAQDONZSA-N 461.288 0.765 50 20 JCGD Cc1nccn1CC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969035 SWJQOZAIPGNQMV-XMMPIXPASA-N 483.573 0.368 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)C1 1781332899 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COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(Cl)c1 1785121789 JNAFLNDCQGUHSX-QFIPXVFZSA-N 458.707 0.786 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CC1 1785376073 UDWXPYUTZBWAQW-JOCHJYFZSA-N 467.567 0.058 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncccc4c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979656 HYHLVVCEVVIZRL-RRPUWOKSSA-N 459.311 0.822 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(Cl)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980100 JCIIJRKBRVOEAD-JQFCIGGWSA-N 459.695 0.028 50 20 JCGD CCOC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1790260920 UVUGKVYEIDSYLR-YYWHXJBOSA-N 495.536 0.769 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1790651425 SHPWEDXUSUAVHG-YDHLFZDLSA-N 471.308 0.521 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1COCCN1C(=O)OC(C)(C)C 1793604203 HOSDLVHFBAWJRB-RBZJEDDUSA-N 490.395 0.995 50 20 JCGD O=C(CN1C(=O)COc2ccc(Cl)cc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796189880 LKDKDNWDXYSQBA-REPLKXPHSA-N 497.744 0.697 50 20 JCGD CCCc1onc(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797750971 XLTTUDIHTAJEJS-HBCWATKFSA-N 456.503 0.451 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)no1 1799094644 BSWDNFXCRGVXRD-RMFSNUHRSA-N 470.530 0.532 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799346897 ILBJENYGFYRVMO-ARSDKDGVSA-N 494.358 0.637 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cc(Cl)ccn13)C2 1801013314 NIPUQGNBFYIXKY-VTEUUUEMSA-N 462.938 0.564 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808417545 LQDANMVIBQZPCX-FNCOCRCRSA-N 479.541 0.912 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc2ncnn2c1 1810054172 YQHRNCFPIBXKBG-GCJKJVERSA-N 470.298 0.438 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCc2ccc(O)nn2)[C@H]1c1cccnc1 1812327629 GPIPLRNZBCKPDR-GAJHUEQPSA-N 469.546 0.589 50 20 JCGD CCOC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1812466443 MJSDBGZVPCRULJ-LPHOPBHVSA-N 480.525 0.743 50 20 JCGD CCC1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)COC1 1812490359 MMVQIHXOEWDTGD-VQIMIIECSA-N 452.515 0.826 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1 1814795240 IVDNQEFLMJVIMA-MCIONIFRSA-N 459.931 0.887 50 20 JCGD CCOC(=O)C1(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)CC1 1817475193 KWIUBJJRPPBUOV-QGZVFWFLSA-N 454.292 0.739 50 20 JCGD C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNCP(=O)(O)O)CC2 1825641377 HEQBCAUFVHPINO-JGVFFNPUSA-N 455.271 0.563 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc(C)c(O)nc1=O)CC2 1826008454 BIUCPNGFIIQXHH-QWRGUYRKSA-N 455.924 0.580 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826087713 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O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832172881 ZQQPIZMXXLKEGM-PXNSSMCTSA-N 455.895 0.584 50 20 JCGD O=C(Cc1ccc2c(c1)CCC2)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832504205 NYNHGTCAFGPJLX-SANMLTNESA-N 478.354 0.168 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)n1 1833035596 LZFWUGWXRMWWCQ-KUHUBIRLSA-N 457.369 0.987 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)C1 1833307496 VREPGLATRPDMFI-MSOLQXFVSA-N 479.622 0.520 50 20 JCGD CC(C)N1CCC(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1833696921 NXFIJVMOCLVOAK-UHFFFAOYSA-N 484.450 0.672 50 20 JCGD Cc1nnc(CCC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1833832562 WJSYHDZOKUKDBJ-UHFFFAOYSA-N 485.419 0.344 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc[nH]3)CCO2)C1 1834104871 RTIPGFKUNWBTRU-NRFANRHFSA-N 473.442 0.627 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cn4ccsc4n3)CC2)CC1)c1cccc(B(O)O)c1 1834799980 KYVIFXNYADWVJI-UHFFFAOYSA-N 481.387 0.575 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)n1 1834823427 URNSCPIFJZPSJH-FQEVSTJZSA-N 485.379 0.528 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1 1835755299 ZSUYLISGPMIMIM-UGSOOPFHSA-N 490.395 0.836 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835925965 DRIAJJHQAFKDDY-RUZDIDTESA-N 495.316 0.230 50 20 JCGD COc1ccc(Cl)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1835939777 HJFCRCKEDPXMRK-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD O=C(c1cnc(C(F)(F)F)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836374593 AGOBNBVDRAAMBD-LRDDRELGSA-N 452.817 0.165 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCCC#C[Si](C)(C)C)CCO2 1837432781 NYSXGZVJAFWZOB-HSZRJFAPSA-N 480.682 0.867 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4)CCC3)C2)C1 1837461268 RVSOYUIVFIDYGC-VWLOTQADSA-N 493.564 0.877 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cc(C)on3)CCO2)C1 1837550357 ZYNHLEGDQPUFBJ-LIRRHRJNSA-N 487.351 0.343 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1838022795 GMNGWYISDFNRHT-AWEZNQCLSA-N 496.366 0.598 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1csc(C(F)(F)F)n1)CCO2 1838188808 FQTYWHMGVBWNIE-SFHVURJKSA-N 493.508 0.605 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1sccc1Cl)CCO2 1838222749 IGXMPXXCMLCBDW-HXUWFJFHSA-N 464.736 0.465 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1 1839153825 SUPMWIXQTWMYOU-SFTDATJTSA-N 489.400 0.980 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CCO2 1839384620 MOFAKCQPMPFRKV-BIENJYKASA-N 494.383 0.317 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cc2s1 1839524214 BEGYNJMUOPTILJ-QHCPKHFHSA-N 498.565 0.920 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1 1840647993 ZGFCCMXUTLMULG-KDOFPFPSSA-N 458.284 0.546 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C[C@H]2C[C@H]21 1843012765 LPXWWHOZBKDTAG-BHIYHBOVSA-N 469.347 0.581 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cnn3ncccc23)C1)NC(=O)NCc1ccccc1 1843309230 JDCVEIBLLWSCEX-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nc3ccc(F)cn3n1)C2 1843416648 JCAZBPCDAXOYEH-DHRITJCHSA-N 452.450 0.819 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1 1847742375 ANFOSZXYRYZSOB-WDSOQIARSA-N 458.563 0.449 50 20 JCGD COc1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nnc(C)c(=O)[nH]3)CC2)cc1OC 11548174 YIEZCBIUYQTVIP-UHFFFAOYSA-N 452.493 0.035 50 20 JCGD C#CCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 728214390 OFEJRSSMVOBNGH-UHFFFAOYSA-N 491.595 0.291 50 20 JCGD CN(C)c1ccc(NC(=S)NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 729690952 RLMGFZFCZBRBLP-UHFFFAOYSA-N 478.600 0.751 50 20 JCGD O=C(COC(=O)Cn1cnc2c(oc3ccccc32)c1=O)NNC(=O)[C@H]1COc2ccccc2O1 742378544 WRNIFCJUZZSFBW-QGZVFWFLSA-N 478.417 0.673 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCCNC(=O)Cc2cccc(F)c2)c2ccccc2c1=O 749014692 LMKPVPFLUBJGOX-UHFFFAOYSA-N 454.462 0.858 50 20 JCGD COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)CN3C(=O)CCC3=O)CC2)c1C 749570812 BGSSGNUVBKVEGI-CPNJWEJPSA-N 455.515 0.478 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)c2ccc(OCC(=O)N3CC[C@H](B(O)O)C3)cc2)cc1 864233362 GVPFSDBLCMKZAS-INIZCTEOSA-N 475.332 0.924 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 873822210 YTCCQGXPGQGDPZ-IXDOHACOSA-N 496.611 0.605 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)NC)cc2)c2ccccc2c1=O 906379172 APRPRNXKAITJPR-UHFFFAOYSA-N 479.540 0.338 50 20 JCGD CCCCCn1nc(C(=O)NNS(=O)(=O)c2n[nH]cc2C(=O)OC)c2ccccc2c1=O 912520474 ARSDJGKVDYKHES-UHFFFAOYSA-N 462.488 0.720 50 20 JCGD CN1CCN(c2cc(CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)ccn2)CC1 916390043 KJFUULYKMAPFQX-UHFFFAOYSA-N 450.503 0.225 50 20 JCGD C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)CN1CCCCC1 918103419 AOFJJCSSCKVDKP-QGZVFWFLSA-N 467.592 0.774 50 20 JCGD O=C(CCCN1C(=O)c2cccc3cccc(c23)C1=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919883850 DFDBDSHEZYHPFJ-CQSZACIVSA-N 458.496 0.734 50 20 JCGD C[C@@H]1CCc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C4)n[nH]c21 1778603798 BNJBZOCTEHZCQH-QDOIMOTRSA-N 460.579 0.960 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCN(C(C)=O)CC2)C1 1778911090 ZEYUHTQMQJFIDL-DBXWQHBBSA-N 487.439 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnn1-c1ccccc1)CCO2 1779030180 HXACKHJTBYKPTC-DEOSSOPVSA-N 475.509 0.628 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779563914 GUOOAFQSKXYHJX-WPSZSDGUSA-N 466.347 0.390 50 20 JCGD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1780430561 VILITIBZDPHAAW-ZJSXRUAMSA-N 452.316 0.816 50 20 JCGD COc1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c(C#N)c1 1780688483 SHMKCSRGMDUVTF-PXDATVDWSA-N 485.585 0.996 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1780713561 YKSWAFXYRVUIMW-NSISKUIASA-N 457.163 0.730 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1F 1782109011 IMYCVHLUEQXHCP-QHCPKHFHSA-N 473.285 0.468 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c12 1782373472 XWVIFAZPXLQEOI-XMMPIXPASA-N 463.299 0.614 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1 1783884371 RPKGUHRUMJPKIJ-VWKPWSFCSA-N 457.955 0.987 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccccc1-n1nccn1)CCO2 1783934433 HLERCGFVZZHVNI-JOCHJYFZSA-N 455.519 0.084 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnn1-c1ccccc1)CCO2 1783935309 RXCNQKGESUHZRZ-HSZRJFAPSA-N 454.531 0.689 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(N3CCCOC3=O)cc1)CCO2 1783935615 WCEQKNOEEHCUQL-XMMPIXPASA-N 487.557 0.850 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCS(=O)(=O)c3ccccc3)C[C@@H]21)[C@H](O)CCl 1784089749 HDJIGIIPBDEFGO-OWLYRPNTSA-N 458.964 0.430 50 20 JCGD C/C(=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C(=O)O 1785412696 YQPNOEQZPDNFRN-PLMTYRIPSA-N 459.927 0.979 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)CN)C[C@@H]21 1790696229 GBAQEBPNZGFAFD-COUMVOCASA-N 476.375 0.622 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc(Cl)n1 1791291077 KTKFWLUCEYNPOT-BPUTZDHNSA-N 467.954 0.710 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792239187 ULCACVGTDKENRQ-IHRRRGAJSA-N 459.666 0.678 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccc(Cl)cc1 1792948668 MDIKUAPHTQGQSW-CCWDJLKJSA-N 450.923 0.485 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)cc1 1793145520 JJXALNGJHCQULK-RNGZQALNSA-N 457.980 0.900 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)CCBr)C2 1795116399 FYJNAKSLUFGXHC-AFIMGQEJSA-N 497.390 0.997 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nnc(Br)n2c1 1795927190 GNFILYFLAMHYGE-QVHKTLOISA-N 486.754 0.949 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cncn3c1)C2 1796441999 MKVNDSNFNTVTCY-KEMUROEHSA-N 463.498 0.672 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801173776 GQSKUJWDGAYEBV-LAVAIGHBSA-N 451.527 0.767 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)[C@@H](O)CCl 1803147464 GITVXCPBFYTZDR-HEHGZKQESA-N 456.977 0.547 50 20 JCGD CC(C)c1nc(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)no1 1804411963 BAYPJLXSMIWPSA-AVRDEDQJSA-N 477.330 0.830 50 20 JCGD C[C@H](Cn1cccn1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804714830 DWAYQDRBAKNOKR-PIPMEXSNSA-N 461.331 0.614 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3cccnc23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362571 MDHJBBLIWZRNLI-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366833 HNZYUJLGXQLEPG-GHTZIAJQSA-N 460.299 0.302 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807369322 GPZKQXODAIBXFP-AGHHOFFYSA-N 461.331 0.614 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807376870 WXYHSXMSGJSFHQ-PMVMPFDFSA-N 473.342 0.046 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810294073 HYIFYGWPPDXFJH-XMSQKQJNSA-N 476.541 0.913 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccnc2c1OCO2 1811310690 XNYCKHJRWYKCAS-XLIONFOSSA-N 474.282 0.519 50 20 JCGD Cn1ccc(=O)cc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1811367408 DAYUTIYTFODMLM-IIBYNOLFSA-N 475.509 0.412 50 20 JCGD CCOc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nn1 1811627562 NNSHXDRQPIEGDS-VGSWGCGISA-N 469.546 0.963 50 20 JCGD CN(C)c1cncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1 1815354781 DBQJJWASVCEACR-INIZCTEOSA-N 465.344 0.824 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1(Br)CC1)CC2)c1cccc(B(O)O)c1 1815360578 UPTRUNVTBYLXKE-LBPRGKRZSA-N 464.150 0.976 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817282770 LRTROLOMFJATSP-VPWXJFHASA-N 459.532 0.714 50 20 JCGD N[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cccnc1 1817405672 NEFCDAXMOPGOMV-UYAOXDASSA-N 462.319 0.881 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCN(C(C)=O)CC3)sc2C1 1818898581 SUHPEDKQFRQEFV-KGLIPLIRSA-N 457.984 0.473 50 20 JCGD COc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1 1820507877 DSFKGDMFRSUSLS-CQSZACIVSA-N 452.301 0.766 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1 1823530566 OPNAFGWAZLAXNT-MELADBBJSA-N 486.957 0.770 50 20 JCGD Cn1cc(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1 1827090458 MFABBXJKDHBAID-JOCHJYFZSA-N 452.364 0.966 50 20 JCGD COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1828861514 STPLWTZJOMLXPL-VWLOTQADSA-N 495.341 0.079 50 20 JCGD CN1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1 1828924226 LAZVWKYZCQISCV-NRFANRHFSA-N 471.606 0.166 50 20 JCGD CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCN2C(=O)OCc1ccccc1 1829000388 HKEOIYWPAMVZPY-DEOSSOPVSA-N 465.315 0.452 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)C1 1830713582 DSTVHMSINIUAGB-LWGWVAHUSA-N 465.316 0.723 50 20 JCGD Cn1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc2c1-c1ncccc1OC2 1830724061 VELWZTOCBWIKSJ-SBUREZEXSA-N 490.944 0.649 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(Cl)c1 1830726597 RMAQOYJZXRUYIK-PXNSSMCTSA-N 461.342 0.947 50 20 JCGD CCOC(=O)N(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)Cc1ccco1 1830737865 JKZZUSYYAXJRMG-DYESRHJHSA-N 487.937 0.294 50 20 JCGD Cc1cccc(/C=C/C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1833064397 ZBKNLXAPSKJJRX-MDZDMXLPSA-N 476.386 0.968 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)no1 1833310447 IQCRDFJBKAGFSC-MRXNPFEDSA-N 455.943 0.483 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(C)noc1C)CCO2 1834065445 FTXKJEWWPDDBHW-NMWDDECMSA-N 472.502 0.495 50 20 JCGD O=Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1834797972 RIZPCPDXWXCNPH-UHFFFAOYSA-N 469.372 0.739 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCCc3cccnc3)CC2)CC1)c1cccc(B(O)O)c1 1834801559 XMCMDTKCBAVLMN-UHFFFAOYSA-N 478.402 0.970 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)cc1 1835067591 YULOUORHCHKUOS-QTPRHWQCSA-N 497.552 0.828 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ncccn3)CC2)CC1 1835118363 TZTIVUWGQRLSBE-LQKURTRISA-N 466.546 0.796 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)ccc3O)CC2)CC1 1835738143 IGMJNZDJHUXISE-UHFFFAOYSA-N 482.541 0.595 50 20 JCGD Cc1cc(C)cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835933611 DJMRBVVSWRMSAU-SANMLTNESA-N 480.370 0.686 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(F)cccc3F)CCO2)C1 1838995853 RDUQKJTZYUDKMV-QHCPKHFHSA-N 489.479 0.276 50 20 JCGD O=C([C@@H]1ON=C(c2ccccc2)O1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200930 SJYAGEFEBJKMTK-JVPBZIDWSA-N 486.294 0.868 50 20 JCGD O=C(NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1ccccc1 1839203269 GXRZLUAYOVCUPV-XLIONFOSSA-N 486.338 0.953 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1 1840152276 DFSVUVBPPODAEJ-NYHFZMIOSA-N 478.933 0.257 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840190378 UJQVZALKCJSRGZ-OAHLLOKOSA-N 456.373 0.107 50 20 JCGD CCn1nnc2c1[C@@H](C(=O)N1CCCC13CN(C(=O)[C@H](O)CCl)C3)CN(C(=O)OC(C)(C)C)C2 1842055977 GSLGNQYMTGJFOM-GOEBONIOSA-N 496.996 0.935 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)[C@H]2C1 1843014890 MXNXFTMXZJNIRK-HSALFYBXSA-N 499.373 0.065 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2csc(Br)n2)C1 1843569047 OVPBKTKEEAXFMQ-UHFFFAOYSA-N 450.123 0.716 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1847865390 QTOJCEMILGBERX-RDBSUJKOSA-N 450.927 0.043 50 20 JCGD O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccccc1S(=O)(=O)N1CCOCC1 726862559 SZQWRJWPZLMZMU-UHFFFAOYSA-N 480.568 0.905 50 20 JCGD Cc1cccc([C@@H](CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)NC(N)=O)c1 728322463 BBMXXNPTXVZAAE-QAPCUYQASA-N 456.455 0.625 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc(C#N)c1 728872466 NMDRYXCHCQBZEI-KRWDZBQOSA-N 498.970 0.754 50 20 JCGD O=C(NNC(=O)N1CCN(Cc2nc(O)c3ccccc3n2)CC1)C1CCN(c2ncccn2)CC1 728960401 YEMMBOFLQDHGIR-UHFFFAOYSA-N 491.556 0.900 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)O[C@@H](C)C(=O)N2CCNC2=O)cc1 729621649 CGDVRJVXQWJUCG-LUYJPIOASA-N 480.481 0.825 50 20 JCGD C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 750281743 XRDAFUZAVVJXNJ-WSMBLCCSSA-N 459.455 0.081 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1 751206325 DSSBVNOSSYQJIO-UHFFFAOYSA-N 492.510 0.029 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)C2CCN(S(=O)(=O)c3ccccc3F)CC2)n1 752859096 OJLXJTACMAERTO-UHFFFAOYSA-N 498.558 0.925 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccccc2OC)cc1OC 768291218 JWOJGPUGHBHQGY-UHFFFAOYSA-N 453.473 0.217 50 20 JCGD O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)NNC(=O)[C@H]1COc2ccccc2O1 848978615 KIUVOSXGUNBZQD-JLTOFOAXSA-N 497.460 0.341 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cn3ccc(=O)n(C)c3=O)c2)c(C)c1 915063773 LEOUSOYULAEQQG-UHFFFAOYSA-N 485.522 0.426 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCCn1ccnc1)N(S(C)(=O)=O)CC2 915905415 QYGBFUUEPUPSHJ-INIZCTEOSA-N 480.547 0.180 50 20 JCGD CC(C)CS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 916105766 DXLDDJOWFNCABY-UHFFFAOYSA-N 467.569 0.997 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2C)cc1 916830218 CVDZRDFATKCJRK-UHFFFAOYSA-N 460.512 0.724 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)cc1[C@]1(C)NC(=O)NC1=O 917721431 YSMGVEGBACBZRU-FQEVSTJZSA-N 472.483 0.329 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)cc1 920977751 KHBZZVIMRTXQIJ-OQLLNIDSSA-N 467.573 0.020 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1OC 921190850 JRCTWJBZAXNPEM-UHFFFAOYSA-N 493.538 0.955 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3cc[n+]([O-])cc3)C2)C1)NC(=O)NCc1ccccc1 1779887015 DECTUAGUMKHBJY-XMMPIXPASA-N 482.541 0.110 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CC[C@]4(C3)CN(C(=O)C(C)(C)CCl)CCO4)csc2n(C)c1=O 1780921782 SKSVUUKMIDSJDY-QFIPXVFZSA-N 497.017 0.936 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(=O)c1ccco1)CCO2)NC(=O)NCc1ccccc1 1780968181 BFXNKDJPOKTRAY-XMMPIXPASA-N 483.525 0.638 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1)NC(=O)NCc1ccccc1 1780968660 DDOCYVXAEAXHGL-VWLOTQADSA-N 498.559 0.939 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CSc3ccccc3[N+](=O)[O-])C2)C1 1783787118 ZBVRXDLNZWTYBR-NRFANRHFSA-N 479.559 0.890 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783934769 MKMASLSCHZZZFP-NRFANRHFSA-N 465.482 0.859 50 20 JCGD Cc1nc[nH]c1CSCC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936729 ZTBZFRWTTUIRIS-FQEVSTJZSA-N 452.581 0.154 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3Cl)C[C@@H]21)c1ccc(B(O)O)cc1 1786983666 PGJJKSBBNPGICW-CEDBRAGKSA-N 472.734 0.347 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccncc34)C[C@@H]21 1787508587 BWJUIBGDNWGPFA-PGMBAZLQSA-N 478.513 0.457 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ncncc4c3)[C@H]2C1 1788379798 RGUUBRLZINAVIH-QRFRQXIXSA-N 454.531 0.596 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4[C@@H]3O)C[C@@H]21 1788607764 FVSYQSTUZYRKJS-DCDFMAEDSA-N 493.564 0.574 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCC(F)(F)C3)C[C@@H]21 1788607922 VRZJEFWLTUVVFO-PYTWLRIVSA-N 451.474 0.714 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)[C@H]2C1 1792275478 MBNQRYMFKGEIIW-ZOFXXKQRSA-N 492.013 0.884 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1cccnc1)C2 1792868457 APUIVEZVFCMMJE-FAYQHZLMSA-N 453.337 0.432 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(C2CCCC2)C1)c1cccc(B(O)O)c1 1794027488 CTTRAYUSHSTTRU-FRTACKCFSA-N 453.348 0.409 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccc(N2CCOCC2)cn1 1794441517 MUHHXRHPEWORGL-RMHZUWNSSA-N 471.327 0.812 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCCN1Cc1ccccc1)C2)c1ccc(B(O)O)cc1 1795735012 IITJGTHKOLUUTQ-VRUIKYSZSA-N 491.397 0.624 50 20 JCGD O=C(Cn1ccnn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1795893087 DURMYQVZEQTKRI-SFNKJDCFSA-N 462.348 0.874 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1797240938 VYSSAHFXBCIIRH-IRJINJETSA-N 464.327 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cccc(F)c13)C2 1797753623 CFCBVFNAIIVRRK-KSPBDQMDSA-N 467.461 0.218 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C)n1)C2 1798522767 XNPWPSZCNGUKTM-HBCWATKFSA-N 457.443 0.771 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)nn1C 1799095039 RHAIDVBAVSFZBM-HATOLVCRSA-N 483.573 0.278 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1)C2 1800982677 IPEOMGZPMZGJOM-ZMMAXQRCSA-N 489.013 0.383 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1)C2 1800982991 NQRZXOHHZJGCKN-NNXHMXCWSA-N 475.970 0.466 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)NC2)[C@H]1c1cccnc1 1802613075 QYTXSAKIDPMVSH-ZMCLEAOESA-N 479.541 0.748 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803141707 TVANDBMRTKAAGP-VSZNYVQBSA-N 484.981 0.963 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803611958 BWCCBVZEOWYRON-NBPAUJCUSA-N 454.531 0.807 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1 1806340800 NKNBAGUTXOMFTK-CXAGYDPISA-N 474.319 0.917 50 20 JCGD CN(C)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807361578 GOBRVTZSRKDRLO-XXBNENTESA-N 473.342 0.856 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364813 UKSOWCRTVIKPPF-GHTZIAJQSA-N 470.298 0.438 50 20 JCGD Cn1ccc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1807512853 PGIVXIZGJYQDFQ-IIBYNOLFSA-N 462.514 0.376 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1 1809530482 CRDBWPPYDMRPFV-UZLBHIALSA-N 481.513 0.242 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810295691 VNEHBQAKVFUJFJ-CWZDDEHYSA-N 477.525 0.258 50 20 JCGD CCn1nccc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810298363 IALKMJMFUINOTB-JXFKEZNVSA-N 462.514 0.930 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1811065769 BAXVBVKXDYRAJY-WMZHIEFXSA-N 473.342 0.856 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812365512 NRNWBBMAETXAHW-BPAFIMBUSA-N 469.303 0.643 50 20 JCGD O=C(CN(CCO)CCO)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1 1812713136 HBFUFPRKRAQCDC-APWZRJJASA-N 457.369 0.159 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1 1813071379 PBYXJIXPMGPXAL-FDDCHVKYSA-N 454.531 0.322 50 20 JCGD CC(=O)N[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(C)(C)C 1815056524 CGEFUMARVLJYIN-QUCCMNQESA-N 469.351 0.946 50 20 JCGD COc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c(F)c1 1815355666 YFYAXLGLPCFRMB-CYBMUJFWSA-N 470.291 0.905 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1)c1ccc(B(O)O)cc1 1817471942 YFBATEGIDMAYAX-INIZCTEOSA-N 460.263 0.147 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCN(C)CC2)[nH]n1 1818112884 SFIPQPIFBUCRQI-JHKMYFMNSA-N 483.577 0.783 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cnc4ncccn34)sc2C1)c1cccc(B(O)O)c1 1818434392 GXRLAIHRBSLRMR-CQSZACIVSA-N 462.300 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4ccncc34)sc2C1 1818504676 HNSRFZFOBBXOOR-NSHDSACASA-N 477.510 0.724 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCC3)CC2 1819798139 YVHKWUFCVSDCRO-LLVKDONJSA-N 466.527 0.824 50 20 JCGD C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](O)N3CCOCC3)sc2C1 1819877392 UAMVKPYZKFCSSJ-OHUAYANFSA-N 461.382 0.737 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CC(c4ccccc4)=NN3)sc2C1)c1cccc(B(O)O)c1 1824435255 ZFKHQPWUYKFSGQ-YLJYHZDGSA-N 489.366 0.815 50 20 JCGD NC[C@H](N)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1829046637 CSFRGDIBCHMBOA-FTRWYGJKSA-N 455.918 0.259 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1830539045 ZSKDPIIOKSVENB-KUHUBIRLSA-N 472.336 0.497 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1830543636 WYZXYJUHQXUTTG-XOBRGWDASA-N 494.346 0.191 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1830575525 VUFJMZWJGFFHKN-AUSJPIAWSA-N 463.959 0.346 50 20 JCGD O=C(c1cc(Br)c(O)cc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731173 HMOAMZATHWYTND-QAPCUYQASA-N 495.729 0.964 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](F)Br)CC1)C(=O)C(=O)O 1831166340 CFOKMBWFXDQQBM-JSGCOSHPSA-N 450.305 0.840 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](F)Br)CC1)C(=O)C(=O)O 1831166345 CFOKMBWFXDQQBM-TZMCWYRMSA-N 450.305 0.840 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn(C)c3=O)CCO2)C1 1831892932 FRDRKRWGQGLCEM-DNVCBOLYSA-N 456.337 0.629 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3)C2)C1 1832549578 UZYSWWKAOWSJEN-MGPUTAFESA-N 472.926 0.877 50 20 JCGD O=C(c1ccc(Cl)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931169 HTWWNJMYMPGYBH-JOCHJYFZSA-N 458.707 0.404 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc[nH]c4cc3Cl)C2)C1 1835937409 UTIASWPMCLFULN-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836337835 XLNCGROGRLQNEM-QGZVFWFLSA-N 484.022 0.063 50 20 JCGD CN(C)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837327669 ZLMOJLZSTSLCBP-UHFFFAOYSA-N 480.374 0.753 50 20 JCGD Cc1cc(F)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461249 RJTCXCPSFBRVCA-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CS[C@H]3CCCCO3)CCO2)C1 1837509347 XOZNZGLFTNNQNJ-UGKGYDQZSA-N 493.586 0.015 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)Cn3ccnc3)CC2)CC1 1837533737 OVYYBUZJMFJLQY-UHFFFAOYSA-N 455.519 0.194 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)NCc1ccco1 1837637201 WHQGTNXEUQDBGO-HECAZONMSA-N 488.310 0.599 50 20 JCGD COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nn1 1837919330 YVEODLRGNZSJEU-UHFFFAOYSA-N 468.319 0.091 50 20 JCGD Cc1ncc(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1837921047 VGDLDHOXUUBBFB-UHFFFAOYSA-N 471.388 0.986 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1 1838102858 FHYXWDIWXCKJDF-AKBIMGJMSA-N 486.573 0.645 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=C4c5ccccc5C(=O)N4CC3)CCO2)C1 1838458841 FSJGKVBWWJJDGT-NTKDMRAZSA-N 489.956 0.967 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2 1838998312 SDIOUGJCUBADKV-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1839147396 PEBIWNNERDQFBN-QRWLVFNGSA-N 470.979 0.365 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1839151704 AZUKBQUNQFQFIU-MOPGFXCFSA-N 462.330 0.702 50 20 JCGD Cc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839314119 ROCDTVHUHHYHRA-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839743892 CRCNFUHSRPWMFL-GLRBVFSKSA-N 488.491 0.949 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840006964 ZTEQGRGSSTZMOY-VVBPWWLESA-N 487.981 0.300 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1 1840031680 ZIOLCUHEUOTZGJ-LIRRHRJNSA-N 456.337 0.873 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1 1840152473 JKNPWDKOHPLHSN-UTKZUKDTSA-N 450.923 0.897 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCCC3(F)F)C2)C1 1840182449 JLQLJHQATDZAQP-JXFKEZNVSA-N 460.522 0.641 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)COC3CCCCC3)C2)C1 1840182822 JPPFXDBSTFPUHM-QFIPXVFZSA-N 454.568 0.165 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CCCC4=O)C2)C1 1840184203 CPXAOPIZDRBVMU-VWLOTQADSA-N 486.569 0.649 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(Cl)c1 1840694757 ZAIYUQGNCXVQEP-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2c(I)cnn2C)C1 1843603947 TTYSQMZNSPNGJK-UHFFFAOYSA-N 488.330 0.215 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@]23C(=O)Nc2ccccc23)C1 1846182898 FLNLQRPSNPBSGD-XDHUDOTRSA-N 460.494 0.412 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@]13COC[C@@H]1CN(C(=O)OC(C)(C)C)C3)C2 1846384014 UBKUILPLHQFQFL-XDHUDOTRSA-N 493.605 0.446 50 20 JCGD CN(C)CC(C)(C)CNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 727065539 LBWCICBXFGGMIC-UHFFFAOYSA-N 457.622 0.404 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1cc(F)ccc1Br 728549456 MNCGUVUILZFNJZ-GXSJLCMTSA-N 462.297 0.385 50 20 JCGD Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)ccc1F 729276101 WZUYOSAKRBESRY-GFCCVEGCSA-N 472.520 0.634 50 20 JCGD Cc1ccc(CCC(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 749163791 WNIZBZNJKPVRID-UHFFFAOYSA-N 488.566 0.526 50 20 JCGD O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)CN1CCCC1=O 789857437 GGNSQKJQHWFGCH-UHFFFAOYSA-N 450.439 0.534 50 20 JCGD CC(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 912852035 AHLAWDWULPEZTC-QGZVFWFLSA-N 456.528 0.969 50 20 JCGD CNC(=O)c1cc(S(=O)(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cn1C 914688837 CTQHDORGMIKQLZ-UHFFFAOYSA-N 494.533 0.766 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H](C)n1cccn1)c(=O)n2Cc1ccccc1 918254857 FNUVKDRBDQXBKE-KRWDZBQOSA-N 492.540 0.669 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)Cc2ccccc2OC)c1 919820519 KMKRDMBAUIBLBS-UHFFFAOYSA-N 450.517 0.278 50 20 JCGD O=C(CSCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919884351 ILVZCFGDGOIONU-SECBINFHSA-N 471.586 0.636 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919885399 OYNRMEQFZHBCPB-CQSZACIVSA-N 487.604 0.058 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)Cn2nc(C)cc2C)c1 920622970 WJKSNRXTGYXOKK-UHFFFAOYSA-N 464.548 0.108 50 20 JCGD COCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 920862464 IOTOJXHIURVRRG-UHFFFAOYSA-N 464.500 0.874 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc(Br)cn3)C2)C1 1779421581 KJRIWIMYORLZEK-FQEVSTJZSA-N 474.120 0.281 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)NCc1ccco1 1781331200 GJQSGDWIEYVSOS-SCQSPADBSA-N 458.284 0.972 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1781355217 MBZFJZRYZVQOAB-UVBSCNOISA-N 482.347 0.783 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1782206910 YPWRTIOUXLSXPM-MDNXKNQGSA-N 453.305 0.807 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1 1782481182 PLXKNXIJJRXCHT-JOCHJYFZSA-N 452.251 0.139 50 20 JCGD O=C1NC(=O)[C@H](CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)N1 1783017730 CCLJODJLULSGNB-QYWGDWMGSA-N 493.358 0.421 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccc(F)cc3)C2)C1 1783598152 XRWZNRVZRFWDAB-QHCPKHFHSA-N 455.490 0.901 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1783679463 KGBHVYPSUPFDIO-NRFANRHFSA-N 464.987 0.778 50 20 JCGD C[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1)n1cccn1 1784524014 JOQUEIYWRZZOST-YADARESESA-N 483.573 0.620 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786407768 UMAVWLAFDBZBDS-LLLHUVSDSA-N 470.368 0.222 50 20 JCGD CC[C@H](NC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786970614 AEWQLNILJXQKAF-TUFLPTIASA-N 474.606 0.310 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(Cc4ccccc4)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786984205 QKAWHURJYNNIHG-OYDLWJJNSA-N 488.353 0.518 50 20 JCGD CCOc1ccccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984743 DVTBZYYSDVJBEP-XJABCFGWSA-N 452.316 0.672 50 20 JCGD CC1(C)Cc2cccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)c2O1 1787365850 KCWUHHKZVOHWMT-NYVOZVTQSA-N 478.354 0.987 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCNC4=O)[C@H]2C1 1788256520 QYFHAVKCDAHQKK-WSMBLCCSSA-N 482.379 0.641 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611662 OSPYEGWNWNIQAS-JQFCIGGWSA-N 461.519 0.010 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC3(F)F)C[C@@H]21)NC(=O)NCc1ccccc1 1789726753 SZIHCAWLUQLWFK-VJANTYMQSA-N 479.528 0.968 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)no1 1789926129 OJRVOKCKKZLQFN-UHXUCMFUSA-N 461.288 0.383 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789946329 JPMMJBDVVTVEMS-QQOZLPODSA-N 452.316 0.427 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)[C@H]2C1 1791066261 RRPHXNRTPHEFTM-IGCRFXBTSA-N 483.569 0.249 50 20 JCGD CN(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)c1ccc(Cl)cc1 1795741220 NQZVEFWZUBSCCY-UDKICSLYSA-N 485.777 0.526 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccn3c1C)C2 1796442232 ZGNQVKTULWVCGR-FKWFMORESA-N 477.525 0.980 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccn1)C2 1798522102 FEXINCMXMUKMIO-YVWYUNDQSA-N 457.443 0.620 50 20 JCGD Cn1c(=O)c2c(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)C(Cl)Cl)C4)csc2n(C)c1=O 1799062725 ILPSCDKAIFXTID-GNXNZQSNSA-N 489.381 0.235 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccc(F)cc1)C2 1801009278 YFQNOKTVBRBUGY-MFKICJERSA-N 450.511 0.557 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1801931734 PTRZBXQQCPXUEJ-FCHSSTLOSA-N 483.374 0.731 50 20 JCGD COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(N3CCCNC(=O)C3)n1)C2 1802273946 PKBIXPJLFIXVQX-YVSFHVDLSA-N 463.966 0.914 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803138405 ABXSWGPLMBRJEY-LTIDMASMSA-N 470.954 0.573 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc2nncn2c1 1809909971 IEBWUPNGBFWUQA-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1 1810302445 JDIRRSBGAFWGRL-YCRPNKLZSA-N 485.508 0.985 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1 1810488726 ZLOAJCYVBSEVJH-QGZVFWFLSA-N 456.334 0.894 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN2CCCCC2=O)[C@H]1c1cccnc1 1812974488 DFNIHPMAXDDBOI-HTAPYJJXSA-N 479.541 0.412 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)[C@@H]1c1cccnc1 1813034027 ZEIVCMOLEHXBBG-IJXRJRJASA-N 476.965 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CSCC(=O)O)[C@H]1c1cccnc1 1813085931 FJGUCFYTVOCXDE-IFXJQAMLSA-N 472.527 0.218 50 20 JCGD O=C(CCN1CCCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1814068766 NJSORRXABZYWEB-KRWDZBQOSA-N 456.377 0.925 50 20 JCGD O=C(COc1ccc(O)cc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336019 XJKYPWKOMSPFBX-HNNXBMFYSA-N 467.312 0.833 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815364500 VGFHJFUWHQSZPF-AWEZNQCLSA-N 459.333 0.638 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476430 RIVBTXUKDSDZHG-KDOFPFPSSA-N 451.296 0.323 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1 1818112889 SMBRGGNJMXJTCM-NXUGVVLJSA-N 465.474 0.933 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCNC4=O)sc2C1 1818916072 HKMZRFSHHLCHHY-MNOVXSKESA-N 466.951 0.953 50 20 JCGD Cc1ccn(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n1 1819401906 WZMHQCCXHZGUSH-KRWDZBQOSA-N 451.491 0.919 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1 1819550961 XTYSFQSBAOVRSM-IBGZPJMESA-N 492.345 0.696 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1)[C@H](F)Br 1820932951 WADSRXJXOMXOSQ-CABZTGNLSA-N 468.247 0.532 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1 1823007318 LVSUWFGJAHZTRY-UBHAPETDSA-N 451.318 0.897 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2 1828132862 PCBYTIVXNWMRJX-UKRRQHHQSA-N 452.581 0.733 50 20 JCGD O=C(O)C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829330215 CFBVJQCKFFLVPE-VGOFRKELSA-N 477.901 0.126 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830738628 RAMYQLYUWXDQDI-DRSNIGMVSA-N 489.997 0.736 50 20 JCGD O=C(C[C@H]1OCCc2ccccc21)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831245874 PQXIOLJJRGIARZ-ZEQKJWHPSA-N 494.353 0.141 50 20 JCGD CCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549619 VMRRNBJWXMUXDU-YWZLYKJASA-N 463.959 0.611 50 20 JCGD CC(C)c1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)no1 1832790606 AOTZLCNZSFCRKN-WMLDXEAASA-N 463.304 0.882 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C(=O)c3ccco3)CC2)CC1)c1cccc(B(O)O)c1 1834799829 FRHAQZMNRXMAIO-UHFFFAOYSA-N 453.304 0.028 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CC3)CC2)nn1 1835117610 DQIQDILQWYQWQZ-JVWAILMASA-N 496.572 0.804 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnn4cccnc34)CC2)CC1 1835534500 FSSJXMDSRFCFTP-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD O=C1COc2ccc(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)cc2N1 1835574800 JQSWAFMQCAIXRV-GOSISDBHSA-N 464.950 0.802 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)n1cccc1C=O 1835736758 GRJIVDCWWFMJCT-QGZVFWFLSA-N 495.584 0.746 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)Cc3cccnc3)CC2)CC1 1835736948 MOMZULVLEVUSKX-UHFFFAOYSA-N 465.558 0.508 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnc4ncccn34)CC2)CC1 1835737855 IDYXQQOJDQEJIX-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1 1835835790 HXONAAJUKMNWAO-QOKNQOGYSA-N 455.353 0.711 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2 1836617224 IQPFHDWUBALYKQ-OAQYLSRUSA-N 463.510 0.428 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)C(F)(F)C(F)F)CC2)CC1 1837021900 VUZJSXMLFFIFGU-UHFFFAOYSA-N 460.233 0.879 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837460774 KFCFBKCUBPHAIB-VWLOTQADSA-N 481.553 0.696 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)C(C)C)C2)C1 1838527274 KTQYHVNBODZNIM-UGKGYDQZSA-N 479.486 0.607 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(C#N)c1Cl)CCO2 1838599549 LDCITKRZHJJCGY-JOCHJYFZSA-N 477.949 0.655 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1839151459 RVBKEHRYLVSUBV-RTBURBONSA-N 459.330 0.487 50 20 JCGD O=C(C1CCN(c2ccc(F)cn2)CC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839723526 BWIQOWAIHCDESW-AVRDEDQJSA-N 484.956 0.493 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1 1840033436 FGJPMNLBWORWCK-IYOUNJFTSA-N 456.341 0.517 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)C2)C1 1840155291 WSFOUHZOMHYEEK-HRAATJIYSA-N 485.921 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4occc4c3)C2)C1 1840184472 PFAMRSVXBAQYQX-QHCPKHFHSA-N 458.515 0.876 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(N4CCCC4)ccn3)C2)C1 1840184473 PFHAROQHSIPUTK-DEOSSOPVSA-N 488.589 0.125 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185083 IDJQKYGALIZRDY-MBSDFSHPSA-N 461.563 0.090 50 20 JCGD C[S@@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1841230553 ABLIEVJPUQGIGC-JSRFDTRYSA-N 466.000 0.451 50 20 JCGD O=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)CN1Cc1cccs1 1843013261 ZVTPSNSPIIMZCA-QGZVFWFLSA-N 467.356 0.294 50 20 JCGD O=C(c1nn(-c2ccccc2)c2c1COC2)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013758 JKLNEUSQCQLIGV-UHFFFAOYSA-N 472.310 0.713 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCN(C)C3)C2 1843416656 KCDYDFXMOJKGPA-PCLIKHOPSA-N 466.546 0.670 50 20 JCGD C[C@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)[S@@](=O)c1ccccc1 1844264978 GBTBUCJZWYVLGG-IBADJEFMSA-N 455.540 0.698 50 20 JCGD CC[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1846072443 ZSBRNMJVVZKTPI-MELADBBJSA-N 487.420 0.543 50 20 JCGD CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC[C@H]2C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847562992 LRBLPPHWMSPUFH-LUKYLMHMSA-N 499.008 0.551 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)Cc1cccnc1 728891955 MNDYVFYJMFEWEK-INIZCTEOSA-N 488.975 0.207 50 20 JCGD CSCC[C@@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 729277290 YKWXFYSYCXKJRA-NOZJJQNGSA-N 485.415 0.930 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2O)cc1 730780267 SFOVMVJDNMENBN-KQPPXVQYSA-N 452.467 0.722 50 20 JCGD O=C(NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)C(=O)N1CCCC1 748159224 UHRALZVEYGZRBV-UHFFFAOYSA-N 475.980 0.301 50 20 JCGD O=C(NNC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1)C(=O)N1CCCC1 748247885 XRJONODOZPWYLK-UHFFFAOYSA-N 462.553 0.879 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CCc1ccco1 748267690 YSNJXAZZLBPQID-MRXNPFEDSA-N 457.530 0.141 50 20 JCGD COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)CNC(=O)c3ccco3)CC2=O)cc1OC 751207073 QTTHPSZEICLDGI-HNNXBMFYSA-N 458.471 0.265 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCn2cnc3ccccc3c2=O)cc1OC 792689846 FIKNMFYPFZEEIX-UHFFFAOYSA-N 454.439 0.808 50 20 JCGD NS(=O)(=O)c1ccsc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 800640755 QAMLDMICBMTDFT-UHFFFAOYSA-N 494.576 0.949 50 20 JCGD O=C(COC(=O)c1sccc1S(=O)(=O)N1CCCC1)NNC(=O)[C@H]1COc2ccccc2O1 824968698 HCPJEBXXHMOXIO-OAHLLOKOSA-N 495.535 0.677 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(-n2ccnc2)cc1 913466344 ZIXNCNYWIWRYAB-UHFFFAOYSA-N 455.496 0.968 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cn1c(O)nc2ccccc2c1=O 915402483 NDCFIEXATAWSBH-UHFFFAOYSA-N 460.830 0.769 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCCC(=O)NC(C)C)N(S(C)(=O)=O)CC2 916270947 WVVRXGLTBKUXEE-INIZCTEOSA-N 499.590 0.198 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1cccnc1N1CCOCC1 916400035 MHUMCGMXEJAHHE-UHFFFAOYSA-N 467.574 0.961 50 20 JCGD Cc1ccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c(O)c1 917753881 RPAHWPHPCIEHMM-UHFFFAOYSA-N 455.514 0.345 50 20 JCGD CC(C)(C)N1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 918094212 BTPRTDGWIMJFGK-UHFFFAOYSA-N 467.592 0.914 50 20 JCGD C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 920050722 GVLWFNLRPVZYKB-GFCCVEGCSA-N 469.451 0.810 50 20 JCGD O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1cc(Br)c[nH]1 920338517 CSPFIBWTQHUMPJ-UHFFFAOYSA-N 460.266 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nonc3c2)C1 1778525987 ZAEHYXOWWKPXKI-AUSIDOKSSA-N 479.497 0.663 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3c[nH]c4ccccc34)CCO2)C1 1779032154 CSSHQTNAMVNYPV-DEOSSOPVSA-N 462.510 0.853 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(F)c1 1779036902 IFYUHPAXLPOVOJ-QFIPXVFZSA-N 457.462 0.590 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/N1CCCCC1)C2 1779372632 QIOOPPXSDJQDHV-CAMGNALRSA-N 471.562 0.284 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780891958 HMVLSVLTVASSFD-RUZDIDTESA-N 490.325 0.493 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cncnc1)CCO2)NC(=O)NCc1ccccc1 1780968742 DTYVFNQKDVPPNQ-QHCPKHFHSA-N 467.530 0.266 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)co1 1780970282 UBBDAWPICMWNBM-HSZRJFAPSA-N 470.530 0.773 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)[C@@H]1SC(=N)NC1=O 1781331750 VNCXBZZXHKCTRK-AMDHYVTDSA-N 451.318 0.309 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334021 UIXABVDXHLCKLY-LYOVBCGYSA-N 454.293 0.350 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1 1783535207 ASTVUOOSQYCKNJ-TYILLQQXSA-N 453.337 0.813 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc2c1OCCO2 1783935491 URZDTBQIJCBULE-QHCPKHFHSA-N 460.531 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]3C[C@H]3N1C(=O)OC(C)(C)C)CCO2 1783939751 KXQRLWDRQGTPLP-SXTKOZQMSA-N 493.605 0.587 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c([N+](=O)[O-])cc1O 1784091390 RSPMFOSOSIXHCX-VTBSOJSOSA-N 457.867 0.502 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C2)C1 1785551751 AIRGWZRPNALTRY-AWUSRGSFSA-N 480.481 0.750 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnnc3)[C@H]2C1)NC(=O)NCc1ccccc1 1785957693 PKCDAVDCYFMBGK-ACRUOGEOSA-N 481.557 0.416 50 20 JCGD Cc1ccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1786591289 LRELNSFVJZMLJT-NDXORKPFSA-N 467.526 0.666 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnn(C)c3)C[C@@H]21 1787508078 CHNFCCJDVJZLSI-ZPSROVLTSA-N 455.519 0.076 50 20 JCGD CC(=O)Nc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1788188765 ZJVBJJKTFLBWQL-VJBMBRPKSA-N 479.342 0.161 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21 1788639879 HVVUXNQAJYXHAB-XSLAGTTESA-N 458.584 0.312 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21 1788755506 QLOYVXXBDHHZJW-VQUGOPFGSA-N 488.497 0.804 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn[nH]c3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726563 AETBHJPBFRFBNS-IHPCNDPISA-N 469.546 0.349 50 20 JCGD Cc1cc(F)c(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1790276844 RLZIRVHMBQNJMF-QSFXBCCZSA-N 458.270 0.860 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(S(C)(=O)=O)c3)C[C@@H]21 1791057875 YWBQNGPBDSEYKX-APYUEPQZSA-N 474.377 0.862 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1791254167 OXNULHLUEFXTDE-VIQHNZTISA-N 477.986 0.496 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOc3ccc(F)cc3)C[C@@H]21 1791287263 WLXNOERGMAQUPB-VDGAXYAQSA-N 464.538 0.947 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)CN3C(=O)C=CC3=O)cc2)CCC1 1791696142 WGMHKRLTXDRUNX-UHFFFAOYSA-N 462.466 0.358 50 20 JCGD CC(=O)Nc1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1792003396 NFMVZMNXRSQOCM-QRFRQXIXSA-N 459.547 0.611 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c[nH]c1C 1792975494 SOIZZDYRZHLSJB-RCJHGTSTSA-N 455.939 0.622 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@H](O)CCl)C2 1792984119 YMIAIMZPKGQMMY-ZEHZNMFBSA-N 471.982 0.964 50 20 JCGD O=C1CN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)Cc2ccccc2)C3)C(=O)N1 1793834345 LPDASTOFCVPZJZ-YYAJDYIMSA-N 493.358 0.134 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(Cl)c1 1793866849 GTAGWCKCFYPJEC-USGNIVHTSA-N 487.944 0.793 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc(O)nc(O)c2C1 1794111270 KHQNMRXMBOGASZ-VOZNZKSSSA-N 483.363 0.756 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc(O)nc(O)c2C1 1794112960 KWQAYMJPYCLGEJ-FLTUCWPJSA-N 464.595 0.434 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cc([N+](=O)[O-])cn1 1794276724 GZEUOXXPOMELMI-NGYDUSEUSA-N 456.463 0.564 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(F)cc1F)C2)c1cccc(B(O)O)c1 1795737809 VIMKXKWJPXZQAZ-MBQWOLKWSA-N 456.254 0.561 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(C)C)[nH]n1)C2 1796441397 HCNBNLIQJCDCRQ-IHHIPJHASA-N 455.519 0.870 50 20 JCGD CC(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C 1796908397 RBEYVIBYXZQOQW-YRPNKDGESA-N 487.362 0.029 50 20 JCGD Cc1cccc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)[nH]c12 1797751695 PMFRIOVUTDRMBL-VPTLXERWSA-N 462.510 0.992 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1802063776 QDLKNQMFGOFQJV-OPMZPASUSA-N 462.315 0.079 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn1 1803139434 PIJXIIQKMDBWTQ-AYOQOUSVSA-N 480.974 0.941 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2C(=O)C=CC2=O)cc1)c1cccc(B(O)O)c1 1803875568 CXCUAZKMKSNMFN-NUZGMZIFSA-N 473.294 0.361 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c(O)n1 1807359646 BSDHWFDSUGHIAS-WIYYLYMNSA-N 460.299 0.804 50 20 JCGD CCn1nc(C)cc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365230 XCCXOYYZCJLRKD-UGKGYDQZSA-N 461.331 0.920 50 20 JCGD 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1810832724 YYTJTGZVOPQONU-QRWLVFNGSA-N 464.482 0.799 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812779272 RDBRMSPYJQKUPA-LNLFQRSKSA-N 471.396 0.548 50 20 JCGD Cc1cc(C)n(CCC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1813304836 FWYIDCFTYACLHE-QPPBQGQZSA-N 475.358 0.985 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)Cn2cc(C)c(O)nc2=O)[C@H]1c1cccnc1 1814037044 HJQVYOYUOJYCRP-SOLBZPMBSA-N 463.922 0.612 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)CC2)c1cccc(B(O)O)c1 1815350150 GRAFZABFQKUPQN-NVXWUHKLSA-N 496.398 0.840 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)C(=O)NCC(C)C)sc2C1 1817323098 GZCQTXURRJFETQ-PKCARXMOSA-N 473.559 0.961 50 20 JCGD O=C(CSc1nc[nH]n1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822711378 XUZDXQUWZCMQND-OAHLLOKOSA-N 455.309 0.306 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2 1826644682 YNQUOUMBYYFDBB-ZLKJLUDKSA-N 454.940 0.125 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC[C@H]1C1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC1 1827050814 ZPEPNKZLEQJGNQ-INIZCTEOSA-N 488.243 0.955 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1 1827681535 YOEBUKKEWDDSBD-FSTGKYBXSA-N 465.576 0.785 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1828357742 NJXKMLYITRPRCD-MSOLQXFVSA-N 464.028 0.877 50 20 JCGD COCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828549037 UKDKQSGLDGYQME-UWJYYQICSA-N 453.923 0.685 50 20 JCGD O=C([C@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1 1828970503 IMNSAYOOTWHTOJ-VYDXJSESSA-N 450.349 0.947 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CN)C2)C1 1829341122 XHYMJWFQCDNWCK-UWJYYQICSA-N 452.939 0.651 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1 1830546265 RCFAITMOKHQFRK-VBKZILBWSA-N 468.348 0.887 50 20 JCGD O=C(c1ccc(Br)nc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725740 RMSSGGWIUIRPOS-SJCJKPOMSA-N 480.718 0.653 50 20 JCGD O=C(c1c[nH]c2nccc-2c1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830727907 KMBNDYQOAPRGIC-IFXJQAMLSA-N 457.314 0.838 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C1(O)CCC1 1833067290 GDYRFOFFCJZJQI-KRWDZBQOSA-N 457.380 0.103 50 20 JCGD C=CCNC(=O)/C=C\C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1833074832 GCPXJIOHUJIPLO-AGKHUZRLSA-N 497.600 0.550 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)[C@H](O)CCl 1833313847 WCMINEHFNZXHHP-CQSZACIVSA-N 463.025 0.018 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1 1833615195 PICSCJMHWSIFAC-IIBYNOLFSA-N 497.390 0.772 50 20 JCGD Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)no1 1834799217 QNGHFEHGDMURHY-UHFFFAOYSA-N 454.336 0.091 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1834823379 QTIDSSJBXIIQKF-IBGZPJMESA-N 471.352 0.780 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H]3Cc4ccccc4CN3)CC2)CC1 1835059824 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N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839741976 JBYFYIHRHCROMM-OXGZWMJISA-N 469.872 0.928 50 20 JCGD O=C(c1nc[nH]n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839801954 ISGAUPQQOULTJE-JXFKEZNVSA-N 478.347 0.881 50 20 JCGD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839911835 BKXXECKSZOGCLN-FYNLTWRRSA-N 456.348 0.263 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1840031309 MDKNKMHZPONLBB-KPZWWZAWSA-N 455.309 0.034 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1840152858 WXNCMUROVQSRQO-QVKFZJNVSA-N 466.922 0.379 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)n1 1840338224 OIRBVKYXCCYKED-VWLOTQADSA-N 496.568 0.400 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1 1840645835 PZEKNKKLAZSKJR-VBKZILBWSA-N 468.348 0.887 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014007 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O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ncc(Cl)cc1Cl)CCO2 1829606793 MMBLUDLEWNHIGZ-NRFANRHFSA-N 494.140 0.452 50 20 JCGD O=C(c1cc(Br)ncc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728091 OXMBBMDWGRFSNV-DYVFJYSZSA-N 480.718 0.653 50 20 JCGD C=CC[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830738770 VKVIYEACSZWXSK-DRSNIGMVSA-N 489.997 0.902 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1831999100 PRZXMBMLMQJWHP-GCKMJXCFSA-N 475.970 0.512 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nc(C)cc3C)CCO2)C1 1833038550 VDYBAECLUWLKLG-UPQSEYGOSA-N 485.545 0.090 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1 1833309648 IKXRLNBNSHSWOX-RTBURBONSA-N 485.390 0.141 50 20 JCGD Cc1cc2nnc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)c(C)n2n1 1833310642 XMJWPMSAFRFPCZ-QGZVFWFLSA-N 463.970 0.526 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1)[C@H](O)CCl 1833313677 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CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1 1840185005 DLWMGPJITQFOQG-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD COC(=O)N(CC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)Cc1ccccc1 1843015036 ASFFZWHQYQHYFB-UHFFFAOYSA-N 465.315 0.452 50 20 JCGD COc1ccc(F)c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1OC 1844264966 DJDHCEQKLHFHJP-UHFFFAOYSA-N 457.462 0.972 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@]13C[C@H]1CCN3C(=O)OC(C)(C)C)C2 1846385836 BPNYTDJQKFDTMM-WAIKUNEKSA-N 463.579 0.962 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2c(=O)[nH]c(=O)c3ccccc32)c1 11331109 WYDJSRBSJKSMNO-UHFFFAOYSA-N 473.511 0.182 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)[C@H](NS(=O)(=O)c2ccc3c(c2)OCCCO3)C(C)C)n1 20917898 DHMQKQKSOSJNAV-HXUWFJFHSA-N 479.559 0.812 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)n1 23689801 QCIRYCBAHDANQT-UHFFFAOYSA-N 454.940 0.797 50 20 JCGD O=C(CN1CCN(Cc2ccc3c(c2)OCCO3)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 26843000 QLRRJNPQFWXSQQ-UHFFFAOYSA-N 455.471 0.945 50 20 JCGD O=C(CSCC(=O)Nc1cccc(Br)c1)NNC(=O)[C@H]1CCS(=O)(=O)C1 728204241 ZNOQMPZVIHAFGG-JTQLQIEISA-N 464.363 0.703 50 20 JCGD C[C@@H](C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)N1C(=O)c2ccc(Br)cc2C1=O 728386639 ZRXPYNQYMJWOCE-IUCAKERBSA-N 458.290 0.016 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(N)nc(Cl)c1)c(=O)n2Cc1ccccc1 749387257 VYAIHEQDTXIRJZ-UHFFFAOYSA-N 496.915 0.520 50 20 JCGD O=C(CCC(=O)N1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 913430546 UVMWTMWFMKSXBO-UHFFFAOYSA-N 474.539 0.565 50 20 JCGD O=C(NC[C@@H]1COc2ccccc2C1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916199484 OXIAMSCGNGNUFL-MRXNPFEDSA-N 474.539 0.903 50 20 JCGD CC(=NNC(=O)[C@H](C)CN1C[C@@H](C)O[C@H](C)C1)c1ccc(S(=O)(=O)NCC(=O)O)cc1 916366334 TYMOZPZRSCGETG-RBSFLKMASA-N 454.549 0.635 50 20 JCGD CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 916646794 OLROXXOYSVFFCA-UHFFFAOYSA-N 488.614 0.980 50 20 JCGD Cc1ccc(F)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 917718342 UEEYVAMNYKKJFK-UHFFFAOYSA-N 457.505 0.778 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)c2ccc(C)cc2O)c1OC 918337458 NKGZLVNTEHUAAX-UHFFFAOYSA-N 479.511 0.814 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(=O)N2CCCc3ccccc32)c1 920045581 PMGHFFJEUOAANE-UHFFFAOYSA-N 459.528 0.860 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1778716177 QRECXXPRAMSLBH-NRFANRHFSA-N 454.317 0.141 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1 1778773745 BOCITQRYHINSHD-RVWJGDDESA-N 464.486 0.535 50 20 JCGD CC(=O)N1CCN(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)C(C)(C)CCl)C3)CC1 1778909218 YUYBQDSRFZZPAF-XMSQKQJNSA-N 457.015 0.929 50 20 JCGD COc1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779029212 NVZUEQXZLXUSTQ-HSZRJFAPSA-N 469.498 0.216 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1C 1779032141 BYEJPJCOSVTJAD-HSZRJFAPSA-N 453.499 0.759 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779299814 FDPBMIWJXJOVNI-BTYIYWSLSA-N 486.642 0.437 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780062551 HCJLYTGFMZEJTN-BFUOFWGJSA-N 464.320 0.707 50 20 JCGD Cc1cc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)no1 1780969583 OMSXXGQWMUZULW-XMMPIXPASA-N 484.557 0.702 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC(=O)OC(C)(C)C)C2 1782209006 GNFXHPXEHRLIEH-OPAMFIHVSA-N 454.568 0.605 50 20 JCGD COc1nccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1F 1782211836 AWJURGLKTCPLED-OPAMFIHVSA-N 465.526 0.730 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1 1784097152 QCDULYUDITYHMM-OWLYRPNTSA-N 454.907 0.431 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC(=O)N3)[C@H]2C1 1786571686 PTGLOZWRWBQEHO-UHEFJODHSA-N 474.470 0.392 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(Cl)cccc4n3)C[C@@H]21)c1cccc(B(O)O)c1 1786983324 NXXNRGOWABFOIG-IEZWGBDMSA-N 482.733 0.575 50 20 JCGD 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CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3c(O)nnc13)C2 1800639938 QSFOTVQTPPMLOK-ZMJPVWNMSA-N 452.309 0.812 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1 1800854992 XVGYBXSWAHKISF-ACDBMABISA-N 459.315 0.821 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1CCN(C(=O)OC(C)(C)C)C1)C2 1801012106 DFOOOWPLRVMFLO-QSNWEANLSA-N 495.621 0.596 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1 1801941275 DRAMUCUEVRDFFG-CEQLMSFQSA-N 499.373 0.137 50 20 JCGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1 1804352435 GOUDXWAEZPLIPN-VTPLQMEGSA-N 456.272 0.376 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@H]1CC(c2ccccc2)=NN1 1812306233 NOTCMRAJUVLEFL-GPUOULLFSA-N 497.364 0.847 50 20 JCGD Cn1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cc1O 1816123728 UKBJYJXWWAELGF-OAHLLOKOSA-N 453.463 0.467 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403289 CJMBSZUMCWMZFK-QGZVFWFLSA-N 464.486 0.727 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnncc3C(=O)O)sc2C1 1820502509 OLGFKGYTCTXHKA-SNVBAGLBSA-N 461.504 0.230 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C#CC(=O)O)n[nH]1)NC(=O)NCc1ccccc1 1822202135 FYZTZQQUPURTQC-GOSISDBHSA-N 481.513 0.836 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)CCC(=O)NN(C)C)n[nH]3)CC2)CC1 1822415498 JWCCJLXNQQBYID-GOSISDBHSA-N 474.610 0.555 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1825506578 PIPAANSICUXTNW-NSHDSACASA-N 489.558 0.892 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)CCC(N)=O)CC1 1826820317 UUYRUFYYTDBPBA-GCOGVYCUSA-N 473.578 0.333 50 20 JCGD O=C(c1nc[nH]c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059145 GKNXHYDSPLPILE-KRWDZBQOSA-N 455.280 0.545 50 20 JCGD O=C(c1nc[nH]n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551071 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CC(=O)Nc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834801551 WHDDLTLQNZHSFE-UHFFFAOYSA-N 492.385 0.824 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc2cn[nH]c2cn1 1835639853 JHLGSLIATWQKJO-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C[C@@H]3CCCCO3)CC2)CC1 1835737193 VKQUOLSFESMPIY-IBGZPJMESA-N 472.590 0.830 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C)c1 1835931386 PTSUJKQSJBITJH-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CCOc1ccsc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934473 UWDJPUOYANJUFE-QFIPXVFZSA-N 474.344 0.210 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCN(C(C)=O)CC3)CCO2)C1 1836764110 HIYZICSLUQYHQF-RXVVDRJESA-N 458.987 0.014 50 20 JCGD O=C1NCc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)CCBr)C4)C3)ccc21 1837150189 UJEIMJRRXGFEGA-FQEVSTJZSA-N 466.332 0.785 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ncc(Cl)cn3)CC2)CC1 1837357011 ZNSROZRVMQYKGW-UHFFFAOYSA-N 472.738 0.736 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837438446 YRAIIRASFOZPJM-JKSBSHDWSA-N 489.997 0.832 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1837835946 WEIDBUXLXFOZAL-KRWDZBQOSA-N 474.322 0.946 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)[C@@H]1SC(=N)NC1=O 1838100614 WELNIQSTGQVTSO-LIRRHRJNSA-N 496.634 0.160 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccnc4c3OCO4)CC2)CC1 1838394564 KPLMORFLKNDWJT-UHFFFAOYSA-N 496.524 0.735 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839153861 TYVJEFCJIPUZJD-ZYSHUDEJSA-N 483.345 0.174 50 20 JCGD O=C(c1nc(O)n2c1CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200634 NAPGBBOEVMGGNJ-KBXCAEBGSA-N 475.315 0.686 50 20 JCGD O=C(c1nc2ccc(F)cn2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202580 KENGHGMYQYPZKY-SUMWQHHRSA-N 474.262 0.629 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1 1839964764 BSWULDOSCSARBC-KXBFYZLASA-N 466.336 0.973 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1840034508 NXPLMVLAZURCLP-IFXJQAMLSA-N 466.336 0.512 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)c([N+](=O)[O-])cn3)C2)C1 1840152262 CUDCTDUVDQQERI-LIRRHRJNSA-N 456.883 0.622 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)CCCO3)CCO2 1840660947 IVCWHUIQCPGAJJ-XMMPIXPASA-N 474.558 0.455 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840724186 KIPQCEYOBIDBPL-XMMPIXPASA-N 496.524 0.027 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)CCO2 1840747930 QJQLSDZQGNVGIY-XMMPIXPASA-N 484.557 0.520 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1840784579 WMEIOPDSZPGKQV-XLIONFOSSA-N 474.341 0.968 50 20 JCGD CN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841353834 SSZZEWSZRUEGEK-CABCVRRESA-N 474.986 0.551 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1842184975 XPOBBFGKPNHTFW-UHFFFAOYSA-N 451.288 0.457 50 20 JCGD C[C@@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)[S@](=O)c1ccccc1 1845777454 PKXKOXHZHFCOFH-ZZQXMTQJSA-N 455.540 0.698 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846129125 DYHYWYIPKPWDMO-CJAUYULYSA-N 483.374 0.831 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)cc2)CC1 1846383710 SRBPKMYFKXTIJY-UHFFFAOYSA-N 456.591 0.628 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)c1 728527400 HWZDURQPWSAHLS-UHFFFAOYSA-N 462.260 0.478 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c1 729274989 IUNVYSYLIZYIBE-SNVBAGLBSA-N 454.958 0.069 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC3(N4CCCC4)CCOCC3)nc2)CC1 729624242 UUIFVHFPQVNTFQ-UHFFFAOYSA-N 481.623 0.289 50 20 JCGD O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)c1csc(N2CCOCC2)n1 730514049 BSKQWWUHYHRZBT-CQSZACIVSA-N 473.511 0.565 50 20 JCGD O=C(COC(=O)CCN1C(=O)COc2ccccc21)NNC(=O)[C@@H]1COc2ccccc2O1 746250771 HSYJDLRUXXCJHO-SFHVURJKSA-N 455.423 0.333 50 20 JCGD COCCCCC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 746863771 ARERWNJJDLMNNP-MRXNPFEDSA-N 457.549 0.917 50 20 JCGD Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc21 747697703 KWUSLUNTDUJTPO-UHFFFAOYSA-N 493.567 0.285 50 20 JCGD CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 749343647 OUOBWHLUJHYWGG-UHFFFAOYSA-N 455.537 0.940 50 20 JCGD COC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1 912521174 KTLUDUWJRNJFCR-UHFFFAOYSA-N 451.490 0.240 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(C(=O)N2CCOCC2)cc1 913628127 XJAGDFDDOGHZKS-UHFFFAOYSA-N 488.570 0.905 50 20 JCGD CNC(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 916392238 RPBJZQDKLOTFDP-UHFFFAOYSA-N 459.528 0.975 50 20 JCGD O=C(NC[C@@H]1CCN(CC(F)(F)F)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916577934 MSPXXALRQJITBZ-AWEZNQCLSA-N 493.508 0.536 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)nc1 916646842 RBTLQYPXFJUVAK-UHFFFAOYSA-N 470.577 0.845 50 20 JCGD CC(C)(C)OC(=O)N1CCn2cnc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2C1 1778368334 UTWHEECCUJZNNU-OPAMFIHVSA-N 497.980 0.677 50 20 JCGD COc1cc(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(F)c1 1779036628 BTUYVKCKERWSDO-JOCHJYFZSA-N 475.452 0.729 50 20 JCGD O=C([C@H](Br)Cc1ccccc1)N1CCO[C@]2(CCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1779095602 JHENHEJSDIXNRY-UZKOGDIHSA-N 496.402 0.473 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1779211678 PZAIDUMIUSMTNT-UAWNWXRQSA-N 496.524 0.416 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1779544114 WRYXGXKKIKDNKB-OXQOHEQNSA-N 484.651 0.817 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1 1779629368 UASGRZZFYYIHQL-HSZRJFAPSA-N 476.497 0.228 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1F 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VTLCWCPSPGUPCM-JRGCBEDISA-N 479.371 0.108 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1808290784 AURXXPHFHCRBTQ-CRFBAAHOSA-N 456.330 0.876 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1 1808323594 NMPOFVIYTZDJDG-GPXOXTDOSA-N 484.365 0.796 50 20 JCGD COC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810299272 PNBXOEAGNPDURW-MGPUTAFESA-N 454.487 0.353 50 20 JCGD CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1812776139 HFNSNUBWELQAGA-YCPHGPKFSA-N 477.296 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1 1813070972 OWCKKYZBAXVBMC-HTAPYJJXSA-N 464.530 0.817 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813415491 FFRKWTXMGGLSCA-GBXCKJPGSA-N 475.358 0.674 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1814478722 SWFJVOBTYJCUTC-NVXWUHKLSA-N 456.507 0.629 50 20 JCGD Cc1nc(N)sc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339828 QSVZARCUWHUFSD-LBPRGKRZSA-N 457.346 0.710 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc3cccnn3n1)CC2)c1ccc(B(O)O)cc1 1815343577 ARZJHSZTAYBFFU-CQSZACIVSA-N 462.300 0.405 50 20 JCGD COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)ccn1 1815360752 MZCCQSHOBCOQBI-OAHLLOKOSA-N 452.301 0.766 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nc1 1817471117 SEDUOAXCCANZHC-IBGZPJMESA-N 497.342 0.508 50 20 JCGD Cc1nccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819797261 RXYXLBVGXUFGHH-NSHDSACASA-N 452.500 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(CO)on1)CC2 1819798020 PYAUXCDGAQQVFQ-VIFPVBQESA-N 457.472 0.162 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822117753 FCNNEKGRNMWROQ-KRWDZBQOSA-N 471.323 0.920 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3ccccc3-n3nccn3)sc2C1)c1ccc(B(O)O)cc1 1823547954 KRXBVSCRCJUPQK-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1 1825454383 POVQADIKTXVVMC-JOCHJYFZSA-N 499.398 0.712 50 20 JCGD O=C(C1CC(O)C1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828541046 NGMKWMHTGFIMNO-AKGDMFDRSA-N 479.961 0.809 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](N)CN)CCN2C(=O)OCc1ccccc1 1829050711 SLUDGSFBMRTONV-HZUJVAHNSA-N 496.406 0.508 50 20 JCGD O=C(C1CCN(c2ccccc2)CC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830610210 MFRZOSUNIHKKLL-NZQKXSOJSA-N 465.978 0.959 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CC1 1830668412 CTSCWQNKBZKAFD-YLJYHZDGSA-N 483.610 0.822 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830737429 HMWIQSYTESBQMH-AUSIDOKSSA-N 498.960 0.723 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830739179 ZALKVMGSTPLEKH-LAUBAEHRSA-N 453.923 0.058 50 20 JCGD COc1cc(N2CCC(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)CC2)ncn1 1830957509 LCPARZUCSVBBCX-GHTZIAJQSA-N 485.944 0.692 50 20 JCGD O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832250973 CBAQBNJSYJYEMR-GFCCVEGCSA-N 455.188 0.602 50 20 JCGD O=C(Cc1ccc(F)cc1Cl)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832274904 PKCRFRCUGVTIFK-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD COc1ccc([C@@H](O)C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1833181799 LXHZKRAICLXIOC-XMMPIXPASA-N 495.385 0.294 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)n3cnnn3)CC2)CC1 1833266062 MIGPDTZULKXVMC-ZIAGYGMSSA-N 456.389 0.837 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833399874 IPNKOZCVBJUFQD-VQIMIIECSA-N 459.952 0.573 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)OCCO4)CC2)CC1)c1ccc(B(O)O)cc1 1834798534 IJQDVVSRXLZRJI-UHFFFAOYSA-N 493.369 0.637 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccccc3O)CC2)CC1)c1cccc(B(O)O)c1 1834799857 IJLPTEKXXRANGO-UHFFFAOYSA-N 451.332 0.571 50 20 JCGD Cc1ccc2oc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2n1 1835928292 IOVZKXYLYJOPSQ-XMMPIXPASA-N 479.298 0.200 50 20 JCGD Cc1ccc2oc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc2n1 1836265085 WEVKSPHCLZAFSS-DEOSSOPVSA-N 479.298 0.200 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1 1836847731 ZRBOIUMFQGVNJS-YOEHRIQHSA-N 468.016 0.567 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3c(c1)NC(=O)CO3)CCO2 1836992773 PQMYDHGDHVEQNW-QFIPXVFZSA-N 477.590 0.939 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(F)(F)F)nn3C)CCO2)C1 1838080988 XDRUWMKRPIRUAF-YVEFUNNKSA-N 468.860 0.763 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)nn3)CCO2)C1 1838352812 STLFLQNBZGBWMA-FZKQIMNGSA-N 457.325 0.729 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C#N)c[nH]1)CCO2 1838736327 YEPAGLFRPQSSPW-WGLQLPMYSA-N 467.486 0.090 50 20 JCGD C[C@H](S)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054107 HDSDBQQABLKJRX-JTSKRJEESA-N 479.603 0.107 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COCCOCCOCCOC)C2)C1 1839149103 TWJQVMSKLJSCID-NQIIRXRSSA-N 480.986 0.156 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3c(Cl)cccc13)CCO2 1839495577 NNJANYSQBKBRMG-QHCPKHFHSA-N 498.732 0.280 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1 1840033120 UYWOUPFVKWGJSX-FQELHTAISA-N 466.376 0.941 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H](C)NC(=O)OC(C)(C)C)C2)C1 1840152807 UKZAGWCMEPLOHG-XFQAVAEZSA-N 477.986 1.000 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)CCO2 1840370202 MQFABNJILNRHBK-UEXGIBASSA-N 469.970 0.321 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840730643 FDGZDXJHRJNIGA-HSZRJFAPSA-N 475.546 0.088 50 20 JCGD NC(=O)[C@@H](N)CCC(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1842948026 QLRSMGIQAQMEQF-HOTGVXAUSA-N 451.365 0.789 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C2 1843415714 DRXBWIKNKMGBTF-PCLIKHOPSA-N 485.566 0.970 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844265618 WLIDQHLLHXQCFZ-UHFFFAOYSA-N 472.546 0.759 50 20 JCGD COc1nccnc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038457 DIECVBBKFSVLFD-UHFFFAOYSA-N 467.530 0.648 50 20 JCGD COc1cc(/C=C/C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc(OC)c1OC 1845949394 CFJIUSHXQOWLMI-BJMVGYQFSA-N 480.326 0.923 50 20 JCGD Cc1cc(C)nc(NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccc(Cl)cc2)n1 22235213 JOVCROOEJPBTRM-HNNXBMFYSA-N 475.980 0.972 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCN1CCN(S(C)(=O)=O)CC1 746512017 AQQCVNAPYYWOOA-ZDUSSCGKSA-N 492.396 0.124 50 20 JCGD CC(C)CC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 749197139 LWTUDPQQNNBNBQ-UHFFFAOYSA-N 495.602 0.689 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)CCNS(=O)(=O)c2cn(C)c(C)n2)cc1 750662217 BMFXPNDXFLRXDH-ZDUSSCGKSA-N 453.521 0.411 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cn1cc(Br)c(O)nc1=O 751052187 SOOODUSSBVQSBE-UHFFFAOYSA-N 479.335 0.071 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)c2)C[C@@H](C)O1 912920842 FBDFIDFIGVORFY-TVFCKZIOSA-N 482.603 0.745 50 20 JCGD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 913416678 NPCMDRPFDAMMEV-QGZVFWFLSA-N 469.903 0.866 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)c2ccccc2c1=O 914280566 UFOKTHCEYNGUJZ-UHFFFAOYSA-N 461.438 0.233 50 20 JCGD CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(S(N)(=O)=O)cc1 915915066 MKSYEAXPZNODKV-UHFFFAOYSA-N 494.595 0.828 50 20 JCGD O=C(CCNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)N[C@H]1CCS(=O)(=O)C1 916635987 LDOOVXJKILVEAU-AWEZNQCLSA-N 464.500 0.496 50 20 JCGD Cc1n[nH]cc1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 920444779 KXJHIQVKAKTGPN-UHFFFAOYSA-N 478.513 0.557 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1778055828 DRWSVOSKLYHKHO-JOCHJYFZSA-N 468.706 0.425 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1cncn1)C2 1778094108 ASCIUERRZXITFP-HJBDEHSISA-N 470.534 0.316 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1)NC(=O)NCc1ccccc1 1778672651 IELTZEXQAMPFOE-VWLOTQADSA-N 495.584 0.619 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3cccnc13)CCO2 1779030224 KTJAUCQLSSRDFL-DEOSSOPVSA-N 460.494 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc4ccsc4[nH]3)CCO2)C1 1779036741 DIRSVMKGDIHUHO-OAQYLSRUSA-N 454.512 0.985 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c(C)n1C 1779971818 XYBYJZOMXSEBQU-ZJSXRUAMSA-N 453.348 0.763 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnncc1C(=O)O)CCO2 1780097915 RPZDWOITNZINPE-QFIPXVFZSA-N 499.436 0.766 50 20 JCGD COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C#N)c1 1781172643 BPRYXOUTSKULAA-XMMPIXPASA-N 478.509 0.252 50 20 JCGD O=C([C@@H]1[C@@H](O)CCN1C(=O)OCc1ccccc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1783646587 KACDPHRTERGBQD-KEXUJGGDSA-N 495.960 0.188 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CCO2)C1 1783939998 QBNRMUCTEZUIDP-GLJAUCNMSA-N 459.503 0.811 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)CC1 1783966548 GEYNNNUQZDSEMV-DKIMLUQUSA-N 473.412 0.161 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCNC(=O)C3)C2)C1 1784037333 DOJLTBJYZBPDRK-NYHFZMIOSA-N 474.470 0.490 50 20 JCGD CN(C(=O)OC(C)(C)C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)n(C)n1 1784090657 KALDSTGSDUZISZ-DIECFANBSA-N 499.996 0.984 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1 1785265059 OBABFSPXXDEFGQ-XQQQEEOESA-N 471.489 0.896 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C)c3C(F)(F)F)[C@H]2C1 1785527197 CREODOIDVNSSLD-QEJZJMRPSA-N 474.484 0.405 50 20 JCGD 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20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1 1840186011 YNRLJEXTPQRZAI-HXUWFJFHSA-N 453.927 0.178 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840186677 MLZHDNNVPJKEJK-JLTOFOAXSA-N 496.388 0.882 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265450 DIXZFODWFIDZBI-INIZCTEOSA-N 492.602 0.758 50 20 JCGD CCOc1ccc(CC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1OC 1846265065 ANXILPMEQOFJAM-UHFFFAOYSA-N 452.316 0.833 50 20 JCGD CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 21778833 HFKRNZUGMXOZNK-UHFFFAOYSA-N 475.527 0.994 50 20 JCGD O=S1(=O)CC[C@H](S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(CCCCl)cc3)CC2)C1 726974656 NPBGCHXTQYTIGF-KRWDZBQOSA-N 485.049 0.681 50 20 JCGD COc1ccc(NC(=S)NNC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)cc1F 727499482 LBIJWVCFUHNYAH-LLVKDONJSA-N 457.509 0.317 50 20 JCGD CN(C)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1F 728330077 LRHZSROVWOGGGT-INIZCTEOSA-N 481.458 0.220 50 20 JCGD C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)CC2)C[C@@H](C)O1 728598677 LCKWSVCGAHPKHL-ZIAGYGMSSA-N 491.517 0.614 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)NCCC(=O)N2CCN(C(C)=O)CC2)cc1OC 730826333 NHYDGJAVPOLIAQ-UHFFFAOYSA-N 463.535 0.899 50 20 JCGD CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 749160013 QIEOTIKLBCGKOX-YOEHRIQHSA-N 464.569 0.668 50 20 JCGD CON(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 750458831 RMABNIDRGJZJCB-QGZVFWFLSA-N 479.467 0.013 50 20 JCGD CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 811866600 HVJNSYUUXKOHLP-UHFFFAOYSA-N 480.568 0.762 50 20 JCGD CC(C)(C)C(=O)NCCCC(=O)NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 825123435 SNWQZHYATMVUAN-UHFFFAOYSA-N 485.632 0.968 50 20 JCGD CSCC[C@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)N1CC[C@H](B(O)O)C1 864233941 LEWPWUMQUUELML-LRDDRELGSA-N 491.828 0.517 50 20 JCGD C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 913462879 FQBSHZPATKADSR-MRXNPFEDSA-N 479.607 0.353 50 20 JCGD CCc1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1S(=O)(=O)N1CCOCC1 914406293 YPHITMLYVSTWAX-UHFFFAOYSA-N 485.526 0.320 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3cccc(NS(C)(=O)=O)c3)nc2)CC1 916246279 CBPAXLIGJWLJRV-UHFFFAOYSA-N 497.603 0.216 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCN2C[C@H](C)O[C@H](C)C2)cc1 916250274 YQWRYQSVVITQRP-CALCHBBNSA-N 455.581 0.445 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1C 916562144 MDSFCIHFLPQHIS-UHFFFAOYSA-N 460.512 0.724 50 20 JCGD O=C(COC(=O)C1=NN(Cc2ccccc2)C(=O)CC1)NNC(=O)[C@@H]1COc2ccccc2O1 917268302 UXSBHPLOGKAQIX-IBGZPJMESA-N 466.450 0.696 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccc3c1OCO3)c(=O)n2Cc1ccccc1 918017239 RSGFXOSPHUDMPQ-UHFFFAOYSA-N 490.476 0.618 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 918540001 YVNWGKXWUMQHGB-FQEVSTJZSA-N 465.620 0.940 50 20 JCGD O=C(NNS(=O)(=O)c1cc(Br)ccc1Br)N[C@@H]1CCS(=O)(=O)C1 919961076 QKWUTVZIUKSLLX-MRVPVSSYSA-N 491.183 0.891 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C2)C1 1780094317 JXXNRTHGHLCOSO-JOCHJYFZSA-N 475.502 0.346 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1780728849 XZQURAMIVRDIIC-QHCPKHFHSA-N 452.515 0.508 50 20 JCGD CC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968714 DPHPYJUNNQPWMU-QHCPKHFHSA-N 459.547 0.532 50 20 JCGD COc1nn(C)cc1C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970492 WPNDAHLLEKLQFO-DEOSSOPVSA-N 499.572 0.218 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1F 1782209388 LKHVRNQBCSDGGQ-QVKFZJNVSA-N 452.531 0.368 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c(O)cccc34)C2)C1 1782512681 YJLLOUMQHHATEM-HSZRJFAPSA-N 455.515 0.757 50 20 JCGD N=C1NCCN1CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783022115 FKLVHLMNLOOJCW-UWJYYQICSA-N 478.391 0.662 50 20 JCGD CCOC(=O)N(CC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)Cc1ccco1 1783938083 SMNXEYIHRYCEBI-QHCPKHFHSA-N 493.561 0.441 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3C(=O)Cc4ccccc4C3=O)C[C@@H]21)[C@@H](O)CCl 1784083985 JBWVGKBKQWUZID-WNHJNPCNSA-N 477.945 0.181 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3occc3Br)[C@H]2C1 1787588262 LNYDUILMSJIPOS-PJODQICGSA-N 492.330 0.948 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ccc(-n2c(O)nnc2O)cc1 1789272317 GDAKQBOMZJCBDG-MXAVVETBSA-N 453.858 0.806 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3ccnn3)[C@H]2C1 1790641552 AZTITLLHTSGLDL-VQUGOPFGSA-N 486.485 0.966 50 20 JCGD COc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)n1 1791288064 SLXDWSLRYMVEDO-WDSOQIARSA-N 461.563 0.376 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792982960 XFVOZIVEDJGTNA-UNPPPGBBSA-N 471.982 0.823 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ncccn1 1794190418 FZGDMTASLAHYAD-USGNIVHTSA-N 469.454 0.756 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2 1796446309 RQEBQLJAMMLXSE-USVNMRCTSA-N 454.325 0.493 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)N1C[C@H]2C[C@H]2C1 1797636715 WDIFOULFKQULHG-QYPFPGBOSA-N 498.628 0.262 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cc(Cl)ccn1 1797905594 DZKUHJWHHVQGMX-DPSMYSLWSA-N 488.932 0.837 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncccc1Br 1798187681 BEGRSQXDUMWAGK-FVCICTRLSA-N 468.352 0.420 50 20 JCGD CC(C)(C)OC(=O)N1CCn2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)cnc2C1 1798410609 FMGLZLISEMBMMX-KPEUIFRASA-N 497.980 0.437 50 20 JCGD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)N1CSCSC1 1798440364 KGOINVPENARKGP-APIJFGDWSA-N 464.617 0.980 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)cc1)NC(=O)NCc1ccccc1 1798948958 CQHGKPRTMLXLKU-JHDGKUDLSA-N 481.553 0.942 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1802089121 NWDMFOPEXHWHQR-MLYANYNQSA-N 461.519 0.299 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncc(S(C)(=O)=O)c1)C2 1802332384 BLFYWVDXZYSYPY-MUJYYYPQSA-N 451.549 0.110 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ncc(Cl)cn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361288 FTYLTSJHQIXQGL-APWZRJJASA-N 465.706 0.838 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807369325 GPZKQXODAIBXFP-ZNLUXHQJSA-N 461.331 0.614 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cnnn2C)[C@@H]1c1cccnc1 1808409952 PZIJNPJSTJXUJN-RUVVGEKZSA-N 463.502 0.664 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCN(C(C)=O)CC2)[C@@H]1c1cccnc1 1809678127 LYMSWNHDWFFQAH-ZJOUEHCJSA-N 465.982 0.505 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810474876 FKLRUVQFIAXYJY-BSIFCXSSSA-N 462.319 0.009 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1812866974 VAVVBDBSQMVHIW-SCNOPHJPSA-N 455.353 0.521 50 20 JCGD CN1CCN(C2(C(=O)N3CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3c3cccnc3)CC2)CC1 1813072093 BEFNPWSMHSDRQN-NFBKMPQASA-N 485.633 0.240 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1Cc3ccccc3CN1)CC2)c1ccc(B(O)O)cc1 1815340603 NEXLJQAHKPCEIU-AZUAARDMSA-N 476.367 0.763 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3c(c1)CCNCC3)CC2)c1ccc(B(O)O)cc1 1815348325 KNKYBRIHDPTIHJ-SFHVURJKSA-N 491.382 0.446 50 20 JCGD Cc1nn2cc(CC(=O)N[C@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)nc2s1 1815350575 YHMSGTLNIMXMAQ-AWEZNQCLSA-N 496.383 0.704 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cscn3)sc2C1 1816989239 BPRHGUVOTTZBTC-YPMHNXCESA-N 465.605 0.455 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1 1818110874 ROJYELMATXAQBT-WJNWYLSZSA-N 471.522 0.807 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCSCC2)[nH]n1 1819400245 FZJGADNUYJNWCT-QGZVFWFLSA-N 472.575 0.763 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)n1ccccc1=O 1820123749 CANQUJDHJJGHFP-CZUORRHYSA-N 466.328 0.472 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1 1822415758 HNVYECHXZQYJDB-LBPRGKRZSA-N 462.429 0.880 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825815624 ZMQZOAXUNQLQBT-DOMZBBRYSA-N 488.375 0.962 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@H]2NC(=O)NC2=O)CC1 1827677432 SAMFWADGLVYGFZ-PTISKKJCSA-N 485.545 0.338 50 20 JCGD O=C(COCCO)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551696 SWFIVYZTSGTVGV-GCJKJVERSA-N 483.949 0.047 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C)CCC1)CCO2)NC(=O)NCc1ccccc1 1829684715 MVNGGTPIKUYKQB-VWLOTQADSA-N 487.601 0.979 50 20 JCGD COC(=O)N(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)Cc1ccccc1 1830739044 XBWJWWHFPWLKRE-GCJKJVERSA-N 483.949 0.311 50 20 JCGD CC[C@H](C)[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831506033 RNUAXFKOFSGLTC-NRVIRDBHSA-N 492.013 0.982 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832080227 IRUCDPMAQRBEDJ-JLHGSKIFSA-N 489.997 0.832 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1F)CCO2)NC(=O)NCc1ccccc1 1832126228 FVBVSVQKSIIDMH-SELNLUPBSA-N 477.537 0.147 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1 1833177567 DUKAOIQOHUEXTK-JOCHJYFZSA-N 488.932 0.046 50 20 JCGD Cc1cn(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](C)CBr)CC3)CC2)c(=O)nc1O 1833266007 IXOFTVCSHRGFEK-AWEZNQCLSA-N 498.422 0.860 50 20 JCGD CC(C)c1csc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)n1 1833282063 TWJYTPCVDRPVBB-JOCHJYFZSA-N 473.360 0.330 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(C)c(C)[nH]c3=O)CCO2)C1 1833390029 IRZDLBPLNUEFQM-AUUYWEPGSA-N 471.352 0.630 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1 1833615197 PICSCJMHWSIFAC-KKSFZXQISA-N 497.390 0.772 50 20 JCGD Cc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)cn1 1834078791 XQLNSXCENHAQQF-KSFYIVLOSA-N 497.980 0.987 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)nc3O)CC2)CC1 1835071307 NTGJNNIRKYIVCC-NSHDSACASA-N 456.341 0.856 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1cccs1 1835933853 HPJAPMKJJGHSPF-AOMKIAJQSA-N 458.345 0.302 50 20 JCGD CCSc1cccnc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938180 OSFFXBPDCOECDA-QHCPKHFHSA-N 485.371 0.257 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1[nH]cc2c1CCC2 1836085208 ALKMHINWXOIPER-UHFFFAOYSA-N 464.375 0.682 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccs3)CCO2)C1 1836088566 GNMXTIGIHDZUMY-ZHNJOBQTSA-N 473.555 0.881 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1 1837440656 RIGNDIKXCYOBNB-FWQQEFPFSA-N 459.385 0.946 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)s1 1837460469 GRCTYSGFIVMVKL-UHQIAATHSA-N 486.554 0.233 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)CCO2 1837472135 WYPNPBZWTMAANN-FUCAVZNHSA-N 494.378 0.324 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837576833 BOONHENZLHUUEB-JYFCICGUSA-N 468.315 0.441 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1837714569 KTZQZBYOORKZPW-NJNPRVFISA-N 467.639 0.695 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1838023339 VOGKNEKEKCTGMJ-LJQANCHMSA-N 486.360 0.661 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(OC)c1 1838879606 WNXIZBGDLMCWCI-QHCPKHFHSA-N 478.546 0.147 50 20 JCGD Cc1cc(C)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1838947568 KZRXQUWOIZCLPH-XMMPIXPASA-N 467.526 0.686 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839036213 VFFZUNRMNGEOLB-LFRPXUGBSA-N 471.913 0.000 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](NC(C)=O)c1ccc(F)cc1)CCO2 1839040020 OUCBUELOCGDNJW-KNKQGSTJSA-N 485.940 0.713 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839106113 BGDGZSJIUCURGK-PXNSSMCTSA-N 487.439 0.254 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1839151048 GWBLJRXYLVPDGY-MSOLQXFVSA-N 461.302 0.481 50 20 JCGD O=C(NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)c1cccs1 1839198138 VFFMYHLVQGSVLB-WMLDXEAASA-N 478.340 0.625 50 20 JCGD CC(C)(C)Oc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1839342921 ZJGULEMRQHPJKF-AREMUKBSSA-N 496.369 0.928 50 20 JCGD Cc1cccn2ncc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c12 1839611626 FWSIGGSQLRHSPH-DEOSSOPVSA-N 493.524 0.025 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NNC(=O)C3)C2)C1 1839743944 GREKNYJFLAEXEP-CEMXSPGASA-N 473.436 0.204 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1839801067 SDWSQJVZTXDVGA-WIYYLYMNSA-N 488.990 0.079 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc31)CCO2 1840257500 XNWASMHHMQIAGO-WIOPSUGQSA-N 464.327 0.166 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840798231 HEVTTZPOJUUDMZ-BXTJHSDWSA-N 496.026 0.299 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014841 IBCNRZFBQGPVQG-SFHVURJKSA-N 457.336 0.583 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)N1CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C1)C2 1843015660 SOOSDMOOWCUPRA-UFYCRDLUSA-N 483.374 0.971 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCn1ccnn1)C2)NC(=O)NCc1ccccc1 1845039326 FOHDICFFZJJTPE-UHFFFAOYSA-N 454.535 0.218 50 20 JCGD O=C1NC(=O)[C@H](CC(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)N1 1845940286 GZHVDVDXDSNTFY-CABCVRRESA-N 463.332 0.794 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)COCCOCCNC(=O)OC(C)(C)C)C2 1846383989 QHARUKYHORYCEG-UHFFFAOYSA-N 499.609 0.121 50 20 JCGD O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)[C@@H]2C[C@H](O)CN2C(=O)OCc2ccccc2)C1 1847000778 WBFYJLJNGDPOLG-OKZBNKHCSA-N 465.934 0.562 50 20 JCGD COc1cc(N2CCC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cnccc3C(=O)NN)CC2)ncn1 1847669767 LYODKUFLOGIKNK-OALUTQOASA-N 494.556 0.216 50 20 JCGD CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1=O 17517091 JDOCZYXKHFPLMN-UHFFFAOYSA-N 499.549 0.429 50 20 JCGD CN(C)CC(=O)NNC(=O)c1cccc(NC(=O)C[C@@H]2SC(N3CCCCC3)=NC2=O)c1 727761488 IYUGZPCABLRBCS-INIZCTEOSA-N 460.560 0.822 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cscn1)c(=O)n2Cc1ccccc1 728515908 ZAXAWNQCHYXRSQ-UHFFFAOYSA-N 481.538 0.982 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)C1CCN(c2ncccn2)CC1 728855959 GCZUKEGJMFGAFR-UHFFFAOYSA-N 480.572 0.143 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 748127636 CMQRQIGXZDINMK-UHFFFAOYSA-N 482.540 0.019 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)[C@@H]1COc2ccccc2O1 749838408 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COc1cc(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1OC 1779037336 WLIPFUUHNUVBFK-DEOSSOPVSA-N 483.525 0.768 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1 1780388285 NBPHNFUEIKHXFZ-QHCPKHFHSA-N 476.497 0.023 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)ccc2O)C1 1781142976 NQOOLKDJCYHPIM-AUSIDOKSSA-N 469.498 0.538 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CCOC1 1781308306 LZSSKOUFXWFKPX-PNHOKKKMSA-N 461.943 0.100 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)[C@H]1CCCS1(=O)=O 1781650704 WVKLIVMNNHXMCZ-CKEIUWERSA-N 451.383 0.863 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1782864818 UVCFEUWZLNEBMH-CNAUTRJHSA-N 481.264 0.695 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cncn1-c1ccncc1)CCO2 1783936145 HAOLHGZZNJHPLR-QFIPXVFZSA-N 455.519 0.084 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nnc(Br)n4c3)C[C@@H]21)[C@@H](O)CCl 1784090092 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0.481 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)c(F)cc3F)C[C@@H]21)c1cccc(B(O)O)c1 1786984780 ISTGSMJMXTZIDP-RISOHXOYSA-N 462.233 0.691 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn(C)c3=O)C[C@@H]21 1787507082 WOIRWSCVQOHVQZ-IIYRHJEWSA-N 468.514 0.113 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc2cnccc2c1 1787956478 ZCYIFTDMKGACEQ-PMVMPFDFSA-N 459.311 0.822 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)ccc(F)c3F)C[C@@H]21 1788611726 WCMJRIDSJBBNRW-UVIMBBFXSA-N 491.470 0.938 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)[C@H](F)Br 1789926841 HMIHHGDVIOSBRC-YVNDNENWSA-N 468.370 0.517 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1793088795 QSQBNVVAVXICOX-MIFYACCESA-N 498.404 0.938 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793880166 SFPROVGMCIKUDW-QMHWVQJVSA-N 490.001 0.416 50 20 JCGD 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CNC(=S)NCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1797759405 NGPSOLVJXQSGJI-HBCWATKFSA-N 493.542 0.207 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c[nH]c(=O)cn1)C2)NC(=O)NCc1ccccc1 1799869816 MXBOYKVZPVIDJN-BCDXTJNWSA-N 467.530 0.368 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@@H]2C=CS[C@@H]12)NC(=O)NCc1ccccc1 1800253346 UQYWNTZZWIKFJY-AZWPUGGCSA-N 485.610 0.797 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(c1)CCNCC3)C2 1800761718 FUQWSEXTBSACTN-GMLZMKKNSA-N 451.365 0.756 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1805146146 VTBXOIBAEPWXDL-XLIONFOSSA-N 465.294 0.576 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CSC(=N)N)[C@H]1c1cccnc1 1807002470 SEXGGLRNHJGWFR-PRBGLLFOSA-N 470.559 0.848 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnnc(Cl)c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369378 IFJDRGCASQTUPC-JXFKEZNVSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372341 DNNKQRUOSDZOTL-DYESRHJHSA-N 488.288 0.577 50 20 JCGD CCn1nc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1C 1807374411 HFCXEJNYXNCQQJ-KNQAVFIVSA-N 461.331 0.920 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(C)C 1810106967 RIEABMOVOSSZIY-QMMLZNLJSA-N 482.541 0.987 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1ccnc1 1810294316 JDJKXKMXKYJXQZ-MDYRTPRTSA-N 462.514 0.857 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1 1810303067 PCKRFHOBAYSQQI-DYVFJYSZSA-N 479.457 0.345 50 20 JCGD C[C@H](O)C(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1812857938 BAGXDCCHFPTRHI-UCNVEGJOSA-N 468.558 0.814 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@H]1c1cccnc1 1813071648 WBFVNNHDGBUPAJ-DVECYGJZSA-N 472.590 0.863 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1 1813484219 NVZCPFMTTYEHDP-DPZNOXRXSA-N 472.509 0.903 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817473857 CQEDJWRNDSNHGS-SFHVURJKSA-N 455.324 0.558 50 20 JCGD COCCn1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1 1818259512 OGHMEPVAILGRJM-LJQANCHMSA-N 466.307 0.552 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccn3c(O)nnc13)CC2 1819797141 NIFYCJWUUIHOSW-SNVBAGLBSA-N 493.509 0.430 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)NC(=O)c3cnccn3)sc2C1 1820027326 ZDRZYUGZSALOJL-QJPTWQEYSA-N 466.951 0.917 50 20 JCGD CC(=O)c1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n[nH]1 1825702906 HVJUCERGOFIROH-OAQYLSRUSA-N 452.320 0.839 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@](C)(O)C(F)(F)F)CC2 1826084063 ZAUXDOMPUBVBPA-FVMDXXJSSA-N 451.471 0.741 50 20 JCGD CN(C)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551067 HEDDTUDPCWELGH-XXBNENTESA-N 480.993 0.990 50 20 JCGD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)nn1C 1828924106 IXQSVQFXEPMPGF-LJQANCHMSA-N 469.546 0.974 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830736478 SPIRXZQTOQQNCA-RADWXHQJSA-N 483.949 0.357 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1 1832197970 DYTAGONFSCUHKM-FOIQADDNSA-N 480.363 0.919 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(F)(F)F)CCO2 1834111246 HSVPOLFYMDCFNL-NRFANRHFSA-N 493.247 0.164 50 20 JCGD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc1 1834263083 VTVQXBPHNOSGJT-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CS[C@@H]3CCCCO3)CC2)CC1)c1ccc(B(O)O)cc1 1834798669 WKYFOEJODXLELI-HSZRJFAPSA-N 489.447 0.811 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1834823442 VJZAXKZDJNJDLH-UXHICEINSA-N 482.331 0.963 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)CC1 1835511704 OQXLXAJRJQNYRT-UHFFFAOYSA-N 486.455 0.507 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1835835370 XCLIZDANELIKBD-INIZCTEOSA-N 453.616 0.008 50 20 JCGD CCn1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c2ccccc21 1835928024 BBNNTLAXPKAMFS-RUZDIDTESA-N 492.341 0.120 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)C2)C1 1835930717 VWBLVXZGIPPJGT-WTEVXDJOSA-N 494.378 0.324 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1 1835931310 MLTKDIDSRNIJJR-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3Cl)C2)C1 1835931685 XDIFGVWZXRBSSP-QFIPXVFZSA-N 458.707 0.404 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)C2)C1 1835931888 FWZNTNQZRRPNGL-OTNCWRBYSA-N 464.327 0.240 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1836215623 GLYSMJFTXAWJDU-VPCSNGCSSA-N 479.933 0.348 50 20 JCGD COCC(=O)N1CCC(N2CCC(NC(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1836343872 LPSXPQXDSQARGP-UHFFFAOYSA-N 474.606 0.551 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836577874 AGNLVPLVLCXANX-HXUWFJFHSA-N 474.562 0.212 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C(F)(F)F)[nH]3)CCO2)C1 1837764907 RXBOSOKGXNRNSL-FQEVSTJZSA-N 496.446 0.416 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnn1C(C)C)CCO2 1838021688 MUAVCRMWELSDTF-OINMWHHXSA-N 485.545 0.668 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C(F)(F)F)ccn1)CCO2 1838083705 KONUBDBBIAGNDH-NRFANRHFSA-N 493.247 0.164 50 20 JCGD CC[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838527388 PZHYJWQNICIUCI-UWJYYQICSA-N 465.459 0.361 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1 1838911789 NNWWQIQNWCQRMB-JOCHJYFZSA-N 457.462 0.208 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccn1 1839200965 PPWAANHBIHOOMI-MAUKXSAKSA-N 473.299 0.801 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1840033227 YETXSMBITZMPMT-KPZWWZAWSA-N 468.308 0.288 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1 1840034196 CYIUIWFQMAUGCB-FZKQIMNGSA-N 458.357 0.887 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185174 MLDMHXKBCAHNIJ-XMMPIXPASA-N 476.574 0.755 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)N(C)C(=O)OC(C)(C)C 1840185571 UETVHRKRZDZRPH-UZUQRXQVSA-N 499.609 0.071 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C[C@H]2C[C@H]21 1840912468 FZSYNBASZHZHRU-QTTDFFODSA-N 487.981 0.440 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)CC2=O)c1 1841008410 PCKRCIJTLDSLTO-SFHVURJKSA-N 477.326 0.245 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])cc3c2OCC3)C1 1844689503 AEKPOXGACKCTQI-UHFFFAOYSA-N 451.244 0.340 50 20 JCGD CN(CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc(Cl)cc1 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NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CCO2)C1 1779036201 XDWSSIDUMGJMAU-NFOSPISASA-N 480.481 0.750 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374535 NPHGGZCWWBZYBF-WZONZLPQSA-N 473.530 0.322 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(Cl)nc3Cl)C2)C1 1779418021 OJQRDMCHGVITPR-HXUWFJFHSA-N 464.114 0.826 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780095379 NZFRXIWNZVUYNT-JOCHJYFZSA-N 476.486 0.878 50 20 JCGD CC[S@@](=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968917 QVRPSRHHMBDGFY-OHWKKVTOSA-N 493.630 0.321 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@@]13CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C3)CCC2 1781368636 FSJRFZRKAFZLFY-NTKDMRAZSA-N 481.557 0.349 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1783193445 LHVYEIZDWLATCM-GLHSZLCASA-N 483.968 0.987 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783940653 YIWXLNMARBSJPM-IAMHBRQHSA-N 458.342 0.799 50 20 JCGD Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)nc1 1785305827 DLVBRULRAZGBQC-NYVOZVTQSA-N 451.332 0.296 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncncc4c3)C[C@@H]21)c1cccc(B(O)O)c1 1786983870 CHXUVSVZPBLOGO-XJABCFGWSA-N 460.299 0.217 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1 1787444667 GCMBSOHDRUSIQA-JKOZEPOUSA-N 455.914 0.680 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cncc2cnccc12 1789169564 KRARLMDMUFCHIG-SSKFGXFMSA-N 460.299 0.217 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]cnc3-c3cccnc3)[C@H]2C1 1789197263 MOHDLXAQLKLISA-BZSNNMDCSA-N 469.546 0.438 50 20 JCGD C[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)Oc1ccccc1 1790698207 SJNRUNVQWLSTOD-UJFGGOPNSA-N 466.343 0.817 50 20 JCGD CCc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1Cl 1791288793 VGVRZGMJJIHVCC-DZKIICNBSA-N 468.986 0.602 50 20 JCGD CN(C)c1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1791467781 ANBLKONVJGJOOA-OYDLWJJNSA-N 479.386 0.659 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792981361 KAUNGHZCQMERCM-YUDUXTHKSA-N 463.934 0.523 50 20 JCGD C[C@@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCS(=O)(=O)CC1)C2 1792987366 OLVBHLOBSMRHAH-XQLPTFJDSA-N 450.399 0.386 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C[C@@H]2C[C@@H]21 1792992768 LIMYQJQRYQAVIX-FVSVBAFRSA-N 457.955 0.574 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)n1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1794069485 BVBYVHRTDZODDG-YVWYUNDQSA-N 477.248 0.226 50 20 JCGD COc1ncccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796439581 NMIYNSWTSZJWMC-DGODORHTSA-N 482.541 0.746 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796935066 SIPKFEVAMRVAOR-VBUUOAMHSA-N 454.531 0.791 50 20 JCGD Cc1ccc2oc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)cc2n1 1797750415 ALWJEMLJPXPUOT-VTEUUUEMSA-N 464.482 0.652 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@@H](C)Br)C3)C2 1800327022 YZYBIHIWLHGMNY-LBKYZSNHSA-N 497.390 0.995 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCOCCOCCOC 1800849292 SAVSCIYRJMZDDH-SFNKJDCFSA-N 495.411 0.446 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cccnn1 1801345261 CSUHSGGRTHACJT-KRXQYRFLSA-N 483.953 0.577 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCS1)NC(=O)NCc1ccccc1 1801564096 DTYFIKYWNWHURK-RCLSDMTESA-N 475.615 0.818 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1 1804094274 NURPOKPYDGRPJX-AXHNFQJDSA-N 456.330 0.876 50 20 JCGD Cc1nc(O)c(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nc1C 1804871919 BKQJXZRQACOSET-DYESRHJHSA-N 469.546 0.887 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807369662 RKJCTKDZTDXBSW-NFBKMPQASA-N 461.331 0.595 50 20 JCGD Cn1cc(CCC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1807431231 YWYHPMXONDJHTB-PGRDOPGGSA-N 476.541 0.766 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)[C@@H]1SC(=N)NC1=O 1808398920 HDWXHUCKIPAITD-BMIPRAEKSA-N 489.602 0.263 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810305196 JAUHVDRDKYRHRF-JTSKRJEESA-N 476.541 0.982 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1ccccc1=O 1810517604 DLIXPNGYEPXNKS-RADWXHQJSA-N 489.536 0.823 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1812346049 FRSZVYQFLWVYLQ-CBVHJVASSA-N 459.934 0.901 50 20 JCGD CNc1nsnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1814431321 FBWMYNXFABIOQJ-CQSZACIVSA-N 455.309 0.602 50 20 JCGD COC(=O)CSCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815221932 RCJKENSZZKPHET-INIZCTEOSA-N 460.321 0.302 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)c2ccco2)[nH]n1 1819403195 XKDNKNBQVGROER-MRXNPFEDSA-N 480.485 0.737 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3nc(O)n4c3CCCC4)sc2C1)c1cccc(B(O)O)c1 1820235316 HQNGSSAJLWIGHR-CQSZACIVSA-N 481.343 0.601 50 20 JCGD CN1CCCn2nc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)[nH]n3)cc2C1 1821593810 XIYLBESQQYVEHD-NRFANRHFSA-N 491.361 0.741 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053723 YOQALXUWLQPEIY-FQEVSTJZSA-N 496.329 0.370 50 20 JCGD CC[C@H](O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828532281 GOEBLCZVLUTDCO-SVMVAKDDSA-N 467.950 0.809 50 20 JCGD O=C(C(O)O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCN2C(=O)OCc1ccccc1 1829232515 UALBGCIYNLKHSJ-KUHUBIRLSA-N 488.310 0.440 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)C#N)CCO2)NC(=O)NCc1ccccc1 1830060808 UGBJMOPKWXXRKB-DEOSSOPVSA-N 486.573 0.339 50 20 JCGD COCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830538805 QSIZTXVGKUHDFL-SCLBCKFNSA-N 460.325 0.922 50 20 JCGD N#Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(C(F)(F)F)n1 1830722886 ILOPQXGAZSXVDD-KSSFIOAISA-N 476.839 0.642 50 20 JCGD Cn1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1C(F)(F)F 1830728345 RREPNSHPFZGNJL-ZBEGNZNMSA-N 454.833 0.109 50 20 JCGD Cc1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)[nH]1 1831848606 RLSWHUJGRQHHFJ-BTYIYWSLSA-N 485.969 0.920 50 20 JCGD O=C(Cc1ccc2ncccc2c1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832031973 WOJKUGGDDNNRGE-AREMUKBSSA-N 489.337 0.227 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ncccn3)C2)C1 1832549032 CBDSVHSIKAQMMZ-AOMKIAJQSA-N 497.980 0.608 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)C(C)(C)C)C2)C1 1832549324 HXTCVQUDRNBQFU-WCJKSRRJSA-N 492.013 0.982 50 20 JCGD CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1833532096 AMUAQZFBFVILMM-OAHLLOKOSA-N 464.958 0.405 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCC(F)(F)F)CC2)CC1)c1ccc(B(O)O)cc1 1834797850 DLRAZAGUJZBBCO-UHFFFAOYSA-N 455.286 0.894 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CC(N)=O)CC2)CC1 1835116235 CLAKNIBXJXKBLY-HIFQEXITSA-N 473.578 0.204 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCN(C)CC3)CC2)CC1 1835483722 JJKYMPNXFCJBJE-MRXNPFEDSA-N 458.445 0.589 50 20 JCGD Cc1n[nH]c(C)c1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835872477 KGCCIUHEHYYECK-UHFFFAOYSA-N 468.562 0.524 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1835927853 YXLGGQZVDHWDJS-JCYRPKCISA-N 494.353 0.249 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1836419777 ZAKASCFWMOVPFN-UGSOOPFHSA-N 458.309 0.736 50 20 JCGD O=C(CCN1C(=O)C=CC1=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1836995872 NHXGYYPZYXHGRU-SFHVURJKSA-N 474.327 0.991 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837457892 UXZOTULTRXVVKL-DEOSSOPVSA-N 467.526 0.306 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)NCc1ccco1 1837637204 WHQGTNXEUQDBGO-JFZXIXNHSA-N 488.310 0.599 50 20 JCGD CN1CCN(C2(C(=O)N3CCC(OC4CCN(C(=O)CCC(=O)NN(C)C)CC4)CC3)CC2)CC1 1838629160 JCQDLDCLKLGGEV-UHFFFAOYSA-N 492.665 0.138 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)CC2)CC1 1838786213 MCAIHGFFYKTPQS-VQTJNVASSA-N 483.997 0.709 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)c12 1839556741 NXWRXPBKMGOAJV-IIBYNOLFSA-N 451.907 0.846 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1840033347 AYGQEBWHRVDIJR-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD Cc1ccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)s1 1840185593 SQJLJEIIUFOEML-IMAOXBOFSA-N 464.588 0.899 50 20 JCGD O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1840187138 XQXFQJHMPAWJJE-LBPRGKRZSA-N 455.188 0.602 50 20 JCGD CCOC(CC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)OCC 1840280732 DBEOXOOHKJNOHY-QADUPLGGSA-N 493.561 0.366 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Cn1ccnc1)CCO2 1840430692 MCWGPVBVYLPKLF-VUGUJGDZSA-N 485.545 0.110 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(OCC3CC3)cc1)CCO2 1840749318 QTMSESVIELNKKT-AREMUKBSSA-N 494.353 0.539 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1840908620 CUCGATQSPQSTBW-AVYPCKFXSA-N 461.918 0.894 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(Br)ncc2F)C1 1843529533 RNTCIBCPFGMAOM-UHFFFAOYSA-N 462.084 0.794 50 20 JCGD COc1cc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc([N+](=O)[O-])c1OC 1845551590 VXZSVVWTAKHGHK-UHFFFAOYSA-N 469.259 0.423 50 20 JCGD NC(=O)[C@@H](N)CCC(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1 1845941170 IVSNTDKRMDTTFA-CVEARBPZSA-N 451.365 0.789 50 20 JCGD COc1cc(C(=O)NNS(=O)(=O)c2cnc3c(c2)c(O)nc(=O)n3C)ccc1OC(C)C 727749000 BBBFUMPPSLKFST-UHFFFAOYSA-N 463.472 0.453 50 20 JCGD O=C(COC(=O)CCC(=O)N1CCc2sccc2C1)NNC(=O)[C@@H]1COc2ccccc2O1 728331209 FOVQEDRBYKFYFK-KRWDZBQOSA-N 473.507 0.944 50 20 JCGD O=C(NNC(=O)c1cc(F)ccc1Br)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 728550979 RXCFBTSXSHVTTB-SNVBAGLBSA-N 475.296 0.515 50 20 JCGD CCOc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc(Br)c1OC 730569395 YFVUJNKROYWYJL-UHFFFAOYSA-N 486.348 0.891 50 20 JCGD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)C1 731220496 INRQXRUBLHJXQT-QUCCMNQESA-N 486.621 0.746 50 20 JCGD O=C(NNC(=O)N1CCOCC1)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1 745995769 AQRACLHKVFGPPR-UHFFFAOYSA-N 481.394 0.984 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)Cc1cc(F)c(OC)c(S(N)(=O)=O)c1 915594429 PLPDOHXGCSAONW-UHFFFAOYSA-N 455.464 0.649 50 20 JCGD COC(=O)c1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1 916248895 MNLPXBKRJVPENI-UHFFFAOYSA-N 476.559 0.673 50 20 JCGD CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 916646759 MGTCTKJGKKOWKB-UHFFFAOYSA-N 468.561 0.374 50 20 JCGD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 917533856 CFLKRNQXUUOABV-UHFFFAOYSA-N 492.584 0.737 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)Sc2nnnn2C2CC2)c1 918398723 GGCZMKDLNQIPRU-GFCCVEGCSA-N 467.577 0.980 50 20 JCGD CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1 919779704 VWDBHQXYQAMHBD-LBPRGKRZSA-N 451.461 0.973 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)C1CCN(C(C)=O)CC1)N(S(C)(=O)=O)CC2 1115821017 BMMXNLABPGNLOH-GOSISDBHSA-N 496.586 0.359 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1778089928 JUXWYZJCYKNMBB-UKPHBRMFSA-N 484.388 0.616 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCC3)C2 1779372715 ZJGMWULJYGJFFM-AUSIDOKSSA-N 467.530 0.269 50 20 JCGD Cc1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779373130 DUZFSHGOOWITIS-AUSIDOKSSA-N 452.515 0.830 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)[C@@H]1SC(=N)NC1=O 1780773114 CQNHDTVQTMILDH-NTJNJQCLSA-N 479.372 0.993 50 20 JCGD Cc1cc(C#N)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1781150040 YFAOMVKVZWRWBC-RCZVLFRGSA-N 461.327 0.988 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4occc4c3O)C2)C1 1782393908 RACGKYPGIMQCRU-HSZRJFAPSA-N 465.466 0.894 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)[C@@H]2C1 1783465539 ILHNQSGHWLLTFM-QKQGURCUSA-N 457.955 0.529 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1783687118 PWCBDNUTHDEEPQ-VQIMIIECSA-N 481.384 0.296 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C=C[C@H](NC(=O)OC(C)(C)C)C1)CCO2 1783933247 FUABDICQLVVFNW-NXMSCROESA-N 493.605 0.659 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1cc([N+](=O)[O-])ccc1F)CCO2 1783933313 HBHSGKJXYMXQET-OAQYLSRUSA-N 465.482 0.479 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783934388 GEQSSGNECHUXNC-HSZRJFAPSA-N 459.547 0.219 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(-n3cccn3)cc1)CCO2 1783935435 SXOAZUXUEOCOBC-HSZRJFAPSA-N 454.531 0.689 50 20 JCGD O=C(c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2 1785245623 NGRMEOQLKZWUOA-FXAWDEMLSA-N 489.953 0.685 50 20 JCGD COc1ccc(OC)c(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1 1786659060 SZDJEFLUWNOSMI-VCOUNFBDSA-N 490.601 0.989 50 20 JCGD CN[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21)C(=O)O 1786898810 QVNWMWXZOHFWIP-KUZCPNRJSA-N 492.485 0.176 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)ncc1[N+](=O)[O-] 1787641568 WJJLEZKNPBXGDX-AXHNFQJDSA-N 483.485 0.204 50 20 JCGD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)N1CCN(C)CC1 1788150316 CKMDUYGLPWLLRA-GOSISDBHSA-N 464.375 0.750 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C\C(=O)NC3CC3)[C@H]2C1 1788493522 ZFMCOFQEYFIUAN-MSJFBKSJSA-N 499.008 0.933 50 20 JCGD CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1Cl 1788610527 XUXYLWQAHUKLTI-PJODQICGSA-N 475.937 0.531 50 20 JCGD Cc1ocnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1789031287 UNLDWXDOIVZMIJ-UFYCRDLUSA-N 484.557 0.923 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncnc3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724905 QSIYJEPGHLPJTD-JBACZVJFSA-N 481.557 0.416 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cccc(N2CCOCC2)c1 1790117538 WLAIMDOZPQMYIH-FFGOWVMKSA-N 451.951 0.716 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)CN(C)C(=O)C(=O)O)cc2)CCC1 1791095432 WJUBGTDPHAVCAV-MZJWZYIUSA-N 482.497 0.798 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C[C@@H]21 1791291341 RSIRPFNKOXVISE-BXWFABGCSA-N 472.546 0.022 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1 1791599955 RDCZSHDMBMTWAO-OAHLLOKOSA-N 467.592 0.821 50 20 JCGD O=C(CCc1cnccc1C(F)(F)F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793969795 NVJFELNVQZSJBB-UPHUGPLXSA-N 491.275 0.616 50 20 JCGD NC(=O)[C@@H](N)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1795637902 SNOAWZYLWWNQQU-OYNZLANYSA-N 481.391 0.175 50 20 JCGD COc1ccc(C2(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1795735806 FIQVICJPZFSDRB-BBIADKPPSA-N 478.354 0.700 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2sccn2c1 1796114186 FXLDOKQOMUFRNF-ZSBFGKGUSA-N 454.512 0.516 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)C1 1796189752 VSIAZZJLCOYUKQ-IYWMVGAKSA-N 487.362 0.254 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCO3)C2 1797754082 LNEGOJVCMKHNEQ-UPHUGPLXSA-N 465.510 0.527 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1cc(C)on1 1797829627 KMFROMGXGOXONK-ZWUHOBOKSA-N 457.325 0.476 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc(-c2cnccn2)c1 1798586371 NKPRKOSOZWUZCN-JHDGKUDLSA-N 472.310 0.340 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H]1NC(=O)NC1=O)C2 1799220012 FHIMWSSTWITZLB-ZWUHOBOKSA-N 473.442 0.370 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 1799986690 XQYXAWFBSIJJOC-ILOCAZANSA-N 481.594 0.225 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(c3cccc(OC)c3)C1)C2 1800973384 HUDDLRIXMHGRQI-NESBCBRFSA-N 479.961 0.892 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(C)(C)NCCC#N)[C@@H]1c1cccnc1 1807151623 WGGBCQQJAVXPQR-RXVVDRJESA-N 457.579 0.742 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365462 KEZRPEWJYFYWRU-DYESRHJHSA-N 488.288 0.577 50 20 JCGD CC(=O)NCC(=O)N1CC[C@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1807452970 LMLCJGVNOSBDMO-ZJSXRUAMSA-N 495.584 0.570 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)CC1 1807700133 UAQQIXRVXOYMOU-UHFFFAOYSA-N 492.385 0.757 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808417902 RZBOPMSHERKZCB-WHTRTPITSA-N 497.556 0.373 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1)[C@@H](F)Br 1808660969 FNXMVONWRPCPGL-IACUBPJLSA-N 467.232 0.503 50 20 JCGD Cc1nc2ncccn2c1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1809301241 OSMLFMXPPMYCCS-UGKGYDQZSA-N 484.325 0.746 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@@H]1c1cccnc1 1810302102 GEHAZVQPAYJZKB-MGPUTAFESA-N 485.508 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1 1813351023 LZFXYVJVXLTWBL-BEFAXECRSA-N 460.564 0.371 50 20 JCGD Cc1nccn1[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813491279 XKZYXPRNROTFMI-QGCDCVKKSA-N 461.331 0.847 50 20 JCGD CC(C)c1nc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)no1 1815350171 HWSVXVWXDONCTB-AWEZNQCLSA-N 469.332 0.798 50 20 JCGD Cc1cc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nn1C 1817473959 IGXPYWAKBIPBHL-LJQANCHMSA-N 450.308 0.680 50 20 JCGD Cc1nnc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)s1 1817571401 NUQQIHFTUTTZDJ-INIZCTEOSA-N 454.321 0.798 50 20 JCGD O=C1CCc2ccc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)[nH]n3)nc2N1 1817810675 RSQNUMGUCNDWHH-LJQANCHMSA-N 488.313 0.989 50 20 JCGD Cc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c(=O)[nH]c1C 1825442490 ALVYZBQHSSABMX-HXUWFJFHSA-N 466.347 0.614 50 20 JCGD O=C(c1nc2ccccn2n1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827054521 DGPWPCVQNGHLQG-HXUWFJFHSA-N 461.331 0.956 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828938964 HNXZVLUHXNSUBV-UWJYYQICSA-N 465.363 0.890 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCSC(=N)N)C2)C1 1830537847 QGBBXHRZEPSKKP-BLLLJJGKSA-N 451.387 0.491 50 20 JCGD O=C(CCN1Cc2ccccc2C1=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732451 YHDXIUBMGDZZEN-XMSQKQJNSA-N 465.934 0.089 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733801 TZARJDMKHULYSQ-XMSQKQJNSA-N 480.949 0.578 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NS(=O)(=O)CC)C2)C1 1831640946 TXKYJKJLIIRMPN-MPGHIAIKSA-N 453.989 0.178 50 20 JCGD O=C(Cc1ccc2c(c1)CCC2)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832503601 GNFCPAWEKXPTRK-SANMLTNESA-N 478.354 0.168 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1834800275 CIKAEJCYIHXLJX-UHFFFAOYSA-N 492.385 0.824 50 20 JCGD Cc1cc2nnc(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)c(C)n2n1 1835339127 DNUYNCIMXGJUJH-KRWDZBQOSA-N 463.970 0.526 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(O)cc4)CC3)C2)C1 1837456695 PQCHQLBXDFWMEP-DEOSSOPVSA-N 495.536 0.193 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3CCCC4)C2)C1 1837461519 XCIIEBQSICXJBO-SANMLTNESA-N 493.564 0.948 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1 1837715209 CDDWPUVTYWVWJR-LVZGSSTFSA-N 457.600 0.823 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cncc3cnccc13)CCO2 1838463372 HEYNOCPUIOQQCT-DEOSSOPVSA-N 491.508 0.012 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CN(C)C3)C2)C1 1838528286 OGMSMPVPNDPDKI-JOCHJYFZSA-N 476.486 0.152 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3)C2)C1)NC(=O)NCc1ccccc1 1839054407 XEPUTWRJQQDQDM-QHCPKHFHSA-N 486.529 0.091 50 20 JCGD O=C(COC(=O)C(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200645 NSMIWLDCFXBZFQ-ZWNOBZJWSA-N 465.194 0.239 50 20 JCGD Cc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839312124 FOXTWJTWGRLQPH-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCNC(=O)C3)C2)C1 1839743904 DFHKMTWEQSDKNS-JRDZDNNQSA-N 488.491 0.854 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C2)C1 1840150143 GKUUZNVRCGQLEY-NRJQMVOHSA-N 471.982 0.488 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1840152757 SFBNNUNBVWUKAM-JLTOFOAXSA-N 455.895 0.177 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1 1840266728 FHSGQXJYRPTNQS-XMMPIXPASA-N 483.525 0.094 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)CC1 1844265616 WKONABDDRMBJDP-UHFFFAOYSA-N 458.519 0.559 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)CC2=O)c1 1846383481 FMUTWTQFAGHLDU-KRWDZBQOSA-N 471.558 0.625 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2 1846386001 TVCSUYBVEADQJI-UGKGYDQZSA-N 457.575 0.198 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1 9930857 SGPRKPKUKQSUCB-ZDUSSCGKSA-N 463.965 0.710 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CNC(=O)c1cccs1 725740125 BHQQQSXTEUCPGI-AWEZNQCLSA-N 470.598 0.726 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(Cc2nc(O)c3ccccc3n2)CC1 725871938 IOSNLUJADJIVML-UHFFFAOYSA-N 453.459 0.217 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)C(=O)NC(C)C)c2c1 744447061 UOOHLKKVYVSYDJ-UHFFFAOYSA-N 451.505 0.257 50 20 JCGD Cc1ccccc1C(=O)NNC(=O)[C@@H](CCC(N)=O)NS(=O)(=O)c1ccc2c(c1)OCCO2 769682280 MWOISQRHFIIHEJ-MRXNPFEDSA-N 476.511 0.140 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)CC2)cc1 912920727 AEOQPUHKIQQHMP-IAGOWNOFSA-N 494.614 0.937 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)Cn2cc(Br)ccc2=O)ccc1Cl 914877489 XXFDTKZSPGYHMF-UHFFFAOYSA-N 463.697 0.373 50 20 JCGD Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)cc1 919885255 LDLPPHXIBKCLOA-INIZCTEOSA-N 480.568 0.951 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCNS(C)(=O)=O)c2)cc1 920400624 PXOMSMCTPUTKHZ-UHFFFAOYSA-N 470.529 0.196 50 20 JCGD CCN(CC)CC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 920436419 KRUQLUUKMUOZSE-INIZCTEOSA-N 456.565 0.442 50 20 JCGD COCCCNC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1 920862530 QDZGQHIVTFPQLB-UHFFFAOYSA-N 470.548 0.616 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4c3OCCO4)C2)C1 1777836700 BZUOCHNUZPPRPT-QHCPKHFHSA-N 467.482 0.214 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1 1778664197 UGMXHKMXNNSXDH-QFIPXVFZSA-N 483.916 0.972 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1 1780388283 NBPHNFUEIKHXFZ-HSZRJFAPSA-N 476.497 0.023 50 20 JCGD CC(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968374 FFTBTUDLDSCWGG-QHCPKHFHSA-N 461.563 0.588 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1cncn1 1780968471 CTGLXAUMMKCKGW-JPYJTQIMSA-N 484.561 0.015 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1781291106 KBYPNZGPGXCYMV-ZJBJCVSYSA-N 467.950 0.979 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1782105487 YIZVRNAWBZEJRL-OAQYLSRUSA-N 463.491 0.425 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cnc4c(F)c(F)ccc4c3)C2)C1 1782468696 YRAYZMQTIRYHPU-DEOSSOPVSA-N 481.264 0.950 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1782731094 HBMGIGCQJSRDMN-QFBILLFUSA-N 455.328 0.904 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1783616180 RJLCIBPMCNZFFP-ZOZBEKFXSA-N 490.395 0.970 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783934854 IIFMIDZJPUVXDF-HXUWFJFHSA-N 453.927 0.560 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(N4CCOCC4)n3)C[C@@H]21)[C@H](O)CCl 1784090968 RSULKXYZNFOICV-ONIAQPFYSA-N 452.939 0.111 50 20 JCGD CO[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)c1ccccc1 1786979504 QZKPTSDITDJKEY-JKLQHZFJSA-N 452.316 0.347 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-c4cnccn4)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786984885 VCANMNURVURMNL-SSPYTLHUSA-N 486.337 0.731 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc[nH]n3)[C@H]2C1 1787219661 PODXSFZRWXLJAV-XUXIUFHCSA-N 456.931 0.530 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccncc3=O)C[C@@H]21 1789221793 FGTYQEHZSCPQFF-QSFXBCCZSA-N 499.480 0.370 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[S@](=O)c1ccccc1 1790598094 ZFWVBHVQIMVVPH-ABTNWWTDSA-N 484.383 0.156 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]31)C2 1790686411 SBLFEQOYNYFSHK-OIDVLUPKSA-N 482.965 0.202 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(F)ccc1Br 1792689781 WXOANLIHEITPIK-HBCWATKFSA-N 491.122 0.785 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(Br)ccc1O)C2)[C@@H](O)CCl 1792979128 WFQDEYXQEMIKKR-RBNVPPIJSA-N 461.740 0.887 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1OCC1CC1)C2)c1cccc(B(O)O)c1 1795737335 SRKSKFJGHYGJGV-RMFSNUHRSA-N 465.315 0.067 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)OCO3)C2 1796442047 PFDVSQGQXTWLDO-GSBKIRKESA-N 467.482 0.753 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2 1796889549 CDMPVVQUAMMZSD-PZBKIMLWSA-N 490.561 0.644 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1797303788 BCONRCNLKYLJHG-CURYNPBISA-N 495.621 0.452 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1n[nH]c3cc(Cl)ccc13)C2 1797753167 WEYJMRFPMKNJQW-NGVSDPCNSA-N 497.943 0.661 50 20 JCGD COc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799094788 KTVREPKJKDNOHG-HATOLVCRSA-N 496.568 0.640 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1csc3c1c(=O)n(C)c(=O)n3C)C2 1799268951 OOHFRYVVOXFTKJ-LOUJCGABSA-N 482.990 0.448 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cc([N+](=O)[O-])c1 1799629060 RXGWFPWZUPNEBK-HBCWATKFSA-N 451.455 0.310 50 20 JCGD CNc1nsnc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1802481569 XCWMRLRWCZSWNU-RDTXWAMCSA-N 460.564 0.667 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CC[C@@H](N)C(N)=O)[C@H]1c1cccnc1 1803010105 ZNIYSJGBPIEQLW-JWDQPFGJSA-N 454.369 0.711 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCc2cn[nH]c2)[C@@H]1c1cccnc1 1804502862 ZNHCTQCQIIZRMY-UWJYYQICSA-N 462.514 0.756 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808205177 VTLCWCPSPGUPCM-DZFGPLHGSA-N 479.371 0.108 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1)C(=O)C(=O)O 1808678933 PZIQFKSJSJEMQA-MRVWCRGKSA-N 459.272 0.321 50 20 JCGD O=C(/C=N/N1CCCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810284561 PUUBAOUCHYLKSS-MYOSFUKOSA-N 463.347 0.553 50 20 JCGD Cc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810293194 AVUDPCKTHUEROM-JXFKEZNVSA-N 462.514 0.755 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1 1810303420 RVZJULFOZUZCNY-HTAPYJJXSA-N 475.509 0.262 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1ccc(-n2c(O)nnc2O)cc1 1811423633 DTSJCXAGOHXOMH-RYQLBKOJSA-N 486.916 0.993 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc(O)ccc1O 1811894551 HIGXDQZUQHJZMU-JTSKRJEESA-N 461.283 0.806 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1ccnn1 1812397247 FIDMRLXWZVIWCI-SIXWZSSISA-N 463.502 0.252 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813074918 WTHIKFRROZLHAE-BQRYGKNWSA-N 451.593 0.619 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2C(=O)C=CC2=O)n[nH]1 1815472155 OTFQJRHETKFHQO-OXVLKEGXSA-N 494.512 0.851 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)NC2)[nH]n1 1819400839 VFMKJFILAUJVJL-LRDDRELGSA-N 454.491 0.240 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1)[C@@H](F)Br 1820932248 FHTSGZZDXHMXQA-BXKDBHETSA-N 456.209 0.817 50 20 JCGD Cn1ncc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1Cl 1821005593 LTBBGRHYRHCTBN-GFCCVEGCSA-N 459.724 0.749 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1825999969 HJFOTSRVBXUAMW-JOYOIKCWSA-N 452.924 0.621 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826083353 LWJNENWPSCNNIX-NEPJUHHUSA-N 459.594 0.109 50 20 JCGD CN(C)CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828854590 SAVSGNDRWUGEFK-GCJKJVERSA-N 466.966 0.600 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)Cc2cscn2)CC1 1828927056 YOCMJYMINDZTSO-VQTJNVASSA-N 485.614 0.945 50 20 JCGD CC[C@H](Br)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(O)O)C2)C1 1829316074 SWPRDIUYPYXENA-HRAATJIYSA-N 498.374 0.923 50 20 JCGD COc1ccc(-c2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)n[nH]2)cc1 1830727692 BJAGPOVLERFLIZ-SIKLNZKXSA-N 478.933 0.755 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(N2CCC(NC(=O)C(O)O)CC2)CC1 1833221453 KZVASOQIMYUJTM-UHFFFAOYSA-N 464.475 0.016 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)CC2)CC1)[C@@H](O)CCl 1833312427 UXMAZMVLVQHFHA-VABKMULXSA-N 493.048 0.793 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833597192 VZALEWJCSLYNJN-FQEVSTJZSA-N 473.979 0.820 50 20 JCGD CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1834793482 AGAQYNXLYIMQAH-UHFFFAOYSA-N 463.970 0.868 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc2ncncc2c1 1835584305 FOVDOFBAUKEHEJ-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1 1835840207 FXBDLEJEESNAJN-KSSFIOAISA-N 475.428 0.740 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1C 1835926975 AOYPTBOIHAVDJN-RUZDIDTESA-N 466.343 0.296 50 20 JCGD C[C@@H](Sc1cccs1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938096 KREHEEZXXCEEEJ-ZHRRBRCNSA-N 490.412 0.679 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](N)Cc3cccnc3)CCO2)C1 1836506189 SDTZXMIXBJJVHL-ZWOKBUDYSA-N 469.380 0.581 50 20 JCGD Cn1ccc2cccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c21 1837459245 NGPAIHZIPPJWEE-VWLOTQADSA-N 492.536 0.561 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)c(F)cc3F)C2)C1 1837459981 PZYYUJJOUWKHRU-QFIPXVFZSA-N 493.442 0.486 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cnc1Cl)CCO2 1837859236 ZHRDWZRAXBBHBG-FQEVSTJZSA-N 471.917 0.317 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1839146299 MXTWCYQKKJWWPN-DJJJIMSYSA-N 454.936 0.843 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1onc3ccccc13)CCO2 1839547922 VYQWLSKYMLYZDZ-JOCHJYFZSA-N 459.503 0.271 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)nc2nccn12 1839550696 ZCCFVMZGQHNAFX-KDOFPFPSSA-N 470.299 0.798 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839659502 MWHJRPGVLIOYSY-MZNJEOGPSA-N 482.541 0.029 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CNC(=O)O3)C2)C1 1839742240 TUMGVIOWIKOSSV-JZHCSEKISA-N 476.436 0.437 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1 1839965494 ZSWBLWDKYGTGCC-HBUWYVDXSA-N 463.373 0.324 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840103558 HBTMSIVIGVSVAS-DNVCBOLYSA-N 460.369 0.486 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263454 GXXHLVBNTUQTLT-PBHICJAKSA-N 490.561 0.430 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cccc(B(O)O)c3)CC2=O)c1 1847213626 KUSIWYHCFXSIQX-WTNAPCKOSA-N 477.326 0.244 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)ccc2Cl)C[C@@H](C)O1 15639683 IGDINWIXSYZJQL-MBNYWOFBSA-N 493.991 0.334 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)C1 16225124 HHGRTICBUZFJNA-INIZCTEOSA-N 461.500 0.790 50 20 JCGD CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 19199900 MGURWKRVCXVGJI-UHFFFAOYSA-N 475.571 0.842 50 20 JCGD O=C(NNC(=O)c1cc(Br)c[nH]1)c1cccc(S(=O)(=O)N2CCOCC2)c1 28717436 BSIMGXLFDSCWCS-UHFFFAOYSA-N 457.306 0.873 50 20 JCGD CN(C)CC(=O)NNC(=O)Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O 727369353 KPYOGRDODHZDPT-UHFFFAOYSA-N 489.536 0.165 50 20 JCGD CCn1nc(C)c(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1C 727604933 LQUVOCSVYCWLHF-UHFFFAOYSA-N 450.569 0.677 50 20 JCGD CCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 728213976 KGUHYZAMCSZJGK-UHFFFAOYSA-N 481.600 0.678 50 20 JCGD O=C(COC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)NNC(=O)[C@@H]1COc2ccccc2O1 728334326 XROVDINEACCQEI-SFHVURJKSA-N 467.394 0.925 50 20 JCGD C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)C2=O 728845653 OBGXFVQKLQRFGN-CMJOXMDJSA-N 471.562 0.977 50 20 JCGD CCCOc1c(Br)cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1OC 729276966 PNSYVEXGRBRTMT-VIFPVBQESA-N 452.327 0.945 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCN1CCN(C(=O)OC(C)(C)C)CC1 744896301 YPCJISHLUPLPRE-UHFFFAOYSA-N 497.622 0.785 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CS[C@H]2CCS(=O)(=O)C2)c1 747405755 KVUCMFFUQCKNPU-AWEZNQCLSA-N 463.603 0.398 50 20 JCGD CSCC[C@H](C(=O)NNC(=O)CNC(=O)c1ccco1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 751204154 DYETYNBPLAGSJK-HZSPNIEDSA-N 450.517 0.454 50 20 JCGD C[C@@]12CCC(=O)N1[C@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N3CCOCC3)cc1)CS2 863950038 MQILDOYSKXVZIY-LAUBAEHRSA-N 496.611 0.242 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O)N[C@H]1CCS(=O)(=O)C1 919884491 GVQZEZAMJANQKY-LBPRGKRZSA-N 463.493 0.195 50 20 JCGD O=C(CSCC(=O)Nc1cccc(Br)c1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 920212383 HWZQIFFJDGINPQ-LBPRGKRZSA-N 479.378 0.638 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)c(C)c1 920297360 CMIJRJONWWLBBP-CQSZACIVSA-N 468.557 0.803 50 20 JCGD O=C(NNS(=O)(=O)c1c[nH]c(C(=O)N2CCCC2)c1)c1csc(N2CCOCC2)n1 1248558275 JDORBBCWSLJGIR-UHFFFAOYSA-N 454.534 0.167 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3[nH]ncc3c2)C1 1778941677 PMQMEXRTZWYSFW-VGOFRKELSA-N 457.535 0.458 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1occc1Br)CCO2 1779030740 WCKHMHTYTXTSLU-IBGZPJMESA-N 478.303 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3c(F)cccc3F)CCO2)C1 1779032187 FXIAQKULWSLUBA-QFIPXVFZSA-N 459.453 0.650 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)CC1 1780774954 QFQVWXXVJQXTNS-SZVBFZGTSA-N 477.375 0.355 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3csc4c3c(=O)n(C)c(=O)n4C)CCO2)C1 1781218722 SCTARLRAWIWBEQ-LHSJRXKWSA-N 482.990 0.689 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1 1781769751 FIQRRFXOKYZJLI-OAQYLSRUSA-N 457.223 0.171 50 20 JCGD COc1ccc2c(CC(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)c[nH]c2c1 1783932770 DSTGZKBLUBCJEO-XMMPIXPASA-N 471.558 0.922 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c1 1784449028 GHHUTEPTJMNULU-NLFFAJNJSA-N 497.600 0.929 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cscn3)[C@H]2C1 1787038626 ZBNUNGLRZDZAAI-NGTHKXITSA-N 458.544 0.799 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(S(C)(=O)=O)CC3)[C@H]2C1 1788111067 JGKDYIHXXNWWNE-NXOAAHMSSA-N 494.452 0.811 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc[nH]3)[C@H]2C1)NC(=O)NCc1ccccc1 1788806546 WXFUJMCRMQHZRE-ZJOUEHCJSA-N 468.558 0.954 50 20 JCGD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)N1CCN(C)CC1 1790438646 USCPRYFIYSDGGH-GOSISDBHSA-N 464.375 0.750 50 20 JCGD COc1cc(F)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791885851 JYOJSEMMGHTKGE-ZRCAFCQKSA-N 456.279 0.421 50 20 JCGD COc1ccc([C@H]2C[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1 1793300613 DEVWFUHIVPOZJX-LBQWBERBSA-N 458.559 0.761 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)C2)c1cccc(B(O)O)c1 1795737854 ZXQLHPFZCSNRRZ-YNKYUYGSSA-N 470.281 0.652 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ncsc13)C2)c1cccc(B(O)O)c1 1795739189 QMQQVNZKVMRUFG-CCWDJLKJSA-N 451.313 0.493 50 20 JCGD Cc1ccc(NCCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(C)c1 1797821115 IPELLGLMCIUOOF-IRJINJETSA-N 465.359 0.689 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2sccn12 1798414809 CRQSBVRTBUCENO-FVCICTRLSA-N 450.593 0.811 50 20 JCGD CNC(=O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800433539 QYPMJPLLZDCOKC-RCJHGTSTSA-N 452.349 0.718 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1801012720 HKEHXVJUVMWBLL-SQIWFWNDSA-N 475.496 0.834 50 20 JCGD CN1CCC(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1802644130 PTHXOAUYWXNFQJ-XUZZJYLKSA-N 464.375 0.813 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1803139123 SXYIBVSTAVBTBH-TVFCKZIOSA-N 483.997 0.929 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1804577409 MCXYHUURAJAZBX-REWPJTCUSA-N 461.331 0.595 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(=O)OC(C)(C)C 1806722510 WDMJZSZCCQNUOW-UGKGYDQZSA-N 496.373 0.948 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807360903 MBVOGXBQDMZVPR-WGGBDISSSA-N 473.342 0.977 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CS(C)(=O)=O)[C@H]1c1cccnc1 1808415551 YDAVFVPYWPTVKP-AMZZFQKZSA-N 474.543 0.266 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1 1813072211 BRPIYWYDEGVWGT-KSSFIOAISA-N 473.452 0.566 50 20 JCGD Cn1cccc1C(=O)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813474418 DYJYIKBDBKTNFU-GHTZIAJQSA-N 460.299 0.302 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c[nH]c(=O)cn1)CC2 1817281190 APPYPWHCWHFZHX-YCBFHKDISA-N 468.499 0.586 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470037 GNMGJMUNWARXHU-GOSISDBHSA-N 455.324 0.558 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1cc2n(n1)CCCNC2=O 1818910264 LXMCRZIQMPTKPI-NOZJJQNGSA-N 452.924 0.299 50 20 JCGD Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1821309250 BTQSRFORUUAHFR-CQSZACIVSA-N 452.301 0.061 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1 1822416571 IICWHBDIUMDLJE-LSDHHAIUSA-N 454.553 0.352 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc2n(n1)CCNC2=O 1823002209 BCWMAODCBAROCA-JMCQJSRRSA-N 471.312 0.999 50 20 JCGD C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)CC2 1825640570 BAFSPALEDXPSHX-YUMQZZPRSA-N 466.321 0.883 50 20 JCGD Cc1nn[nH]c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551808 UVEBVQQJTMYGTN-JTSKRJEESA-N 490.948 0.779 50 20 JCGD C=C1CC(C(=O)N2CCO[C@]3(COCCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)C1 1829670641 HDJVPDJDMDZKEC-VWLOTQADSA-N 485.585 0.755 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1830545816 NFPGRMWYMQKWDH-MLGOLLRUSA-N 462.370 0.384 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726955 YBELDZUDKLGCLI-BEFAXECRSA-N 450.841 0.703 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(=O)n3O)CCO2)C1 1833478730 YHOYQQBMIDBYJO-UGSOOPFHSA-N 458.309 0.329 50 20 JCGD Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(C)s1 1834797415 JLJRZETVXFMKMK-UHFFFAOYSA-N 484.431 0.868 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccc4c(c3)CCO4)CC2)CC1)c1ccc(B(O)O)cc1 1834799329 WXUNQKGOPPZDQS-UHFFFAOYSA-N 491.397 0.729 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C#N)CC1)CCO2 1835340958 KHJDEEBXDCSTJO-YCRPNKLZSA-N 470.954 0.879 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)N1C[C@H]2C[C@@H]2C1 1835678156 POVPBAQLKWFZKL-GUDVDZBRSA-N 462.639 0.271 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737478 XNRYJHLZVRRKBK-QGZVFWFLSA-N 495.584 0.733 50 20 JCGD CCC1(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)COC1 1835738264 QGWHPRZOVITEEV-UHFFFAOYSA-N 458.563 0.297 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1835796155 SFWAUBXWBMDTIO-GUYCJALGSA-N 499.385 0.857 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cncc2cnccc12 1836088336 JIENAMVLXZHQTI-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837627350 SPWCVAFISTWIIK-IFXJQAMLSA-N 469.336 0.508 50 20 JCGD O=C(c1nc(O)n2c1CCCC2)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837759079 OOIFMDUMVYRYQF-RDTXWAMCSA-N 475.315 0.686 50 20 JCGD O=C(c1cc(Cl)ncn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1838259197 SUILBDFYBWEWBA-WFASDCNBSA-N 451.680 0.891 50 20 JCGD O=C1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](Br)Cc4ccccc4)CCO3)C2)N1 1839801938 IOLUXFMWDDVFPX-NJNPRVFISA-N 494.386 0.728 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1 1839965212 QQLVYGQKAPNDMK-KKSFZXQISA-N 499.406 0.917 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1839966464 FPKUQNVHCZZNAQ-KXBFYZLASA-N 471.352 0.909 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1840059703 NDITVFYJPKALRR-LAPQFRIASA-N 496.388 0.617 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CN(C(=O)OC(C)(C)C)C3)CCO2)C1 1840869003 ZFBKBHHDUSXRFH-HTAPYJJXSA-N 489.997 0.954 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCNC(=O)c2ccccc2)C1 1846955925 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CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827058251 VQXGEDDYAVLQOF-YADHBBJMSA-N 488.346 0.095 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)CC1 1827676058 CXHUDZNHHHPZHY-NRFANRHFSA-N 491.419 0.025 50 20 JCGD O=C(c1ccc(Br)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731409 LIDSCUIOLUMUPQ-WMLDXEAASA-N 462.728 0.514 50 20 JCGD CC1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CC1 1831107636 PJKALGPKMWQIEX-AEFFLSMTSA-N 450.349 0.865 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnco3)CCO2)C1 1831927868 VXTQNLMVEYNPOY-VBKZILBWSA-N 472.926 0.877 50 20 JCGD CC(C)N[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(C)C 1834787540 JICIOIBWZPAPCN-QFIPXVFZSA-N 487.649 0.893 50 20 JCGD CCOc1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1834797539 WDTMRGWVKNZHMG-UHFFFAOYSA-N 481.362 0.054 50 20 JCGD Cc1ccccc1NCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835865036 ARLXNSWJNKZSBM-DEOSSOPVSA-N 482.541 0.176 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccncc3O)CC2)CC1 1835875941 VIZRZNAPISNTOX-UHFFFAOYSA-N 467.530 0.285 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836337834 XLNCGROGRLQNEM-KRWDZBQOSA-N 484.022 0.063 50 20 JCGD O=C1COc2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)cc2N1 1836992547 KUVWSPWNPKGJNJ-LPHOPBHVSA-N 486.294 0.778 50 20 JCGD O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)CCO2 1837297444 UOMVYYKFPPAXQE-RBUKOAKNSA-N 458.298 0.981 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837434218 RFEMODGWXFTRIF-HRAATJIYSA-N 453.923 0.072 50 20 JCGD CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1838990572 IJMVVKVNEUORKT-XMMPIXPASA-N 467.526 0.631 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CCC3)C2)C1)NC(=O)NCc1ccccc1 1839054792 LQYMKULVFVXFGS-RUZDIDTESA-N 487.601 0.979 50 20 JCGD O=C(c1cc(Cl)ncn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200855 QYJFAPDTVUVWPC-IUODEOHRSA-N 451.680 0.891 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)ccc1F)CCO2 1839295859 UVQUBNNGGTYPSL-OJLHXUGZSA-N 487.488 0.735 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840037359 YPTCOFVIQILQRQ-DJJJIMSYSA-N 457.369 0.819 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C)CN(C(=O)OC(C)(C)C)C3)C2)C1 1840153114 DYPSJUBEUJKQMP-KSFYIVLOSA-N 489.997 0.954 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1840154011 HZXVAZNSXNMQGX-PGRDOPGGSA-N 484.933 0.160 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@]3(F)CCCCC3(F)F)C2)C1 1840184564 VMNXPSRMEYCKMO-WOJBJXKFSA-N 478.512 0.733 50 20 JCGD COc1ccc(Cl)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840186767 DXECYHQPUTXBSB-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCO2)C1 1840887805 DHRVQACSDFCKTH-UZLBHIALSA-N 473.885 0.987 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(C(=O)OC)cc3)CCO2)C1 1840958717 WOASFGJYXNZSQY-AVRDEDQJSA-N 484.933 0.562 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cncc(S(C)(=O)=O)c2)C1 1842189091 RQARVKLYOMVZIW-ZVHZXABRSA-N 472.527 0.436 50 20 JCGD O=C(c1nccn(Cc2ccc(F)cc2)c1=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013615 PUCAIKDCFWAPGB-UHFFFAOYSA-N 490.300 0.241 50 20 JCGD COc1ccc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c([N+](=O)[O-])c1 1845260227 HRMAWDPOPQMZKS-UHFFFAOYSA-N 468.470 0.662 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCC13CN(C(=O)c1cnccc1C(=O)NN)C3)C2 1845862727 IZHXAAVBZQKGMK-OAHLLOKOSA-N 495.540 0.138 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)CN(CCO)CCO)C1 1846034740 ZMQCETYDKLOEHQ-SFHVURJKSA-N 468.392 0.483 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846534871 MBOYRRVAKDWANH-IBGZPJMESA-N 497.361 0.043 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2 1847090505 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Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(F)c(S(=O)(=O)NC(C)C)c2)n1 728724495 ZBJMBJHFFNCKGA-UHFFFAOYSA-N 472.520 0.824 50 20 JCGD CC(C)CCOc1ccc(C(=O)NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)cc1 749354377 UMNNPMWLIZEGQC-UHFFFAOYSA-N 455.581 0.633 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(Cl)ccc2O)cc1 802586853 HOMBVHSGGMAARX-UHFFFAOYSA-N 455.876 0.962 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1ccc(S(=O)(=O)N2CCCC2)cc1 914750695 XCDQBOKRKQGTCN-UHFFFAOYSA-N 496.567 0.923 50 20 JCGD CC(C)OC(=O)CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916219811 MQDGGWLPUXMCOS-UHFFFAOYSA-N 470.548 0.312 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@@H](C(C)C)N1CCN(C)CC1 916258213 NTDNFFFZHUBRCH-INIZCTEOSA-N 453.613 0.504 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c2ccccc2c1=O 918119328 ZTQXBISLZHFQEQ-MRXNPFEDSA-N 477.525 0.779 50 20 JCGD CCOCCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 920395588 XRZXMYIZSMFQTH-UHFFFAOYSA-N 471.557 0.976 50 20 JCGD CCN1C(=O)C(=CNNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C(=O)N(CC)C1=S 920976262 UMPYJXLJEKFNMO-UHFFFAOYSA-N 493.611 0.975 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)cc1OC 935522900 OGJDNRGIURCCIF-UHFFFAOYSA-N 464.456 0.110 50 20 JCGD COC(=O)C12CCC(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)(CC1)CC2 1778303217 QEPXJVBKFZYETK-STEQJIOHSA-N 484.358 0.324 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(C)cc(C(N)=O)cc3C)C2)C1 1779011200 GJWRRLPVENCZBB-ISAGNRBTSA-N 494.552 0.980 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779375650 QXWINHNZKRPOMC-FCORRRHLSA-N 469.546 0.579 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1780584725 GRSUQSWHGYNLFN-NTKDMRAZSA-N 489.378 0.407 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1781231792 FJUGWURUFDULJS-VQTJNVASSA-N 485.405 0.749 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)cc3Cl)C2)C1 1781487680 IVXPFOMQTQNJLI-DEOSSOPVSA-N 494.744 0.963 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2)C(=O)C(=O)O 1781543554 VBHZQAOCLTXLJX-NXOUGTEYSA-N 452.335 0.280 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNCP(=O)(O)O)C2 1781997840 ICJDDPGSEDUFGV-LALPHHSUSA-N 456.274 0.009 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(O)c3ccn(C)c13)C2 1782212091 HIWWNISKBUZCBV-HOYKHHGWSA-N 486.573 0.779 50 20 JCGD O=Cc1ccccc1-c1cncc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1782765030 KTZPTAPFTDKSQE-MHZLTWQESA-N 499.332 0.998 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1 1783336675 SGYCPTQUKHKCHI-KLGNFRBTSA-N 467.526 0.554 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(S(C)(=O)=O)CC3)CCO2)C1 1783349885 VGAUBOJINITBMA-MAUKXSAKSA-N 480.425 0.661 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1783537552 TYUJTUWDFPXPGU-VLIAUNLRSA-N 451.365 0.997 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnn(-c3cccnc3)c1)CCO2 1783936862 WBAMBTGHOUUGTH-QFIPXVFZSA-N 455.519 0.084 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C[C@@H]21)[C@H](O)CCl 1784094736 QDCPQEVQNWWLAG-OLGWUGKESA-N 465.978 0.201 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C2)C1 1785152065 RLNIFTFDOOOACO-XMMPIXPASA-N 460.299 0.514 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1 1788607932 WLWITQMOOHUEQQ-ZEWNOJEFSA-N 483.525 0.021 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c4nncn4c3)C[C@@H]21 1788611170 NNWYXCGJXANCEK-IWEFOYFVSA-N 498.931 0.288 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611334 VJHNDIDLLUCFOB-LNMJFAINSA-N 467.530 0.174 50 20 JCGD COc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1OC 1790158718 CWWORSGENWUARU-KNBMTAEXSA-N 486.305 0.430 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1793040943 DVJREONVAKVSMK-QEOTZNIISA-N 471.982 0.965 50 20 JCGD CC(C)[C@@H](S)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793385335 KNSLPEBRFWUNRB-KOUHRCEDSA-N 477.631 0.877 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1 1795258524 BJKVTZWYAAKHAI-RRCBXWCQSA-N 467.526 0.961 50 20 JCGD CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)CC1 1796365184 VJCLSWHUNBWCBO-XGUBFFRZSA-N 463.934 0.872 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncccc2c1 1796805163 GCZUTGULQRSWKR-UPHUGPLXSA-N 460.494 0.750 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)C2 1797748622 MXEUEGWMAGBFSX-XWMYTOBWSA-N 467.501 0.831 50 20 JCGD CCn1nc(C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095222 ZHVJKYYBPZGFRZ-JHDGKUDLSA-N 497.600 0.761 50 20 JCGD Cc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1[N+](=O)[O-] 1799330217 NMYZQDLKUBPKEQ-VPTLXERWSA-N 482.497 0.348 50 20 JCGD CN[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C(=O)O 1800332980 JQCFYXPSRFZQNX-CUKSWYAQSA-N 462.453 0.524 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2 1800754093 FLVVSKQLRPPHAN-AHDPXTMNSA-N 478.384 0.635 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1800907409 FEQBAEPTFORBGG-VPTLXERWSA-N 485.327 0.270 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)C2 1801010592 KGKIRHBZBIGSPM-YZIUBNRHSA-N 457.531 0.142 50 20 JCGD CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1802900443 YXICRPZBGGHYPZ-CZUORRHYSA-N 458.910 0.792 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1805146143 VTBXOIBAEPWXDL-PXNSSMCTSA-N 465.294 0.576 50 20 JCGD CC(=O)c1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n[nH]1 1807360776 CYYZMAJDBJVVSR-LAUBAEHRSA-N 461.287 0.321 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807368791 ZJVXCULYABWSBB-NQIIRXRSSA-N 482.346 0.606 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1 1809745522 SFRAQVQEMDDEFZ-UTKZUKDTSA-N 464.530 0.817 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1 1809781803 SKBRZCCTROZUBY-DYESRHJHSA-N 464.530 0.817 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnc2c(c1)CCNCC2 1812379437 YHHVDFJCFCZTIT-PXDATVDWSA-N 499.380 0.478 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2cnn(C)c2)[C@H]1c1cccnc1 1813070812 LAFFEVRERKLOEY-CVDCTZTESA-N 455.563 0.827 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1814122710 DIQGGRQSEAAPMW-BAGYTPMASA-N 466.347 0.386 50 20 JCGD C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)[nH]n1 1814778896 KJBJGSAZTODJNY-JQWIXIFHSA-N 455.313 0.985 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1cccc(B(O)O)c1 1815360128 NQSYPWCOKFOLCC-GWCFXTLKSA-N 456.102 0.739 50 20 JCGD Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc(O)n1 1817150657 FFVXGRZUHSRQIH-OAHLLOKOSA-N 452.301 0.772 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)COCCO)n[nH]1)NC(=O)NCc1ccccc1 1820925387 FLRGQGPYMBMGRP-IBGZPJMESA-N 487.561 0.757 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CNC(=O)C2)n[nH]1)NC(=O)NCc1ccccc1 1821964400 VYFCMIISFXIRSJ-IEBWSBKVSA-N 496.572 0.884 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052132 PNPAMMDMDJJSLX-UWJYYQICSA-N 457.380 0.905 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1830545810 NFPGRMWYMQKWDH-BLLLJJGKSA-N 462.370 0.384 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830738629 RAMYQLYUWXDQDI-HYFFOGBASA-N 489.997 0.736 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)C1 1830881757 JRUSGKQLYYUIKI-AVYPCKFXSA-N 479.933 0.613 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1831866812 YRRAUHRNRFKVSR-AUSIDOKSSA-N 460.336 0.216 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)CCO2 1832043329 VJTMVVYPFDUHMQ-QHCPKHFHSA-N 499.609 0.119 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1833455030 CWCZBBVIPKOWFN-QHCPKHFHSA-N 485.545 0.020 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)CC1)c1cccc(B(O)O)c1 1834801368 CHQJMHUXJIHCCN-GOSISDBHSA-N 479.390 0.080 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1836484154 ONZDHACMVJZOAB-ZGOLIUOYSA-N 491.495 0.775 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCN(C(C)=O)CC3)CCO2)C1 1836764108 HIYZICSLUQYHQF-NQIIRXRSSA-N 458.987 0.014 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1837116682 NLCZFZQPKDATOJ-KUHUBIRLSA-N 463.362 0.819 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccoc4C3)C2)C1 1837455674 DAUKFIDIWRAYBU-MZNJEOGPSA-N 483.525 0.153 50 20 JCGD COc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837456614 LEJPFFYYYQOSSM-RUZDIDTESA-N 497.552 0.397 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1837711628 MBXGZQPRUBBIMV-OAQYLSRUSA-N 465.579 0.774 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1838472665 WHXAOERMCNSSRN-YWZLYKJASA-N 496.362 0.575 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)C(C)C)C2)C1 1838527270 KTQYHVNBODZNIM-DENIHFKCSA-N 479.486 0.607 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(Cl)c1)CCO2 1838918040 GEIUZUFACVNFRB-JOCHJYFZSA-N 458.707 0.404 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839224781 OPANTHOPIPDBNM-TUGUMKMLSA-N 476.534 0.378 50 20 JCGD O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839470089 XSULFSZJMOMKDC-XMSQKQJNSA-N 476.917 0.519 50 20 JCGD NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1839865621 MTCXZILHLAAYRU-UTKZUKDTSA-N 482.375 0.715 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2)C1 1840030655 RPZZRRJJPGTWBO-KSMMKXTCSA-N 494.383 0.112 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1840059694 NDITVFYJPKALRR-CKNLXJGOSA-N 496.388 0.617 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4sc(C)cn4c3=O)C2)C1 1840152375 GWFMJCDNPJBRRY-FOIQADDNSA-N 484.962 0.388 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1 1840155912 JUKWSWZUYSYKOO-UZLBHIALSA-N 473.885 0.987 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1C(=O)OCc1ccccc1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841354442 AGJNWGVVVDCNBL-OKZBNKHCSA-N 465.934 0.562 50 20 JCGD O=C(c1ccc(N2CCCOC2=O)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012275 XRKCWQDRHWUIAN-UHFFFAOYSA-N 463.299 0.844 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015703 VICPRAANBRWMIU-MZNJEOGPSA-N 469.347 0.653 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)CO2)C1 1846119195 ATRFCUINXXHYOL-CABCVRRESA-N 457.955 0.816 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3ccc(B(O)O)cc3)O2)C1 1847287071 HKYBRSFEMBTCDD-SLFFLAALSA-N 499.373 0.350 50 20 JCGD CCOc1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)cn2C)cc(OCC)c1OCC 21316253 OCANUINSKUYUHG-UHFFFAOYSA-N 454.505 0.943 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(S(=O)(=O)NC2CC2)cc1 25379032 GDXRFQYHVGFGFP-UHFFFAOYSA-N 492.579 0.987 50 20 JCGD CC(C)n1nc(C(=O)NNC(=S)NCc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 726439210 NRJPJHNYHCAPEU-UHFFFAOYSA-N 474.568 0.934 50 20 JCGD C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCC(=O)N1CCN(c2ncccn2)CC1 726710861 VWUARAXHUJCTAH-OAHLLOKOSA-N 459.482 0.452 50 20 JCGD COc1cccc(C(=O)NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)c1O 727164169 HPONQKSDZFJDQB-UHFFFAOYSA-N 451.237 0.068 50 20 JCGD CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 728379396 JWATZDUOKHFQCC-FZMZJTMJSA-N 492.417 0.883 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=S)NCCS(C)(=O)=O)c2)cc1 729157763 IXFCWNQERUTXBF-UHFFFAOYSA-N 486.597 0.650 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)Cn2ccc3ccccc32)c1 729450103 ONVAFYCJHZWZIW-UHFFFAOYSA-N 459.528 0.681 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCCC2)s1 751211348 GNHLGYAQRIDDGK-UHFFFAOYSA-N 454.530 0.636 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1cccs1 785394006 JIBFRWMSTCAKLS-UHFFFAOYSA-N 469.497 0.192 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccncc1 821887167 NHWYXZZPOVRYIQ-CRPZLVSXSA-N 466.541 0.236 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(C)=O)c2)c2ccccc2c1=O 913597155 YRXLDCCDKFLZNO-UHFFFAOYSA-N 485.522 0.749 50 20 JCGD O=C(NCc1ccc(N2CCCC2)nc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916388946 JLKBHANZDUDWSK-UHFFFAOYSA-N 488.570 0.847 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNc3c(F)c(F)nc(F)c3F)n[nH]c2n1 919689601 YJIKXGVMYLZPDR-UHFFFAOYSA-N 460.421 0.992 50 20 JCGD Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)CC2)c(C)c1 919883865 GGBBXDPSRBHGNN-KRWDZBQOSA-N 486.616 0.530 50 20 JCGD CCCCNC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N3CCOCC3)ccc2n1C 920764860 OSMANLDFRRZFHT-UHFFFAOYSA-N 466.564 0.657 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)c(C)n2n1 1777781480 XBEPPRQXKZVZBA-SFHVURJKSA-N 451.325 0.970 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1778237938 PEMDIPDIQPDPAL-UUOWRZLLSA-N 487.362 0.067 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1ON=C(c2ccccc2)O1 1779260080 IZVHMVFTTYKFGV-NIJXNBFTSA-N 493.325 0.229 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372398 GWIWOSGMJRWLIY-YZZKKUAISA-N 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JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)CCN3CCOC3=O)C2)C1 1778159188 UCTNQLZPFHHEIZ-QFIPXVFZSA-N 490.469 0.806 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1n[nH]c2ccccc12 1779017129 ZTNXRMSFJJPQAG-HYBUGGRVSA-N 462.315 0.684 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc4[nH]ccc4s3)CCO2)C1 1779032401 QLBVCJHTCMCQRB-OAQYLSRUSA-N 454.512 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ccc(Cl)cc4n3)CCO2)C1 1779032549 SJFSOFZQZUGCOQ-QFIPXVFZSA-N 483.916 0.744 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnc3ncccc13)CCO2 1779037255 UTJRKMSMDVSUJF-HSZRJFAPSA-N 461.482 0.386 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1snnc1C1CC1)C2 1779373132 DXZLELJGVHHROB-OPAMFIHVSA-N 485.570 0.855 50 20 JCGD O=C(COc1cc(Cl)ccn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779504126 RFPDUIDGRDSQTP-AUSIDOKSSA-N 487.749 0.621 50 20 JCGD COC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780096619 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CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1 1800143943 RYZVZILTWCCPAE-IPPNXFFKSA-N 481.594 0.681 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1800761832 GNQGWFIHZQBTEF-MCYUEQNJSA-N 457.281 0.130 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2 1800839607 STPBIJKNNJDIIK-PNBKFKSVSA-N 451.358 0.429 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(C(=O)OC)cc1)C2 1800982437 GCAKEGHYDVXUJT-HIRMHNASSA-N 454.907 0.695 50 20 JCGD COc1ccc(COCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1 1802518957 XPHJBYNAWVQSCK-WKCHPHFGSA-N 452.316 0.844 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@H](O)c1ccccc1 1806804910 OPFPPHWXJSILHS-ACIOBRDBSA-N 459.311 0.815 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807369815 WSIYAASIKVELPS-PXNSSMCTSA-N 463.303 0.137 50 20 JCGD CNC(=O)CC(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1807454003 RIUIHCIEOLIJLL-GBXCKJPGSA-N 495.584 0.570 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1808712495 ILHAEMXXMBDYRB-VQIMIIECSA-N 477.529 0.886 50 20 JCGD C[C@](O)(C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(F)(F)F 1810294041 HTSHHARSYYUCHM-AUJRIZCKSA-N 480.447 0.713 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccncc2O)[C@@H]1c1cccnc1 1810303231 QXQDPPBDCVXMRQ-MGPUTAFESA-N 461.482 0.814 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@@H](N)Cc2cccnc2)[C@H]1c1cccnc1 1813071949 ZXIYWOCCASYHIQ-QTEQDKRBSA-N 467.574 0.425 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1814170438 SOMCTCBIAHCKDW-QUCCMNQESA-N 467.331 0.670 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815229817 QOIGAXCCRWBBGH-GUYCJALGSA-N 462.337 0.076 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 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NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ccoc13)CCO2 1839586146 LFVSXRFZIDNEOR-DEOSSOPVSA-N 479.493 0.815 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1839962824 RPDIEJUGYFUTRJ-UGSOOPFHSA-N 458.309 0.329 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839964320 NNTJHXMKWMEMRG-RKRZWIQWSA-N 498.378 0.750 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1840035413 QJCFUJMVQCTBHI-VOJFVSQTSA-N 459.293 0.657 50 20 JCGD CC[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CC1 1840056963 BBKHDNUNOSDTEW-KHCICDEESA-N 458.364 0.653 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1 1840184785 AMMBZZDSULDZEB-JOCHJYFZSA-N 480.638 0.268 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1 1840184942 HYUYUCOWZYRKBW-GBXCKJPGSA-N 474.558 0.210 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185050 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C[C@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)S(=O)(=O)c1ccc(F)cc1 728329576 CDRYMCLFEINUSC-SJKOYZFVSA-N 466.443 0.519 50 20 JCGD CCn1c(=O)nc(O)c2c(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)cc(C(C)C)nc21 728722592 GCBQJVIXNVDIEJ-UHFFFAOYSA-N 488.526 0.952 50 20 JCGD CN(C)N(C(=O)c1ccc(S(=O)(=O)N(C)C)c(Br)c1)[C@@H]1CCS(=O)(=O)C1 729170726 IKJSTOHOINQRIW-GFCCVEGCSA-N 468.395 0.805 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)c1 914846297 GKPDHPCGQDZVQQ-UHFFFAOYSA-N 497.599 0.525 50 20 JCGD CCCS(=O)(=O)N1CCC(NC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)CC1 916383918 WKTLRFKEGMLYTF-UHFFFAOYSA-N 462.598 0.599 50 20 JCGD CS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 916567784 NXEKWSJENNZIPG-UHFFFAOYSA-N 496.567 0.255 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)NCc2cccc(S(N)(=O)=O)c2)c2ccccc2c1=O 916626172 VXTNMLHMOBLCFW-UHFFFAOYSA-N 458.500 0.769 50 20 JCGD CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OC)c([C@]2(C)NC(=O)NC2=O)c1 917719808 NVPFTYMRCHWTBR-NRFANRHFSA-N 476.511 0.701 50 20 JCGD 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CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1 1811270055 LXAGSPONLIGMNP-VGSWGCGISA-N 464.530 0.817 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccccc2C(N)=O)[C@H]1c1cccnc1 1811289083 GAOAKCFXRBLJGW-HTAPYJJXSA-N 466.542 0.873 50 20 JCGD O=C(CCc1ccc(O)nn1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1812323946 CZHXPXFVGXXIEB-JPYJTQIMSA-N 475.314 0.209 50 20 JCGD CN1CCN(CCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)CC1 1814581283 QPDZSDGKFFXURY-AWEZNQCLSA-N 486.602 0.005 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccnc3c1OCO3)CC2)c1ccc(B(O)O)cc1 1815343862 STFRJIXQVWGYAH-CYBMUJFWSA-N 466.284 0.486 50 20 JCGD O=C(Nc1cccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356788 RJUOLRTXQMPZIP-CQSZACIVSA-N 465.300 0.082 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cccnc3)sc2C1 1817192521 MJBKQGZHUWRBJL-GJZGRUSLSA-N 459.576 0.393 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ccc(F)cn3n2)[nH]n1)c1ccc(B(O)O)cc1 1817474957 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C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1 1830544494 ZNVAPLWMZLPYMF-IFXJQAMLSA-N 478.384 0.999 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830720355 XWPHKEWJWBMWJA-SFYKDHMMSA-N 481.977 0.641 50 20 JCGD O=C(c1cccc(N2CCOCC2)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732942 COGAHVCPPOQYQJ-KNQAVFIVSA-N 467.950 0.193 50 20 JCGD CC#C[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)c1ccc(O)cc1 1830738343 NPBWHBYCTXKLSZ-XQFWAAQXSA-N 464.946 0.945 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830897476 HLFQWFGELMHJPX-DEOSSOPVSA-N 469.347 0.014 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1831298904 YPBLGMXYTBIJSD-PSHVLCQKSA-N 452.935 0.855 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1 1833306729 ZZLNQWGJXVOHCE-VQTJNVASSA-N 453.967 0.900 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1833483974 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1 1835117865 UERYVRWFWSBWNU-CCVNUDIWSA-N 498.544 0.207 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)COC(=O)C(F)(F)F)CC2)CC1 1835687825 PBOIRLMUGGOCFE-UHFFFAOYSA-N 479.500 0.037 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CC2)CC1 1835738113 FANIDONPDXYNDL-QFUCXCTJSA-N 470.574 0.438 50 20 JCGD COc1cc(F)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(F)c1 1835931743 AJTXWKLCKVOEIZ-QHCPKHFHSA-N 490.268 0.037 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835932062 LQPKHYNKTQDGTF-JGXQXMPLSA-N 494.353 0.549 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461166 PXMOYRBYRHJIED-XMMPIXPASA-N 496.524 0.027 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837869922 VICRBBUHKPYUFI-SFHVURJKSA-N 480.374 0.874 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921125 CHFZKAKCNBZGEN-NRFANRHFSA-N 458.364 0.552 50 20 JCGD O=C(c1cccc(C(F)(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837928691 RFIWCOPZRBGDAJ-GUYCJALGSA-N 451.829 0.770 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1 1839145538 LEPMLYLSTVOKMY-HRAATJIYSA-N 454.955 0.761 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839157668 CFSPXSJISNQDIV-XMMPIXPASA-N 489.573 0.071 50 20 JCGD O=C(Cn1nccn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1839238120 VLDOBZTZHNNXNP-NQIIRXRSSA-N 492.374 0.741 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1839642489 QYHTWQCDSHEUID-QMHKHESXSA-N 492.529 0.930 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1840034920 AUOWTIBQAWIMKV-FZKQIMNGSA-N 457.325 0.355 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)OCCO4)C2)C1 1840152722 RBLZRPHPLGEYLI-IERDGZPVSA-N 454.907 0.782 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnc4ccccc4c3)C2)C1 1840182802 VIIPTHCYIORPPT-SANMLTNESA-N 497.596 0.997 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1 1840185960 XNDJIJBQPVWBNK-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840333527 BOROXOCFEAYHRS-MZNJEOGPSA-N 482.541 0.029 50 20 JCGD C[C@H](Cc1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840471237 SCYWPTRLKCFCOL-WAIKUNEKSA-N 471.514 0.227 50 20 JCGD COC1(CC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CN(C(=O)OC(C)(C)C)C1 1843011288 ORXNLIKKHBXLHV-UHFFFAOYSA-N 487.362 0.209 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c([N+](=O)[O-])c1 1843012224 PZSNZWLSTQETIO-UHFFFAOYSA-N 467.243 0.192 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2 1843417098 VHJRKCOQCUIGSZ-MPNONXCDSA-N 492.580 0.959 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 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O=C(NCCOc1ccc2c(c1)OCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916647239 VXAUSLMTCRQQTP-UHFFFAOYSA-N 492.510 0.459 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NCCCn2nc3n(c2=O)CCCC3)c2ccccc2c1=O 916650265 YEOFGTODUOQURW-UHFFFAOYSA-N 482.545 0.925 50 20 JCGD O=C(NCc1ccc(Cl)nc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 918080277 MAYBLGIRAPJEDP-UHFFFAOYSA-N 453.908 0.900 50 20 JCGD CNC(=O)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1 918235149 JXPNWUIGYNAHJG-UHFFFAOYSA-N 463.516 0.966 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@H](O)CN1C(=O)Cc1ccccc1F)NNC(=O)c1ccc(Cl)cc1 919181592 LWHQFKSJPIEVBD-WMZOPIPTSA-N 477.876 0.988 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(NC(=O)c2ccc(F)cc2)cc1)N[C@@H]1CCS(=O)(=O)C1 919961266 ZHKXVRPHGKBCPO-OAHLLOKOSA-N 470.504 0.758 50 20 JCGD CCN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 920052122 ZAXYRPJAWLIOTA-UHFFFAOYSA-N 461.544 0.930 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1 1779030778 HVRORQIPOYMIMV-QHCPKHFHSA-N 467.482 0.100 50 20 JCGD 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XHTQNQXILAJBCC-XMMPIXPASA-N 489.573 0.887 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969937 OMQYJVHBGCMPSQ-HBRDYDSTSA-N 487.557 0.282 50 20 JCGD Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc(Cl)cc1[N+](=O)[O-] 1781999488 IBODZXSTUCEECH-QFIPXVFZSA-N 487.705 0.994 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782212312 RCURYWGNWVSDEV-UZUQRXQVSA-N 483.610 0.787 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)CO2)C1 1783455647 YTNGOLNQURZPDT-QYWGDWMGSA-N 487.981 0.442 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1783616168 RJLCIBPMCNZFFP-GXNBUGAJSA-N 490.395 0.970 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1783687102 PWCBDNUTHDEEPQ-LPHOPBHVSA-N 481.384 0.296 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784091297 ZGSCCPRQCUEFPP-VIQHNZTISA-N 475.970 0.202 50 20 JCGD N#Cc1ccccc1OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1785379766 DXIPWQOTBGUXJK-HSZRJFAPSA-N 464.482 0.079 50 20 JCGD Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1C(F)(F)F 1785526772 JINCBYTVQAVDJO-JQFCIGGWSA-N 480.252 0.026 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccc4[nH]3)C[C@@H]21 1788610174 HUDYEFAVLXRQTB-AXHNFQJDSA-N 463.498 0.469 50 20 JCGD COc1cc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(C)c1 1790205888 FBGRGRNBRLMNPC-NYVOZVTQSA-N 466.343 0.899 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(O)cn3)[C@H]2C1 1791707960 RZHYUITYSXJQBJ-SJQXZKBRSA-N 468.514 0.443 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1793317785 JWEVJHMRBQLHKX-PASOZIPMSA-N 496.536 0.789 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COC(=O)C(F)(F)F)C2 1796891712 HDUDAIADAIXHBD-AIUQWGENSA-N 457.409 0.864 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)NCc1ccco1 1797893427 LQINDRQDONOQQH-QOEYFNNLSA-N 454.321 0.825 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(N2CCCC2)c(F)c1 1798559964 XVRFKOAUDMCJPH-BBIADKPPSA-N 481.333 0.623 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)NC(=O)NCc1ccccc1 1799094979 NQPSQGAQALILKO-XEMDLRDOSA-N 496.406 0.707 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)[C@@H]1C[C@H](O)CN1 1799143388 QYIYZZMURGGKRX-QSMSVPEVSA-N 466.376 0.305 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NS(=O)(=O)CC)C2 1800639976 DPEBYQDTYOTFDB-QNSTZXKLSA-N 454.387 0.077 50 20 JCGD O=C(CCC(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804152384 XOFAENLCYGTZSH-GBXCKJPGSA-N 478.358 0.484 50 20 JCGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1 1804343372 DBSQDEJKWPIPHZ-XEZPLFJOSA-N 452.309 0.471 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1 1805525085 CJBSKFRJGFJOAE-OAHLLOKOSA-N 454.980 0.722 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CC[C@H](N)C(N)=O)[C@H]1c1cccnc1 1807191924 FOBZCKUEDHACQT-WBTNSWJXSA-N 454.369 0.854 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CSc2ncccn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362228 FRJXQHWJFPIJTE-GHTZIAJQSA-N 477.355 0.663 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1 1813072977 IJBCJLNQZWSQAJ-KUHUBIRLSA-N 458.479 0.406 50 20 JCGD O=C(Cc1ccc(O)cn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813496971 YIWKCKMHFIOVHH-MBSDFSHPSA-N 460.299 0.424 50 20 JCGD N[C@@H](CC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1cccnc1 1815339811 QECDJFQQLXXJCN-IRXDYDNUSA-N 465.344 0.534 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(CO)c(F)c1)CC2)c1ccc(B(O)O)cc1 1815347854 SZNXGRIMUKLLRB-INIZCTEOSA-N 469.303 0.994 50 20 JCGD COc1nn(C)cc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815355212 RTBFLGQLHBQYFS-ZDUSSCGKSA-N 455.305 0.105 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2)N1CCN(C)CC1 1822692973 SEGABMZBQINMQL-UONOGXRCSA-N 486.602 0.003 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCc3cnccn3)sc2C1 1826909917 UMHTVIQVVLWLHN-LBPRGKRZSA-N 466.527 0.790 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)CC1 1827048428 RSSGAKYQFTVZKC-GOEBONIOSA-N 450.927 0.905 50 20 JCGD O=C(c1ccc2ncnn2c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052068 NOYRZPAELRDWGN-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)N1C[C@@H]2C[C@H]2C1 1827057927 NUORNJCYKFGKAC-NPWUYRIISA-N 453.392 0.940 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN(C)C(=O)C(=O)O)CC1 1827679364 ZRCNHYIRZCRXMN-BFTFCADCSA-N 488.545 0.283 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(N(C)C)o3)C2)C1 1830538171 XHOGJVNAULHLAD-UGSOOPFHSA-N 459.341 0.842 50 20 JCGD O=C(c1ncn(-c2cccc(F)c2)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725417 OJGIVHGFKUXFQV-JXFKEZNVSA-N 467.885 0.076 50 20 JCGD Cc1cc(C)c(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(C)c1 1831167625 XLIHVNXPXNBVOK-SANMLTNESA-N 496.369 0.441 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1831301325 PLVAXOUFNKFJLN-ZEVJAHDQSA-N 494.353 0.249 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)c2c1 1832742921 QRFXTNXSLWWLKI-SANMLTNESA-N 491.353 0.469 50 20 JCGD COc1cccnc1CCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833796306 TWKOUJAHUWXEDS-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(F)c1 1834007413 ZDFATXIXUPETHI-UHFFFAOYSA-N 484.337 0.408 50 20 JCGD COc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1834509618 UOSSAWCOEDSJBI-UHFFFAOYSA-N 479.386 0.803 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834717814 SOHSGMSSXRRVPY-QGZVFWFLSA-N 494.600 0.766 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCCn3cccc3)CC2)CC1)c1ccc(B(O)O)cc1 1834800656 VZZUSNBPYZBFKC-UHFFFAOYSA-N 466.391 0.834 50 20 JCGD COCCn1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)n1 1834821369 GIQWFPPLKOOMAY-GOSISDBHSA-N 459.341 0.385 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2 1835682460 KQPJPJAARLWGJA-DNVCBOLYSA-N 459.385 0.898 50 20 JCGD COc1cc(C)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835939238 INPQYUMCWYPHRD-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)ccc1C 1835939735 ZDGXFEXDYPENBC-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939989 RPMRGCSXCBARJU-DFBJGRDBSA-N 466.343 0.315 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4=O)CCO2)C1 1837135473 JOXREEWRXAARDW-ZSEKCTLFSA-N 494.342 0.922 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccoc3C(F)(F)F)C2)C1 1837457636 LGNYHQNVBCMDEZ-HXUWFJFHSA-N 497.430 0.681 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1OC 1837460081 TWCULCOKMISCIR-DEOSSOPVSA-N 499.524 0.086 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1ccccc1=O 1837919213 QSBQUZKPIRLFJB-SFHVURJKSA-N 481.358 0.402 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839144851 MGYGKHJVQWNOSG-RKRZWIQWSA-N 453.927 0.594 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839765182 UUFAVLUYXCQBGU-SSOJOUAXSA-N 499.543 0.773 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(O)C(F)(F)F)C2)C1 1839962539 JLJZTXPWMZEVJC-NILFDRSVSA-N 461.275 0.930 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1839964629 XNKCEPHDNDMBSY-ABSDTBQOSA-N 469.380 0.581 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2)C1 1840153919 FSIKZOQJPXXNOL-XFQAVAEZSA-N 477.986 0.952 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840188159 RJOXZUFMMKAODN-BFUOFWGJSA-N 483.393 0.489 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1840381309 VNIWXZGJLGODHS-HOTGVXAUSA-N 452.364 0.590 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1F 1840683267 BZQCJLHKZLCHIT-QFIPXVFZSA-N 466.510 0.277 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840898371 FWJVJRXOGSQEKH-KDLSMAQYSA-N 495.297 0.058 50 20 JCGD C[C@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1ccnc1 1841466957 FSCMSUNSIHJMSK-GOSISDBHSA-N 453.547 0.994 50 20 JCGD COC(=O)CSCC(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038409 ZAJIIAICJLASKM-UHFFFAOYSA-N 477.587 0.442 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2 1846384078 AFPXRERBMMCTEO-UHFFFAOYSA-N 455.515 0.249 50 20 JCGD COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 16785772 JNCLKVNUXQQXBP-CQSZACIVSA-N 473.573 0.456 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc(CN2C(=O)CNC2=O)c1 27229869 SPKHTJIZJFFDNT-UHFFFAOYSA-N 485.522 0.598 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 28663399 KBYNILKBQFHZLO-UHFFFAOYSA-N 495.579 0.505 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2ccccc2)CC1 727056662 IVQHGQXHJMMFPK-UHFFFAOYSA-N 463.516 0.432 50 20 JCGD CCOc1ccc(OCC)c(NC(=S)NNC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)c1 727496384 MILBWGQPAPVSFE-CYBMUJFWSA-N 497.599 0.967 50 20 JCGD C[C@H](C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C)N1C(=O)c2ccc(Br)cc2C1=O 728178165 CJGUNYFVKICTAH-ZYHUDNBSSA-N 458.334 0.926 50 20 JCGD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)C1 731220322 CESSUQDYHRUMIU-CVEARBPZSA-N 464.592 0.531 50 20 JCGD Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)cn1C 750663457 OAOKNNXOKNHODY-SNVBAGLBSA-N 474.337 0.384 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Nc1cccnc1)c(=O)n2Cc1ccccc1 754573279 BPNRZNAUKOBFFS-UHFFFAOYSA-N 492.496 0.302 50 20 JCGD C[C@@H](O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)OCC(=O)NNC(=O)c1cccs1 776971499 YEODUSWWSWFHPB-BFUOFWGJSA-N 491.547 0.933 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)[C@@H]1COc2ccccc2O1 844254562 WAPQRUQZIXYMFK-KRWDZBQOSA-N 453.498 0.277 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)c2)C[C@H](C)O1 912920841 FBDFIDFIGVORFY-MHORFTMASA-N 482.603 0.745 50 20 JCGD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1 916567492 LEQNEKARHVRVSJ-UHFFFAOYSA-N 463.468 0.825 50 20 JCGD COc1ccc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)[nH]c2c1 1777769613 MXNFUJWFSHATOZ-XMMPIXPASA-N 478.509 0.932 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cc(C)[nH]n1)C2 1778090928 HUGWAAQSHKMIOJ-PZOAEKQQSA-N 469.546 0.909 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779036935 JSYFRQTTXFUGNU-JOCHJYFZSA-N 484.469 0.365 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc2snnc2c1 1780043541 POAWFBXTTHHIMZ-XMSQKQJNSA-N 481.343 0.207 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1780785088 JNVJXPLDWQETNM-DXEZIKHYSA-N 477.986 0.376 50 20 JCGD CCc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n(C)n1 1780968539 NCQCLXLYLXYVBJ-VWLOTQADSA-N 497.600 0.772 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C(=O)C1CC1)CCO2)NC(=O)NCc1ccccc1 1780970221 UYTNIGDPYPBAFO-QHCPKHFHSA-N 457.531 0.142 50 20 JCGD O=C(CN1C(=O)C=CC1=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783023098 TYTHZHFTPKQWID-VGOFRKELSA-N 490.354 0.748 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1783458407 KKJFNSILFTZKHU-IALDWUNLSA-N 457.955 0.673 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1 1783540147 SIJRJDJOKKGCEH-APWZRJJASA-N 481.384 0.296 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1=O 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451.332 0.632 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n(C)n1 1807365082 WREOZZVOMJGJPG-LAUBAEHRSA-N 463.303 0.137 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365737 MAOQTHOGQGOOJC-XMSQKQJNSA-N 470.298 0.666 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)C(=O)N(C)C)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807452664 KQPNYYABNNSLRB-IRLDBZIGSA-N 495.584 0.522 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1 1808416548 BEPDDBIPHGQLCW-XMLBAGAUSA-N 492.544 0.555 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1)[C@@H](F)Br 1808652513 YPUHUIUFHTXMOE-BHYGNILZSA-N 491.383 0.508 50 20 JCGD Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c2c1CCC2 1809364826 GTUGZJFKGJEHGW-KSFYIVLOSA-N 488.552 0.936 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)n1 1809974896 GOENATNJJBGVLD-UHFFFAOYSA-N 464.331 0.878 50 20 JCGD NC(=O)c1ccccc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1811279116 IQAYOXNPMOXYDX-PGRDOPGGSA-N 472.310 0.494 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1812865841 YDOOWXNDRRQMTC-QILLFSRXSA-N 487.420 0.601 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)[C@@H]1c1cccnc1 1813030265 AIDLXVSXVKEJOA-INDMIFKZSA-N 469.922 0.836 50 20 JCGD C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1 1815333907 YUHVFMLJQYTYBA-SFYZADRCSA-N 466.321 0.883 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3c(c1)CNC3=O)CC2)c1ccc(B(O)O)cc1 1815344353 VFDJSZQZFYTDDM-MRXNPFEDSA-N 476.323 0.606 50 20 JCGD O=C(COC(=O)C(F)(F)F)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1819610815 HUWNBSZSCPCLSB-LLVKDONJSA-N 471.222 0.154 50 20 JCGD O=C(C#CC1(O)CCCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1819844380 UNJSCBNXDCIROK-KRWDZBQOSA-N 467.356 0.747 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1822417942 SWUSSQUORLBVLU-CYBMUJFWSA-N 481.604 0.635 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cnc3ncccn23)CC1 1828248021 MOFHLVPNUOXLCS-FQEVSTJZSA-N 461.331 0.956 50 20 JCGD CN1CCC(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC1 1830005736 XRSCQVPMALIMPL-WMZOPIPTSA-N 450.349 0.865 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1830535241 KDPOYQMWGQZDLT-MGPUTAFESA-N 483.363 0.299 50 20 JCGD Cc1cc2nc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)[nH]c2cc1C 1830731180 IKCPMSILNZJUSS-UWJYYQICSA-N 450.923 0.849 50 20 JCGD Cc1cnn(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)c1 1832549576 UZFDOFDHCKDSRF-JTSKRJEESA-N 499.996 0.780 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C=CCN3)C2)C1 1832549701 YGIYBGUAVDMIBO-QYWGDWMGSA-N 472.970 0.103 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833572393 FNZKQYTYFHBFHE-UHFFFAOYSA-N 482.589 0.534 50 20 JCGD CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)cn1 1833888730 VGWAMUMDLHOONY-FXZATJRASA-N 482.541 0.848 50 20 JCGD O=C(O)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)ncn1 1834819257 MKPOIQQCZGXSNP-KRWDZBQOSA-N 457.281 0.030 50 20 JCGD COC(=O)C12CC(C(=O)N3CCOC[C@@]4(CN(C(=O)CCBr)CCO4)C3)(C1)C2 1834824646 CWKABWOFIHJMDT-CTWPCTMYSA-N 459.337 0.571 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834824687 GTNQLWPEQQPNTC-YWZLYKJASA-N 483.363 0.441 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)s1 1835927555 SRQPLCHIGXXBQI-HSZRJFAPSA-N 472.372 0.439 50 20 JCGD Cn1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C(F)(F)F)c1 1835936959 LZJVRHDDUPZXQF-OAQYLSRUSA-N 495.263 0.108 50 20 JCGD Cc1cc(F)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1F 1835941100 GUXOPOZSAIIOLP-HSZRJFAPSA-N 474.269 0.337 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3nccnc3C(N)=O)CC2)CC1 1836051492 LPHNDHCPSKUSST-GFCCVEGCSA-N 467.368 0.544 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nc(O)n3c1CCCC3)CCO2 1837759212 WGIALIMBAZPZQO-NRFANRHFSA-N 466.611 0.847 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3O)CCO2)C1 1837814354 KKXYLLPWZNQHTD-KSFYIVLOSA-N 498.964 0.989 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cnc1Cl)CCO2 1837855355 FFIMYCOYKQMMLS-NRFANRHFSA-N 492.895 0.256 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3nn[nH]c3C(F)(F)F)CC2)CC1 1837919081 BQWDKHBELYXRQE-UHFFFAOYSA-N 495.267 0.429 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc[n+]([O-])cc3)CCO2)C1 1838334052 WHXDZDCQNGJRKV-JTSKRJEESA-N 498.964 0.522 50 20 JCGD O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838458078 NVJCWNVCIJATDX-JPYJTQIMSA-N 475.929 0.313 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nccnc3C(N)=O)CC2)CC1 1838510443 WZCHJEDUFYXFKL-OAHLLOKOSA-N 453.927 0.442 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3C#N)CCO2)C1 1839132286 CMSGFIRFCZKDLU-DENIHFKCSA-N 465.934 0.820 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(O)C(F)(F)F)C2)C1 1839150631 RTHCYYXTXLPZTO-ZNMIVQPWSA-N 451.269 0.992 50 20 JCGD Cn1nc2c(c1C(=O)N1CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C1)CCC2 1839583718 OQWRTFKEOHMHNO-OAQYLSRUSA-N 450.612 0.830 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1840148806 VKGOXKLMWBSPDM-WMZHIEFXSA-N 498.960 0.723 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nc1 1840186943 XNVUZDKJKKZNTR-KRWDZBQOSA-N 466.343 0.359 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(F)c1F)CCO2 1840718543 ANLXGSMHDSNGBY-JOCHJYFZSA-N 493.442 0.486 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2=C3c4ccccc4C(=O)N3CC2)C1 1844650427 FJXFAIGOVXUVTE-UHFFFAOYSA-N 472.505 0.773 50 20 JCGD O=C(CN1C(=O)CNC1=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1 1845940561 XHPMQJSTPSGYLZ-OAHLLOKOSA-N 463.332 0.748 50 20 JCGD O=C(CCC(=O)c1ccc(I)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 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453.521 0.593 50 20 JCGD COc1cccc(-n2c(CC(=O)NNC(=O)CNC(N)=O)csc2=NCc2ccco2)c1 915775513 FFWDQBNDYZRRMB-UHFFFAOYSA-N 458.500 0.600 50 20 JCGD O=C(Cc1nc2ncccn2n1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 915808355 FHTHIANUSUOYQS-UHFFFAOYSA-N 454.450 0.886 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)NCC(=O)N(C)C)cc2)cc1 915913214 HXNFRPJWSUELER-UHFFFAOYSA-N 463.516 0.918 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(O)cc1)c(=O)n2Cc1ccccc1 916333781 VNCSPZMHOGLUFT-UHFFFAOYSA-N 476.493 0.910 50 20 JCGD O=C(COC(=O)CS(=O)(=O)Cc1ccc(Cl)s1)NNC(=O)[C@H]1COc2ccccc2O1 916533575 YLBORICKZWKAHS-CQSZACIVSA-N 488.927 0.847 50 20 JCGD CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccc(S(=O)(=O)N2CCNCC2)cc1 917566643 UDDUIKDHCGOGIV-UHFFFAOYSA-N 492.627 0.657 50 20 JCGD COCCn1cc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cn1 918543357 ZSGOANDQMNJRHJ-UHFFFAOYSA-N 452.493 0.017 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCN(c3ccc(F)cc3)C2=O)ccc1Cl 919690549 OQQSRVUOGXMOSL-ZDUSSCGKSA-N 454.867 0.941 50 20 JCGD COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)cc1 919884537 HWGXFSAVMVSHSM-HNNXBMFYSA-N 496.567 0.651 50 20 JCGD O=C(COC(=O)[C@H](CO)NC(=O)c1cccc(Br)c1)NNC(=O)c1cccs1 920652309 BRDYVCGOKNYIIE-LBPRGKRZSA-N 470.301 0.606 50 20 JCGD CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1778077064 FAZCKQOYLGMVAB-GCKMJXCFSA-N 475.970 0.442 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030467 ATHWUVCUGCSZBU-OYHNWAKOSA-N 453.503 0.024 50 20 JCGD CCn1nccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371237 VSACXWKUIDSIDE-XMSQKQJNSA-N 455.519 0.343 50 20 JCGD CCn1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n1 1779371242 WPEKJJCYQKQBIN-XMSQKQJNSA-N 455.519 0.343 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccc3nc[nH]c13)C2 1779373164 JHWNIFMFKUWPLZ-UZUQRXQVSA-N 478.513 0.398 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)N2CCOCC2)C1 1779415480 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CCC(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1781727036 RLEQDVCUABUGBA-HYBUGGRVSA-N 473.574 0.826 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781998436 UMFWWCOUBJOHOT-URKNILKWSA-N 453.142 0.277 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1782040876 HPRPJHSYNYIBMB-HSZRJFAPSA-N 460.531 0.680 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc([N+](=O)[O-])c1OC 1782119377 ZIDFRBZEQRINOT-KUHUBIRLSA-N 457.867 0.655 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1783537749 NGRLRHPFCMXUDM-BMIGLBTASA-N 450.380 0.460 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1783685135 AMIVSSAXVPVJKZ-XSRQCEPYSA-N 457.955 0.816 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1F 1783934550 IAZADJBKALXOHE-RPWUZVMVSA-N 491.564 0.380 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ncsc4[nH]3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980953 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O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ncc(Cl)cn1 1805233029 VVUZIDANUVPLIN-APWZRJJASA-N 465.706 0.838 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807367386 KUYYNZRZJWNAPO-KPDCDPCYSA-N 474.326 0.944 50 20 JCGD Cc1cc2nnc(C(=O)NC[C@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)c(C)n2n1 1809193042 ZZYIZDLEBWDDDD-WZONZLPQSA-N 493.572 0.829 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1 1809778040 ZSXIRKPPFHMFGZ-UZLBHIALSA-N 485.508 0.756 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809978760 OOAFDSJMMRQJDT-NSRYLYFRSA-N 457.336 0.740 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc2n(n1)CCC2 1809979800 BCPCZPNAUWTCNL-XMSQKQJNSA-N 459.315 0.538 50 20 JCGD Cn1nc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c2c1CCC2 1810302470 KIWYIYVYJLDRCX-ZHRRBRCNSA-N 488.552 0.936 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 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CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)Cc2cccnc2)n[nH]1 1818073592 SQLDFVFTAFMAKV-FUHWJXTLSA-N 456.551 0.740 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)C(F)(F)F)n[nH]1 1822444580 ZZVFVGGCMUUBGW-GFCCVEGCSA-N 461.445 0.453 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1823436417 CWRBUUAPWUODHI-PKOBYXMFSA-N 455.324 0.700 50 20 JCGD COCCOCCOCCOCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1 1824187047 XZHHOGKNNPMRHI-UXHICEINSA-N 479.014 0.902 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1 1828832085 XGGIPQKTVMBMQI-KRWDZBQOSA-N 470.253 0.705 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1 1830540133 OPUFORLGQAPPRN-LBTNJELSSA-N 463.373 0.181 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1OC 1830732759 ADKAKCPGJSINEE-IIBYNOLFSA-N 456.923 0.682 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)CC2)CC1)[C@H](O)CCl 1833313550 JXOVWEWXRVBYQU-ROVVAWJSSA-N 467.950 0.988 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccco1)CCO2)NC(=O)NCc1ccccc1 1833926614 HJIGUKBJCZIDQX-DEOSSOPVSA-N 485.541 0.696 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1 1834819024 CZVWYCZVKOWVJU-IBGZPJMESA-N 489.388 0.945 50 20 JCGD CCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939527 RMGRXPBVTMDVNK-DEOSSOPVSA-N 452.316 0.313 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cnnn3)CCO2)C1 1836150245 ILVJYTYBONNBJK-GSWGVQEBSA-N 473.440 0.015 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Br)cn1)CCO2 1837830004 FXRCLQPVDWDVSR-FQEVSTJZSA-N 498.378 0.287 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)ccn1 1837920443 ZWGNNUMMEAHLHM-UHFFFAOYSA-N 494.357 0.646 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)S)C2)C1 1838528142 HJNFGMDEEKFZMU-XCLFUZPHSA-N 467.500 0.908 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c[nH]c(=O)cn1)CCO2 1838641666 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CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)n(C)n3)C2)C1 1839961611 CQRDFYWAXVYYTD-APWZRJJASA-N 457.369 0.901 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1839965165 PFBMRCMRDWAFBP-KBXCAEBGSA-N 471.308 0.418 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3C1)CCO2 1839990691 BISKQPKMOUDTTB-BKMJKUGQSA-N 478.354 0.242 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1840034008 XQGWHGGQPFAIOL-SQBHOSFOSA-N 484.347 0.692 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cc3-n3nccn3)C2)C1 1840153953 GLIYKJBATIRUSH-AVRDEDQJSA-N 477.949 0.900 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2(O)CCN(C(=O)OC(C)(C)C)CC2)C1 1841789455 HYZCVFFUQRILTD-UHFFFAOYSA-N 481.594 0.325 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)[C@H](F)C1 1847722347 KJIFINQKJQCONF-ZRNYENFQSA-N 489.353 0.777 50 20 JCGD C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 18055553 QMXGCYXKCYOSSC-CYBMUJFWSA-N 454.480 0.414 50 20 JCGD COc1cc(NS(=O)(=O)c2cc(C(=O)NNC(=O)C(=O)NC(C)C)ccc2OC)cc(OC)c1 726616701 RVTLSRUZINSPTH-UHFFFAOYSA-N 494.526 0.799 50 20 JCGD CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)c2)CC1 728176504 FVYCRYOLBPOXRT-OAHLLOKOSA-N 493.051 0.772 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)s1 729614969 VFTLFTLBKIATSP-INIZCTEOSA-N 452.624 0.702 50 20 JCGD CC(C)N1CCC[C@H](CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1 729619056 JUMYHPWFVYWIAG-QGZVFWFLSA-N 453.613 0.764 50 20 JCGD Cc1ccc(OCC(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1 748824236 KAUHOGOGBBEYOQ-UHFFFAOYSA-N 464.486 0.548 50 20 JCGD O=C(COC(=O)COc1ccc(N2CCCC2=O)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 757016795 VSHCRLMSTRTOMW-IBGZPJMESA-N 469.450 0.723 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1ccc2c(c1)OCCO2 844255836 KZDOBWXJMJFZKP-UHFFFAOYSA-N 453.498 0.522 50 20 JCGD CC(C)N1CCC(NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 915896892 LWEZTUYIDLMPTE-UHFFFAOYSA-N 481.619 0.843 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)c2ccccc2c1=O 916237570 AWYRDOMQJSNOJH-UHFFFAOYSA-N 472.527 0.811 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2c(Cl)nc3ccccn23)ccc1Cl 917725676 SLSQKNDENKYPSE-UHFFFAOYSA-N 464.312 0.912 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 919822367 PFMFCVFCLPOOHN-UHFFFAOYSA-N 460.556 0.700 50 20 JCGD NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1 920030288 XQVPSJVKNLSOPE-DVESRUBUSA-N 474.477 0.900 50 20 JCGD Cc1c(NS(=O)(=O)c2ccc(C(=O)N3CC[C@@H](B(O)O)C3)cc2)c(=O)n(-c2ccccc2)n1C 1331895158 JTUCEAVBCLSURS-QGZVFWFLSA-N 484.343 0.974 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)COC4)C2)C1 1777912186 ADYVZJNCBFSWKS-HSZRJFAPSA-N 451.483 0.473 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1onc3ccccc13)CCO2 1779037355 WUOZPXBXGOQYOB-QFIPXVFZSA-N 450.455 0.584 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C2)C1 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0.575 50 20 JCGD Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c2cccnc21 1788462191 AQZMKKQWHPHIRB-DCPHZVHLSA-N 477.525 0.479 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(=O)Nc3ccc(F)cc3)[C@H]2C1 1789683935 UXOSNSJFOCPQOC-SNRMKQJTSA-N 477.537 0.507 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCNC3=N)C[C@@H]21 1790694077 BWPFQNHIASWVBR-TYDTZWSASA-N 472.496 0.691 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1OCCc3ccccc31)C2)c1cccc(B(O)O)c1 1795737624 CKZDOPQGXHOCOZ-SZGVKKGVSA-N 464.327 0.274 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1n[nH]cc1I 1796191899 MSPFBPSTIDZRBM-BTTYYORXSA-N 494.098 0.260 50 20 JCGD C[S@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796361330 NYQXZSGJRCFFHY-AZAZBJKWSA-N 483.990 0.772 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(C(F)(F)F)cn1)C2 1796440311 KSMWPZBTGJCEMC-HIPFWLKJSA-N 493.446 0.833 50 20 JCGD 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C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCNC(=O)OC(C)(C)C 1799354459 RIDMOPQKGDVHHH-AHDPXTMNSA-N 478.384 0.635 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1799366513 QPTNJNQSCJOADY-CUZKYEQNSA-N 482.347 0.542 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC 1800982775 KPUPWVJUXPWAGM-BPKGMFCQSA-N 457.955 0.746 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ccc(O)nn3)cc1)C2 1801012551 PDEWSYDBORIITD-FEJSZKPUSA-N 482.541 0.425 50 20 JCGD CN1CCCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803172853 SUJCMZNEZXMJGT-DZFGPLHGSA-N 465.558 0.884 50 20 JCGD CC(C)(C)OC(=O)CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1803897182 DEDHKUNYHXUTGP-AVRDEDQJSA-N 467.331 0.813 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc(-n2cnnc2)cc1 1806991668 CSNSRRYHMTZLCY-ZJSXRUAMSA-N 496.336 0.976 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807359904 MSIKBZXOPOOTOE-HJNYFJLDSA-N 450.348 0.565 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374685 HFVGCNPFNWFULX-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD CC(=O)O[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(C)C 1807376580 TZQXSGYDXNFZMV-NNWRFLSQSA-N 467.331 0.669 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)no1 1808388797 NUBPBVMNXPPZGY-JPYJTQIMSA-N 491.313 0.406 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C(=O)NCC(C)C)[C@H]1c1cccnc1 1808441720 JKEBWRJYJMLZAL-NLVWTMIKSA-N 481.557 0.994 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1810240071 YOMKYNNFWDVTKP-MEFPCPDASA-N 496.572 0.929 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(O)cn2)[C@H]1c1cccnc1 1810299496 RCDJTUHZJLDLEJ-QRWLVFNGSA-N 461.482 0.814 50 20 JCGD COCc1oncc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810301874 DJEBUZZGLKPTBK-MGPUTAFESA-N 479.497 0.848 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1ccc(-n2c(O)nnc2O)cc1 1811423636 DTSJCXAGOHXOMH-SZMVWBNQSA-N 486.916 0.993 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnn3cccnc23)[C@H]1c1cccnc1 1813070885 NLQBOCXBHRNUQF-UTKZUKDTSA-N 464.530 0.817 50 20 JCGD O=C(CC[C@@H]1CCOC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813626574 BJHKJJBNZLMLCQ-MONBJTKQSA-N 451.332 0.898 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ncn(-c3ccccc3)n1)CC2)c1ccc(B(O)O)cc1 1815340017 BGXHROQTZNJOKG-INIZCTEOSA-N 488.338 0.943 50 20 JCGD Cn1cc(CCC(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cn1 1819794841 FOLNHYHYNVPCRX-CYBMUJFWSA-N 468.543 0.734 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1823744671 ZVWBFFHQJNFADL-KUFMOJEASA-N 453.348 0.458 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2ncccn2)CC1 1825319290 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COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2 1832051851 XQIVRWGFKZKYNT-GCKMJXCFSA-N 475.970 0.706 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1832437960 TZKYREUGLFEGHH-RUZDIDTESA-N 482.342 0.132 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2c1 1832744796 ULLDIUYOBLIGQJ-RUZDIDTESA-N 485.585 0.848 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)N(C)C)CC2)CC1 1833142122 AYRVNTAMYGGPGT-CQSZACIVSA-N 460.417 0.860 50 20 JCGD O=C(CCN1C(=O)c2ccccc2C1=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1833724329 FBTAWCSCVZWCHZ-HXUWFJFHSA-N 490.988 0.844 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3c(C)noc3N)CC2)CC1 1834700860 TVPIKYGLTSEPGJ-JFLMPSFJSA-N 484.561 0.884 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H]3C[C@]3(F)Cl)CC2)CC1 1835738162 KJAIGOLFBXSKNY-DYESRHJHSA-N 466.945 0.795 50 20 JCGD O=C(c1ccnc(C(F)F)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927034 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CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCCC#C[Si](C)(C)C)C2)C1 1840186045 ZRWHPMICKOGSJB-QHCPKHFHSA-N 480.682 0.867 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2 1840364220 CQEZURNXWQZEMM-CKFHNAJUSA-N 455.353 0.754 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCOC1)CCO2 1840536641 UQFVRIJXILSOQS-AOMKIAJQSA-N 477.470 0.627 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840911481 FZSYNBASZHZHRU-GRJRYPSTSA-N 487.981 0.440 50 20 JCGD C[C@@H]1CN(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCO1 726259178 GUDONVIYNOSSFO-MRXNPFEDSA-N 453.565 0.526 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNC(=O)Cc3cccc(F)c3)cc2)CC1 728215779 IOCYYBRUKBOBPW-UHFFFAOYSA-N 463.535 0.564 50 20 JCGD N#CCCCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 728339962 GSHHWLDHWDIQJZ-IBGZPJMESA-N 487.490 0.908 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)C1CCN(c2ncccn2)CC1 728844680 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0.605 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)cc1 914748182 LRTDUPVPKIWIET-LBPRGKRZSA-N 450.439 0.174 50 20 JCGD COc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1F 916594366 HNGCHQZEAQLYNK-UHFFFAOYSA-N 452.512 0.992 50 20 JCGD N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 916649141 JJGLDASGEPLRSO-SFHVURJKSA-N 487.538 0.925 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1 919833865 HVUAFRYQOMWVJQ-UHFFFAOYSA-N 460.512 0.210 50 20 JCGD O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1nn(-c2ccccc2)cc1O 920274904 HKPAPDRGJOMJPI-UHFFFAOYSA-N 458.434 0.976 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1nccc2nc[nH]c12 1777922763 REBBPXINGUUVIE-WZONZLPQSA-N 463.303 0.079 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)CC[C@H]3O)C2)C1 1778087324 KTNSLIXUHUNQMC-FSTVOOFJSA-N 489.997 0.688 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncn1C)C2 1778091038 DIGGGIIQNWGLSS-GULKHOJOSA-N 455.519 0.682 50 20 JCGD O=C(C1=NO[C@@H](c2ccccc2)C1)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1778173601 WPBZBLXYUGOSCD-ZJSXRUAMSA-N 463.299 0.328 50 20 JCGD COc1cc(C)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779033709 BQISEEBSTKEWPZ-HSZRJFAPSA-N 453.499 0.759 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(OC)c1 1779034866 VOBRCUAJNAXZIF-RUZDIDTESA-N 497.552 0.779 50 20 JCGD COc1ccc(F)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779035724 MIJDALSOQUUOPB-JOCHJYFZSA-N 457.462 0.590 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)n1cccn1 1779376005 UKHHTKRWKVXCSL-YBOAYWMSSA-N 455.519 0.270 50 20 JCGD Cc1cc(C#N)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1781149800 JSIFDGGLEMYDQA-RCZVLFRGSA-N 461.327 0.988 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@]3(NC(=O)OC(C)(C)C)CCOC3)C2)C1 1781312887 ZRRZNWXLRWURBZ-RVHYNSKXSA-N 475.970 0.754 50 20 JCGD N#Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ccc1Br 1781903806 ZJYHEEXYXLSQSE-QFIPXVFZSA-N 498.142 0.758 50 20 JCGD CC(C)n1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1C(=O)O 1782209518 WYIFXBUXGLHYJJ-WZONZLPQSA-N 492.577 0.663 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1 1782944382 VBWRYBWXFGQFBT-NRFANRHFSA-N 452.552 0.123 50 20 JCGD O=C(CN1C(=O)C=CC1=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783023095 TYTHZHFTPKQWID-JTSKRJEESA-N 490.354 0.748 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1783535698 GFMNYXOOJMAWJW-PXAZEXFGSA-N 457.281 0.370 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1783821662 DGCDQJQUOOXNDK-QAETUUGQSA-N 469.583 0.252 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1(C)CN(C(=O)OC(C)(C)C)C1)CCO2 1783934220 AHLZFTGFITWJSE-HSZRJFAPSA-N 481.594 0.446 50 20 JCGD CSc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1784215115 DXPHHZZTBDJBEU-QHCPKHFHSA-N 454.357 0.775 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@H]1CCc2nc(O)nc(O)c2C1 1785332251 LBLSOKGVHWPSAD-WRZDFSGXSA-N 459.330 0.776 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3OCC3CC3)[C@H]2C1 1785732888 BLWQJBDKEYQSMJ-NDXORKPFSA-N 494.552 0.776 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(Br)n3)C[C@@H]21)c1cccc(B(O)O)c1 1786983571 XVPBODBRBJJISN-NOLJZWGESA-N 494.176 0.493 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCC(=O)NC3)C[C@@H]21 1789220684 DNUFUYFCKPTDLB-OFVDUGFESA-N 488.497 0.640 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3C(=O)OCCO)[C@H]2C1 1789250363 PIRDMCSTGSNXGN-QZHFEQFPSA-N 468.934 0.683 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790602296 IGFYOERWAHCQNE-LPWQTFTOSA-N 460.579 0.256 50 20 JCGD CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc(O)nc(O)c2C1 1794108988 XKVAZSMNCACCKJ-JFILPPLUSA-N 452.939 0.847 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(O)cc3)CC1)C2)c1ccc(B(O)O)cc1 1795732894 QTYONQYGKUCJRV-UPHUGPLXSA-N 450.300 0.007 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc2n(n1)Cc1ccccc1NC2=O 1796191955 UYKOVLOTCPIXBP-ACDBMABISA-N 499.336 0.743 50 20 JCGD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)ccc1[N+](=O)[O-] 1796192631 NWJXIIMJAJPURE-BCDXTJNWSA-N 453.260 0.849 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(CS(C)(=O)=O)nc1 1796541175 INKHXBGVOSSEDX-BCDXTJNWSA-N 465.576 0.251 50 20 JCGD Cn1ccc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)c21 1797750537 FQPYBFGZMWKKJH-CWPLJXCYSA-N 462.510 0.694 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-n3c(O)nnc3O)cc1)C2 1798439817 ICECTELASOIZOK-RBVVOMGSSA-N 492.496 0.243 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)cccc1F 1798983264 CIXDWUWLAIEMDO-NXCRSVRDSA-N 459.453 0.409 50 20 JCGD C=CCSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095476 ZZMOTWNNCATTIZ-HATOLVCRSA-N 475.615 0.841 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)NC(=O)NCc1ccccc1 1799097203 INRBLEVLEKVJDJ-SCAQPMJSSA-N 472.373 0.726 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2)[C@H](F)Br 1799344535 NMCBJSXJFXQDJN-BZROYUPASA-N 473.299 0.273 50 20 JCGD CN(C)CC[C@](Cc1ccccc1)(C(=O)O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800292738 JURACIAAEJQIDT-PNULUVANSA-N 496.004 0.441 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3cccnn13)C2 1800760151 DJRAVVQHQJRXNW-LSSIXWDNSA-N 450.293 0.076 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2 1800760653 YKEDXJAEUJOPOG-NJBDSQKTSA-N 455.334 0.743 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]cc1I)C2 1800977074 QYMFTLGLOGLLGA-DTHBNOIPSA-N 482.706 0.471 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(C)CCN(C(=O)OC(C)(C)C)C1)C2 1801011220 BBWCNRXUSWMOLB-JJLPPOTMSA-N 495.621 0.596 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(-c2ncc[nH]2)cc1 1801819457 RCFGNNMKSVGPDJ-CEQLMSFQSA-N 460.299 0.274 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803244256 YSJDDWUXKVOWHN-XWTMOSNGSA-N 484.981 0.963 50 20 JCGD CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803594279 UACVSKYDJIKXFQ-QFBILLFUSA-N 467.530 0.314 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1804343112 WEYVPHAQRUXPFL-UYHMYPTGSA-N 466.336 0.717 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnsn2)[C@@H]1c1cccnc1 1805001002 WOJXLHUCSVMPMW-GUYCJALGSA-N 452.500 0.565 50 20 JCGD COCc1oncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365632 YHOJNTRDQSJGMH-UWJYYQICSA-N 464.287 0.529 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807367612 TYEPNAYIASMJPE-KNQAVFIVSA-N 465.315 0.590 50 20 JCGD Cc1nc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c(=O)[nH]c1C 1810300303 XIWUQEGAYSTFJK-JXFKEZNVSA-N 490.524 0.414 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1 1810489213 JLHCJPWFQRJNFJ-LBPRGKRZSA-N 466.340 0.688 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2c(O)cc(O)cc2O)[C@@H]1c1cccnc1 1811432623 BNDXBDNWIVEMIN-NYHFZMIOSA-N 471.514 0.891 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C[C@H](N)c2cccnc2)[C@H]1c1cccnc1 1813070468 GZBJMYKWQKGDFK-SKPFHBQLSA-N 467.574 0.946 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813074186 RBZRXXLFVLHMSI-AQOAWAETSA-N 468.562 0.751 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813619594 FQRSXJCKPCVESA-PUHATCMVSA-N 464.375 0.954 50 20 JCGD O=C(CCN1CCCCC1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1814068927 PGHCJRVQEWDUKZ-QGZVFWFLSA-N 456.377 0.925 50 20 JCGD CCCNC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815108963 HXXFXVXEXDXSPM-SFHVURJKSA-N 455.324 0.702 50 20 JCGD Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c(O)n1 1815343632 FXTGSSWPDDKUJX-AWEZNQCLSA-N 452.301 0.772 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2[nH]nc3ncccc23)[nH]n1)c1cccc(B(O)O)c1 1817475076 KICDXCOPZSCNAW-QGZVFWFLSA-N 459.275 0.981 50 20 JCGD CCOC(=O)C1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)CC1 1817475192 KWIUBJJRPPBUOV-KRWDZBQOSA-N 454.292 0.739 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401637 MBQVTOAQCACRFC-INIZCTEOSA-N 456.507 0.629 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(O)ncn2)[nH]n1 1819401989 ZXXWXUBAXLEXKM-HNNXBMFYSA-N 451.447 0.524 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cc2ccc3ncnn3c2)n[nH]1 1820701854 JSRZTVCSEZRUMZ-SFHVURJKSA-N 488.512 1.000 50 20 JCGD Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(=O)[nH]c1C 1826080500 OFBRYYPMGZRECQ-GFCCVEGCSA-N 461.548 0.442 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826806146 MJZQSHFKWHUTJX-XJKSGUPXSA-N 466.328 0.911 50 20 JCGD O=C(NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1cccnc1 1827056019 OGJHFUPUDIQIGY-QFIPXVFZSA-N 478.358 0.425 50 20 JCGD CC[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1830525271 KWMXZTJMOHUCIX-DYESRHJHSA-N 465.459 0.361 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830719996 QQJPVVFPMJSBKK-DVSDUFGPSA-N 489.997 0.736 50 20 JCGD CN1Cc2ccccc2C[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830725581 KCSXTGUWIOIOKN-WOIUINJBSA-N 451.951 0.099 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731690 MECWKRQQPLOQSP-XMSQKQJNSA-N 483.949 0.309 50 20 JCGD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832172886 ZQQPIZMXXLKEGM-YLJYHZDGSA-N 455.895 0.584 50 20 JCGD C/C(=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C(=O)O 1832551106 BFCXTHXFLAYOAC-ONWVVCSESA-N 489.953 0.606 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832800613 VOZVVEWCINJACN-IAGOWNOFSA-N 464.306 0.484 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1 1832929467 MLPKJNPBGMZIMV-ULQDDVLXSA-N 489.013 0.975 50 20 JCGD O=C(Cc1ccc(Br)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833107032 TWZXRKDMZLTXBB-QAPCUYQASA-N 476.755 0.443 50 20 JCGD CC(=O)N[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)(C)C 1833402583 PZYGTNBCYGIDHT-JOCHJYFZSA-N 486.422 0.102 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccc1O 1834045026 LKSDFZJHCLYGPT-UHFFFAOYSA-N 451.332 0.571 50 20 JCGD Cc1cc(Br)cnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1834550556 KFPYZYQSOZVWQU-KBXCAEBGSA-N 476.755 0.822 50 20 JCGD O=C(Cc1cccc2ncccc12)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927258 NBLUOVJCKWFXEW-SANMLTNESA-N 489.337 0.227 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1 1835928733 WXJKIVWGYFVGTF-JOCHJYFZSA-N 470.312 0.558 50 20 JCGD COc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)ccn1 1835932902 GRMRWGWWSLWGAD-UHFFFAOYSA-N 460.579 0.648 50 20 JCGD Cc1ccc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1835942113 VYMOVAWMLQUJCD-XMMPIXPASA-N 452.316 0.367 50 20 JCGD O=C(CCc1c[nH]c2ccccc12)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836104922 ADEAQSQUUDQZJK-AREMUKBSSA-N 491.353 0.551 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc(O)ccc1O 1836469827 UQDZTMBWTBJVGX-UHFFFAOYSA-N 467.331 0.277 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCC(F)(F)C3)C2)C1 1837456652 PGAPUMRDJKDWRJ-VBKZILBWSA-N 467.473 0.191 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1 1837457108 XUGGZURJGJSKIK-OAQYLSRUSA-N 481.500 0.581 50 20 JCGD Cc1nc2ccccn2c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837458841 FGHCKQWKWYIDEA-DEOSSOPVSA-N 493.524 0.025 50 20 JCGD CCCOc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837460038 QXOHEHUCAPFJGE-VWLOTQADSA-N 497.552 0.858 50 20 JCGD O=C(c1ccc(Cl)nn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837838310 ZHGMZIIOECFKMC-WFASDCNBSA-N 451.680 0.891 50 20 JCGD O=C(c1cnn(Cc2ccccc2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838016249 WAHKEIDNTPOGBY-UGKGYDQZSA-N 462.934 0.601 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C)n3)C2)C1 1838526825 DXYYRJHLZDROCA-JOCHJYFZSA-N 487.469 0.637 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1839716328 GEFOKLBIIPKIOT-AUSIDOKSSA-N 497.976 0.148 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1840029532 ITAWAZPFBJYTFD-YOEHRIQHSA-N 450.399 0.275 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1840034399 JTTRXFJUEPFGIA-APWZRJJASA-N 473.412 0.006 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC=CC[C@@H]1C(=O)OC)CCO2 1840143849 GVJPNUXCUBFFCR-MXTNKPTQSA-N 458.939 0.452 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1 1840905877 UCNUDTWUGGTBOB-HRAATJIYSA-N 482.375 0.965 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)C1 1841080262 DEHSSYYGAKQSSO-QGZVFWFLSA-N 493.605 0.731 50 20 JCGD O=C(c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841354716 QNTBEEUSQZSCBU-QGZVFWFLSA-N 471.963 0.124 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCS(C)(=O)=O)C2 1844693255 MZRANNHOVWLUPE-UHFFFAOYSA-N 453.473 0.772 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1847070424 XYGPVHCPOSOFDS-SFHVURJKSA-N 455.320 0.100 50 20 JCGD O=C(COC(=O)CCCNC1=NS(=O)(=O)c2ccccc21)NNC(=O)c1cccs1 9787214 ASSDEKFDIWOMLQ-UHFFFAOYSA-N 450.498 0.571 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C 16204532 YJVIRZFSNJCTBZ-NSHDSACASA-N 493.318 0.201 50 20 JCGD Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1 106075922 MFBZZAMLHPSMNX-UHFFFAOYSA-N 482.588 0.568 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2c(C)nc3c(c(O)nn3C)c2C)cc1 729511268 CUOBFUBWNMEXNF-UHFFFAOYSA-N 474.543 0.610 50 20 JCGD CC[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(S(N)(=O)=O)c1 729612814 JBENNCZCPHUIJD-MRXNPFEDSA-N 458.500 0.676 50 20 JCGD O=C(CC1CCCCC1)NCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 748700158 WFMNHFPNAMOSSU-UHFFFAOYSA-N 494.614 0.874 50 20 JCGD Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)N3CCOCC3)CC2)c(C)n1C[C@@H]1CCCO1 798119096 ODOZUTLGMNFOTN-VAZXNAHHSA-N 483.569 0.721 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2ccccc2)o1 915441647 PBLJBSSBILEDEV-HNNXBMFYSA-N 493.494 0.614 50 20 JCGD COC(=O)c1ccc(CCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 916249040 ZDNJAOXMRORZRR-UHFFFAOYSA-N 462.528 0.975 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(C3CC3)C2=O)cc1 916550569 QHVKZOKMPWULJQ-HXUWFJFHSA-N 457.516 0.589 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NC[C@]2(N3CCOCC3)CCSC2)nc1 916637013 SFYGUMDQPAYANQ-GOSISDBHSA-N 458.610 0.602 50 20 JCGD C[C@@]1(NNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCS(=O)(=O)C1 919785470 ZRVWEGJYKZGOMQ-OAQYLSRUSA-N 477.566 0.823 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCNS(C)(=O)=O)cc1 920852402 ZIQHSLAZQBKNJT-PTNGSMBKSA-N 460.516 0.006 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]nc1C)C2 1778092790 QUPOQMKYEUYAKP-VWCSSDMBSA-N 455.519 0.980 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779030645 GATFLPRRRKMWBJ-VWLOTQADSA-N 497.552 0.779 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780095380 NZFRXIWNZVUYNT-QFIPXVFZSA-N 476.486 0.878 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1780328359 WXOXOPIMRJRIEZ-OAQYLSRUSA-N 474.905 0.499 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1780887666 IAHDVBBEAZUAQU-XMMPIXPASA-N 474.363 0.568 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1nccn1C)CCO2)NC(=O)NCc1ccccc1 1780969610 IJNBCSWZWYPIET-QHCPKHFHSA-N 469.546 0.210 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCS(=O)(=O)CC1)C2 1781997178 IZAWZDKFBGYUTE-HDMKZQKVSA-N 480.425 0.014 50 20 JCGD CCOc1ncccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782210270 LLQJHYZWTFRVGX-WZONZLPQSA-N 461.563 0.981 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)CCO2 1783354504 BSDLEVLLSXCXBX-MDZRGWNJSA-N 470.368 0.460 50 20 JCGD CCOc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1OC 1783698643 IPIIDMPMWATOQC-RUZDIDTESA-N 482.342 0.460 50 20 JCGD CCOc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1OC 1783936416 HAIQUIZZBJYOFB-XMMPIXPASA-N 476.574 0.839 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)COc4ccc(Cl)cc43)C[C@@H]21)[C@H](O)CCl 1784085686 NLYJMHXLYBEKAZ-ZKNMIIFVSA-N 486.352 0.645 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1 1784509294 DEGPIILUDFARIM-AJPHYDNBSA-N 469.546 0.543 50 20 JCGD O=C(CCCN1C(=O)c2ccccc2C1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1785066910 YQLODFJNQKIHHP-FZDIXFNVSA-N 477.945 0.642 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785734902 LHBOPEMAGJBZDR-XMMPIXPASA-N 489.378 0.361 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCNC4=O)[C@H]2C1 1786261197 JOCCKYRSLXRAIK-CIMWUQIDSA-N 458.346 0.456 50 20 JCGD COc1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983466 QBWUWGKPULBGEE-RRPUWOKSSA-N 466.343 0.601 50 20 JCGD Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c2cccnc21 1786983848 ARQXBDJWOWUHLW-LRQRDZAKSA-N 462.315 0.160 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)nn1C(F)F 1786984725 BFXLPQWSGSGWTN-ZVZYQTTQSA-N 462.262 0.174 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786986436 AXVMBEPMLIJUES-LQJIQPLVSA-N 469.372 0.536 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3OCC4)[C@H]2C1 1787816038 IFGRUKVRXLXYBR-YSSFQJQWSA-N 465.510 0.527 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21 1788475515 MABJDFPOMCOABF-AIUMHDJVSA-N 450.330 0.204 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21 1788705894 ABUBDPGZMQGZIY-GVBSNHICSA-N 472.373 0.811 50 20 JCGD COc1ccc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1790138511 QAJLUZQARHTXRG-HSQYWUDLSA-N 452.316 0.591 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)C1CCC(C(F)(F)F)CC1 1793685190 TZAVETYGXNAZDP-CIOUKLMISA-N 468.281 0.938 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc([N+](=O)[O-])c1 1793702278 YHCPSMMSIXVYAA-FAQVEIGNSA-N 461.519 0.490 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#Cc1ccc(Cl)cc1)C2)c1cccc(B(O)O)c1 1795737770 QYXUIANSZGZYHC-OPMZPASUSA-N 452.703 0.275 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3occc3c1O)C2)c1cccc(B(O)O)c1 1795741448 ZXAFPQWAUVNKCQ-YVWYUNDQSA-N 450.256 0.335 50 20 JCGD CN(C)c1cccc(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1 1796188224 CPGSSCFSTRGMDX-NUZGMZIFSA-N 451.332 0.763 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1796439472 GNZKSKTXLACQQF-HYPIOSFMSA-N 473.530 0.299 50 20 JCGD Cc1cc2nnc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)Br)C4)c(C)n2n1 1796926347 SSJVBUGLJFFMQV-YGSHXTJESA-N 451.325 0.728 50 20 JCGD CCSc1cccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1798776821 ZBNBAZJCBCJORU-HGKCTWBKSA-N 455.345 0.390 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)C1 1799199053 VBASALZSFUYWEH-LBKYZSNHSA-N 490.395 0.589 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799347505 ONASQKOOXAHZOB-YOSNBGTRSA-N 458.288 0.401 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1800320058 YYNIEFWYGRDGCA-XXBVRILMSA-N 450.845 0.333 50 20 JCGD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc(O)n1 1807360309 AGFVOXLWIXUPBN-AVRDEDQJSA-N 460.299 0.804 50 20 JCGD Nc1nc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cs1 1807364585 QXOINLBAAKZSGF-YJBOKZPZSA-N 451.317 0.434 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H](O)CN2)[C@H]1c1cccnc1 1807678725 BQHNDUXGIYSPAU-HVMFNXBNSA-N 496.008 0.942 50 20 JCGD CN[C@H](CC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1)C(=O)O 1808414045 DPPBVXLULHFSBH-JBKKHTOXSA-N 483.529 0.284 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)COCCO)[C@H]1c1cccnc1 1808611862 BFCHKEBGHSIIOK-YVIKVBFHSA-N 456.503 0.230 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc3c2NC(=O)C3=O)[C@@H]1c1cccnc1 1810025709 JSSHXOIMOSIZCF-AOMKIAJQSA-N 492.536 0.909 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1 1810948622 PVVVKNJRUQZMSG-RLKJRQFRSA-N 464.486 0.964 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1 1810950002 FQFRORLUVHWROQ-CXAGYDPISA-N 450.459 0.142 50 20 JCGD Cn1ncc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1Cl 1811168116 PYXWQRJAALITHR-APWZRJJASA-N 467.722 0.782 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813419021 YGILUCVZVFRAEH-LZNRXBQRSA-N 455.563 0.993 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813437064 LSJDHZASCSYLSJ-WGGBDISSSA-N 474.326 0.944 50 20 JCGD O=C(/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)NCc1ccco1 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Cn1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)n1 1832549004 AFVBECHLPGYVOS-HRAATJIYSA-N 485.969 0.622 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cncnc3)CCO2)C1 1833114481 HOVLLXNSVHHFMI-JTSKRJEESA-N 497.980 0.608 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc(C2CC2)on1 1833177333 VNWKNICJSPRCLB-UHFFFAOYSA-N 466.347 0.731 50 20 JCGD CC(C)c1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)co1 1833350691 KJUJYRTURRYQOK-NRFANRHFSA-N 451.524 0.241 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)Cc3ccccn3)CC2)CC1 1835736789 HSHKQNBOABJGAN-UHFFFAOYSA-N 465.558 0.508 50 20 JCGD NC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)c1ccccc1 1835811331 DKTJRPUVYVJRSP-PXNSSMCTSA-N 454.365 0.970 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccnc4c(O)cccc34)C2)C1 1835932194 SLMKNRXKUWGMHJ-RUZDIDTESA-N 491.309 0.004 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)ccnc3Cl)C2)C1 1837456227 FVADXIOYUXPLAB-NRFANRHFSA-N 492.895 0.256 50 20 JCGD CCc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)s1 1837459610 STGGVCOWFFTZKN-OAQYLSRUSA-N 474.543 0.088 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1 1837460983 MHENPVISDKBBHF-RXFWQSSRSA-N 493.564 0.560 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1837527534 PFVGGVVVTJEAHS-HUWVGRHQSA-N 462.341 0.757 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H](O)c3ccccc3)CC2)CC1 1837779439 VDWHPKHUABRNPD-HSZRJFAPSA-N 466.343 0.712 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919114 GFRBFNPQDRWZAA-QGZVFWFLSA-N 473.379 0.283 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1 1837921220 NQJVWZKDSPGPRZ-CTNGQTDRSA-N 497.401 0.380 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cn2[nH]cnc(=O)c12 1838471090 HGGROFNOOZWEOL-RDTXWAMCSA-N 486.298 0.092 50 20 JCGD O=C(c1cnn2cccnc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200824 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COc1cc(CC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)ccc1[N+](=O)[O-] 1845147765 BETHFOYTAXHEKK-UHFFFAOYSA-N 453.260 0.343 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1COC3(C1)CN(C(=O)OC(C)(C)C)C3)C2 1846386029 WMTBFALJNAYTCH-KRWDZBQOSA-N 493.605 0.589 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3ccc(B(O)O)cc3)cc2)CC1 1847242230 QMQBTSHCHKMDRJ-GOTSBHOMSA-N 462.359 0.247 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)cc1OC 14800403 RMQVZYWPMIFWRS-INIZCTEOSA-N 499.567 0.247 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3n(c2=O)CCS3)c1 15633370 KNLKORSSEWCXFE-UHFFFAOYSA-N 451.530 0.454 50 20 JCGD O=C(Cn1nnc2ccccc2c1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 15714342 UTQRWAYASXAWNX-UHFFFAOYSA-N 456.484 0.037 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c([N+](=O)[O-])c1 23392157 LRXGMKBASLYENP-UHFFFAOYSA-N 472.501 0.542 50 20 JCGD CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 726150539 BKHYBCKCJAPHPU-KRWDZBQOSA-N 477.930 0.977 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCc2nnc3n2CCCCC3)c1 727606761 FLNUZUHXTPAWFC-UHFFFAOYSA-N 463.564 0.832 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccc(Cl)s2)n1 728734368 YUGYKXJHYJWHSV-UHFFFAOYSA-N 466.950 0.378 50 20 JCGD CC(=O)N1CCN(C(=O)CCNC(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1 730786414 PQZRHVANUVLJGD-UHFFFAOYSA-N 466.542 0.854 50 20 JCGD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1 751281819 HEBQRUKAKRWZIY-UHFFFAOYSA-N 475.570 0.301 50 20 JCGD CSCC[C@@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)N1CC[C@@H](B(O)O)C1 864233942 LEWPWUMQUUELML-MLGOLLRUSA-N 491.828 0.517 50 20 JCGD C=CCNC(=S)NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 913437923 AIVFXMFSBHMSFP-UHFFFAOYSA-N 474.008 0.634 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1ccncc1)N(S(C)(=O)=O)CC2 915881545 KCADCDJILOIREM-QGZVFWFLSA-N 477.543 0.878 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1[C@@]1(C)NC(=O)NC1=O 917718029 RLJDXLRABUFQEF-LJQANCHMSA-N 462.440 0.102 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1ccc(F)cc1Br 918341645 TZNLLWCWNUMLHQ-GXSJLCMTSA-N 462.297 0.385 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2)c1 919806123 LWBHJYCBYWGXMU-FQEVSTJZSA-N 474.539 0.434 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)OCC(=O)NNC(=O)c3ccccc3)CC2)c1 920614395 PITDRZGJQKEWGQ-UHFFFAOYSA-N 474.539 0.451 50 20 JCGD Cn1c(CCC(=O)NNC(=O)NCC2CC2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 920859621 SGYSHNYQHSOSEC-UHFFFAOYSA-N 464.548 0.267 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1 1779762336 OBTZYJMMQAQGMO-LRULAXNGSA-N 467.530 0.725 50 20 JCGD CC(C)n1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)n1 1780207443 GIOJLNZUPIZRLX-NFBKMPQASA-N 454.336 0.585 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(Br)CC2)C1 1780784510 JZMJCGVFQWSQIW-RDTXWAMCSA-N 459.385 0.801 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)cc2F)C1 1780937681 BWTIOJFXYCPICH-AUSIDOKSSA-N 471.489 0.971 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1CC(c2ccccc2)=NN1 1781446230 ITOAMMGMGBEFGG-JQYIIUTOSA-N 490.369 0.260 50 20 JCGD Cc1cnn([C@@H](C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1782512070 AOUURTLLZCULJX-XTQVGHSUSA-N 454.336 0.260 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC)CCO2 1783870370 BFTXZECJVOWLIO-FAPUVCABSA-N 477.986 0.998 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1 1783950187 LDTXBNLGBIAXCV-RBUKOAKNSA-N 466.362 0.992 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)c3cccn3C)C2)C1 1784608359 ZKHXHZLDWGZROF-NMWDDECMSA-N 454.487 0.172 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)nn(C)c3C)[C@H]2C1 1784702488 YUEBMFNGMHATJB-ZPSROVLTSA-N 469.546 0.764 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS(C)(=O)=O)[C@H]2C1 1786648881 QMLOCUIXYGQTTE-OWQGQXMQSA-N 483.499 0.158 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)nc2ccccn12 1786983430 RXTBFQGHHXTTNT-IHPCNDPISA-N 462.315 0.230 50 20 JCGD O=C1CSc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)ccc2N1 1787388627 KGJIKYPGVAKSJR-QRFRQXIXSA-N 495.366 0.318 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1 1790213745 ITBOZLODQZWRRT-NXXSPTCGSA-N 484.469 0.206 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc(C)c1O 1791934698 BUEGMJOLMLSUKX-YYWHXJBOSA-N 452.316 0.596 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(N2C(=O)C=CC2=O)cc1 1792070878 MAHNBIQEZSWJAI-OWLYRPNTSA-N 461.902 0.309 50 20 JCGD C[C@H](CC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1793428776 XQJZGRPILHSFSJ-USRAEIGSSA-N 460.959 0.220 50 20 JCGD O=C([C@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)C(F)(F)C(=O)O 1793730657 ZNWJKUPXBACOQV-YWIQKCBGSA-N 453.158 0.622 50 20 JCGD CC[C@@H](C)[C@@H](N)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1795551155 JRSNZYMGLLRGSW-ILMFXRJHSA-N 474.606 0.296 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccccc1Cl)C2)c1ccc(B(O)O)cc1 1795734444 IDDMXTBYSNHIKM-OPMZPASUSA-N 456.735 0.856 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cc1F)C2)c1cccc(B(O)O)c1 1795740285 NYWVTGXKHQWZAW-HBCWATKFSA-N 478.232 0.624 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@H]1CN(Cc2ccccc2)CCO1 1796189070 SICHXAHWLVYTPF-UEQSERJNSA-N 477.370 0.519 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1796394078 FRUJQRWLZCPAMZ-RNJOBUHISA-N 454.351 0.919 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS(=O)(=O)N1CCCC1 1796440692 KGQNTJXENFGJGD-FQLMCAECSA-N 466.398 0.175 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799346208 JJIYQEYHQMUMHX-ITGHMWBKSA-N 481.363 0.509 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2 1800977699 CTPJOUGSGPVKJP-LUYSREMJSA-N 465.978 0.731 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1802121697 PBINSNKMWCAFPI-CCWDJLKJSA-N 490.561 0.193 50 20 JCGD CN(C)c1ncc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1 1805343730 LVYYNUKPWLHGTG-XLIONFOSSA-N 463.303 0.449 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H](O)c1ccccc1 1806802452 VKFCIDRZLMWECZ-WWNPGLIZSA-N 459.311 0.815 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361831 UIFDWKHIOOGNQH-RHSMWYFYSA-N 488.235 0.532 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374765 JAGLJKGYYKTYKU-WMZHIEFXSA-N 473.342 0.928 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1 1807933833 ASRYRGISVTVAHY-OXQOHEQNSA-N 485.508 0.756 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1808590351 CTSRZXFVTYDABJ-XMSQKQJNSA-N 488.309 0.576 50 20 JCGD Cc1nnsc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808649204 YWZLHCQSSFMLHO-WMZOPIPTSA-N 451.317 0.555 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cn2cccnc2n1 1809776551 FVKHWWGBGPXGBV-GHTZIAJQSA-N 470.298 0.438 50 20 JCGD Cc1cnc2c(C(=O)NC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)cnn2c1 1809835558 MOQDQFIUYQNGMA-SIKLNZKXSA-N 484.325 0.746 50 20 JCGD Cc1noc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810303005 OFZDCXOPJSYKOR-MGPUTAFESA-N 464.486 0.334 50 20 JCGD O=C(CCc1cncnc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354552 IHGXZGFHYCBJIT-MRXNPFEDSA-N 451.317 0.472 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354747 CEDZYQSCEBVACO-BBRMVZONSA-N 453.333 0.582 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCNC(=O)C2)[nH]n1 1819404419 JZUIKEPROMCDSD-BLLLJJGKSA-N 454.491 0.240 50 20 JCGD COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)ccn1 1820540642 OFDHTFQHMOOGQP-OAHLLOKOSA-N 452.301 0.766 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1820991984 TXMRGVWLKDKGJX-IBGZPJMESA-N 450.308 0.978 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060608 SQWVPQQHGZLVTL-OAQYLSRUSA-N 466.347 0.728 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(C)c1 1830737698 GPTRVNRFQLXFGI-DYESRHJHSA-N 454.907 0.451 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C#CC3CC3)CCO2)C1 1831209227 UDTNAVIJGJVXDJ-HTAPYJJXSA-N 469.966 0.988 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1831864982 JLAGGQGPXPZKFZ-AUSIDOKSSA-N 460.336 0.216 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1 1833895860 KDZDGSDKLCSLHA-UGSOOPFHSA-N 459.341 0.842 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834687001 AXCUQIHMFCSXFH-MGPUTAFESA-N 459.595 0.244 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ncc(F)cc3F)CC2)CC1)c1cccc(B(O)O)c1 1834800098 VUPLIBNYDXILQT-UHFFFAOYSA-N 472.301 0.539 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)COCc3ccccc3)CC2)CC1)c1cccc(B(O)O)c1 1834801115 POLBYLQWYCPGCM-UHFFFAOYSA-N 479.386 0.768 50 20 JCGD CC(=O)Nc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccn1 1835262360 PBRVRXFXAPZCTO-UHFFFAOYSA-N 493.373 0.219 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837171192 DDLBWJLSWCFCDB-BEFAXECRSA-N 466.336 0.973 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837677890 IRQVVOQQAILPRK-HACGYAERSA-N 452.321 0.438 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(C)C 1838358589 HNCAGNCEYGMHBP-OAQYLSRUSA-N 489.573 0.885 50 20 JCGD O=C(c1ccnc2c1OCO2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1838478691 XDKBXXHLMPRFQX-DYVFJYSZSA-N 460.256 0.571 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202761 OWFHNDMRZOYYCV-XLIONFOSSA-N 485.354 0.530 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1O 1839472254 KEZMITJDENLOSO-XLIONFOSSA-N 455.895 0.020 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622390 BLMSDSQTLKUMLB-YWZLYKJASA-N 484.395 0.572 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCC(=O)NC3)C2)C1 1839741993 JXXVRLLQDAYKIH-JRDZDNNQSA-N 488.491 0.854 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3C1)CCO2 1839994458 YVABRFZFPIEERL-OFVILXPXSA-N 472.586 0.621 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1840032572 CMGVXYXKPFVYJG-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1840033259 YZZNYAJDUPINRW-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2 1840114071 UQYGTBGGVQTRQM-VWLOTQADSA-N 478.354 0.558 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)ccc3Cl)C2)C1 1840182525 LPYQNRHUPPEZJO-QFIPXVFZSA-N 484.956 0.851 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cccnc34)C2)C1 1840184280 GOJKKYALRDLYHS-XMMPIXPASA-N 469.542 0.678 50 20 JCGD C[C@H](CC(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)Oc1ccccc1 1840184702 BOBJFVYJTBVDRU-DVECYGJZSA-N 476.574 0.673 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n1 1840187674 PPPYRBWWTODRLC-QGZVFWFLSA-N 463.274 0.872 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1cccn1)CCO2 1840440706 JLGJDIPAYPBDAM-XJNGEBIUSA-N 471.518 0.035 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3CCOC3)CCO2)C1 1840533675 KBGWXVGKDZTFIL-QYWGDWMGSA-N 475.970 0.611 50 20 JCGD O=C([C@H](O)N1CCOCC1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1 1845941598 HKDRLDLTPVLTMS-HKUYNNGSSA-N 466.376 0.847 50 20 JCGD CC(C)(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C(=O)NC3CC3)CC2)cc1 9889404 XWSBSOBLVRCAIL-UHFFFAOYSA-N 450.561 0.811 50 20 JCGD Cc1cc(/C=C(\C#N)C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(C)n1C[C@@H]1CCCO1 11245509 GXAIUGXBOBQRIM-NDCSFFLDSA-N 469.498 0.597 50 20 JCGD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)C1 15055856 BANHWBSVEGKDDG-IRXDYDNUSA-N 460.535 0.478 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)NNC(=O)c1cnn[nH]1 729455951 IEYOIBLFMYETCF-NSHDSACASA-N 467.360 0.973 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2OCCN2CCOCC2)c1 744292095 SHJKUZPSXZDFRO-UHFFFAOYSA-N 476.555 0.945 50 20 JCGD Cc1c(NC(=O)[C@H](C)SCC(=O)NNC(=O)N2CCOCC2)c(=O)n(-c2ccccc2)n1C 745993026 TWUPMWCOCWVBOH-HNNXBMFYSA-N 476.559 0.618 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@H]1CCN(CC(F)(F)F)C1 747310500 PHGFNCCMGXNEHQ-AWEZNQCLSA-N 479.481 0.288 50 20 JCGD O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1cccc(C(=O)NCC(F)(F)F)c1 751283036 SMRZUEJIGJUFIN-UHFFFAOYSA-N 464.447 0.780 50 20 JCGD CC(C)CN1CCO[C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 915922255 FDOWZINDEAPTMK-SFHVURJKSA-N 483.591 0.008 50 20 JCGD CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1 916237449 YITRMOGHRDGQQH-UHFFFAOYSA-N 454.530 0.485 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCc2cccc(NS(C)(=O)=O)c2)c2ccccc2c1=O 916246484 IMTUJXDPWPWXRR-UHFFFAOYSA-N 458.500 0.932 50 20 JCGD COc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1O 916642403 YFAZNAGZRGFLAR-UHFFFAOYSA-N 450.521 0.558 50 20 JCGD Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc(S(=O)(=O)N(C)C)c1C 916829419 YXHZUEJSNVTVNX-UHFFFAOYSA-N 488.975 0.929 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 919835738 QVEITJRRWBSIAP-UHFFFAOYSA-N 462.528 0.456 50 20 JCGD CN(C)N(C(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)[C@H]1CCS(=O)(=O)C1 919988687 BDBZSHVSFXSANB-ZBFHGGJFSA-N 474.561 0.488 50 20 JCGD O=C(Cn1nc2n(c1=O)CCCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 1115835330 VNCTYONPPFUOFN-UHFFFAOYSA-N 476.559 0.407 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1 1778620636 PAYBNDSQZLLOIS-QFIPXVFZSA-N 452.251 0.139 50 20 JCGD CC[S@@](=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2 1778818214 UKVUTMOUAQVEHL-NCILJINDSA-N 451.549 0.109 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779036093 XBBSBRKAZIJKGU-QHCPKHFHSA-N 490.561 0.434 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nccnc3C(N)=O)C2)C1 1779872571 CCXBAMZALOJOJE-YEJXKQKISA-N 496.952 0.151 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1781234567 VQNPOCKXGJQQEN-AYOQOUSVSA-N 460.362 0.523 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1783666966 PGPXEUQITVPTLM-QAPCUYQASA-N 451.358 0.669 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)[C@H]2C1 1783844060 FWLGELRQUBCWBR-GYNGXATPSA-N 481.977 0.399 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1784081817 RJCFAKYVAQWVLR-HSZRJFAPSA-N 456.279 0.200 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)n(-c2cccc(=O)n2C)n1 1784089472 DEICCQRUTXDHGP-LAQRGFTBSA-N 477.949 0.072 50 20 JCGD O=C(CCNC(=O)c1ccc[nH]1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1785249086 UGHXQEMSJJGABH-DUPGQFARSA-N 459.316 0.805 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)C3(C#N)CCC3)C2)C1)NC(=O)NCc1ccccc1 1785367501 SIVUHWSHAWJBTL-XMMPIXPASA-N 468.558 0.856 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(c4ccccn4)CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786982014 XSUCQWMUCODQSH-PMVMPFDFSA-N 492.385 0.271 50 20 JCGD O=C(/C=C/c1cccc(O)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790917217 ZLKMMSLCFVIKTC-XHWLONHYSA-N 450.300 0.379 50 20 JCGD O=C(CCc1cnc2ccccc2c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1792821914 CNBJLUNWZAXNRI-GQEURGSBSA-N 473.338 0.751 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1ccccc1F 1792980218 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0.768 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)C(=O)C(=O)O 1810544440 LNXKRNIDYZSUEM-QAPCUYQASA-N 450.568 0.482 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813072249 COVHMWWAVWVMOA-TVTNDZMWSA-N 460.579 0.765 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337879 XDYNUYSWWHSLCF-XJKSGUPXSA-N 453.333 0.582 50 20 JCGD CC(=O)NCC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815339542 RMLRLQPAPGFUCU-SFHVURJKSA-N 455.324 0.558 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361843 SLQQAOGPCNZPQU-GVDBMIGSSA-N 483.355 0.804 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472372 SKLUKKNJNQUSGZ-KBXCAEBGSA-N 463.307 0.686 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819792763 AHIUXCNAHDCXGC-MNOVXSKESA-N 459.532 0.282 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2)n1ccccc1=O 1820132211 ULPKUFKQJFZIGV-ZIAGYGMSSA-N 460.560 0.851 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(=O)n2[nH]nnc2n1 1823005395 YVGGKMPGNVJGMF-GPXNAGAYSA-N 471.272 0.185 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc2ccccc2)C1 1828548432 KPDYRPVWTZDLEK-JTUHZDRVSA-N 494.976 0.550 50 20 JCGD O=C(Cc1ccc(Br)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725902 MRPACBBYVXKTBH-MAUKXSAKSA-N 476.755 0.443 50 20 JCGD O=C(c1cc(Cl)cc2nn[nH]c12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731387 JCUOGESGEPFMGV-KSSFIOAISA-N 458.302 0.281 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737605 FZVMPHDFVBBNLA-YWMZBHJASA-N 453.879 0.664 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1[nH]nc2ncccc12 1835021424 ASUMJEVAEBPPRM-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD Cc1ccccc1OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835152333 CFDIJVXKDADBLE-XMMPIXPASA-N 483.525 0.143 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3occc3Br)C2)C1 1835936876 GZZZMFHBGOGKIJ-FQEVSTJZSA-N 493.119 0.106 50 20 JCGD O=C(c1cnn2cccnc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1836848505 QMIFDGMCCAPQJX-CXAGYDPISA-N 456.272 0.490 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ncsc13)CCO2 1837071362 NILMYGOCRSFYMT-QHCPKHFHSA-N 496.549 0.679 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccs3)C2)C1 1837457962 YTLQKGLONRNMOZ-NRFANRHFSA-N 459.528 0.059 50 20 JCGD Cc1c(F)ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1N 1837457976 ZITNYVOTZIUGJZ-HSZRJFAPSA-N 486.504 0.099 50 20 JCGD CN[C@@H](CC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1)C(=O)O 1837885967 CMJYWMADLHDCPF-ZFWWWQNUSA-N 452.321 0.738 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837948760 HPYMWEGGYALHPV-QZTJIDSGSA-N 461.302 0.481 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(-c3ccccc3)no1)CCO2 1837996446 ALCUXAGGFCNSCK-VWLOTQADSA-N 491.309 0.405 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1838403767 BSTOELJNVFULBE-PXNSSMCTSA-N 476.412 0.809 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccn3)C2)C1)NC(=O)NCc1ccccc1 1839054138 IQBWRKJTMSUCOS-RUZDIDTESA-N 496.568 0.498 50 20 JCGD Cc1cc[nH]c1C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054363 VTPKZISMLMOCED-VWLOTQADSA-N 498.584 0.739 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1839153768 RUFNXSDCSHBTJE-HZPDHXFCSA-N 450.279 0.624 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C4CC4)cc3)CCO2)C1 1839439623 VMKOSTIHLUOPDM-RUZDIDTESA-N 479.537 0.946 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3c(Cl)cccc13)CCO2 1839495576 NNJANYSQBKBRMG-HSZRJFAPSA-N 498.732 0.280 50 20 JCGD CCOc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn1 1840031395 ODMVWBVNQXTPDC-SCLBCKFNSA-N 457.325 0.729 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS[C@H]3CCCCO3)C2)C1 1840153699 YEAPSHCPVDMBPZ-VDZJLULYSA-N 450.985 0.956 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C)cc3-n3nccn3)C2)C1 1840153954 GLIYKJBATIRUSH-GCJKJVERSA-N 477.949 0.900 50 20 JCGD C/C(=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1)C(=O)O 1840836146 AJNCLSWQQHLBLU-QWWPPESWSA-N 489.953 0.606 50 20 JCGD CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC[C@@H]2C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841353956 ZQTUMGOZSGITCU-HZPDHXFCSA-N 499.008 0.553 50 20 JCGD O=C(CCS(=O)(=O)c1ccccc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010894 RVFIXWSAIZBTFA-UHFFFAOYSA-N 456.329 0.047 50 20 JCGD Cc1cnn(CC(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)c1 1845038787 TVWDBCHAOYHZSL-UHFFFAOYSA-N 453.547 0.741 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@H]2CCCS2(=O)=O)C1)NC(=O)NCc1ccccc1 1845913874 GAPLGEZMJYBLDQ-GOSISDBHSA-N 477.587 0.113 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O 1847233728 IGHBJPNLDXGULQ-XLAORIBOSA-N 481.594 0.179 50 20 JCGD COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1 9930883 GERPHKPFXAVHLP-HNNXBMFYSA-N 481.552 0.716 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cccnc1 20900505 HIKYXVJYADKBJS-OAHLLOKOSA-N 474.948 0.278 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 21967783 BLEFHXYJQVQIJN-HNNXBMFYSA-N 495.583 0.512 50 20 JCGD COc1ccc(CCN2C[C@H](C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cc1OC 728179393 KHLCGCYIJABXTG-SJORKVTESA-N 453.561 0.587 50 20 JCGD CCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 730006920 HRGRDZXOTSSOEF-QHCPKHFHSA-N 495.448 0.898 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)NCCS(=O)(=O)N2CCOCC2)N(C)c2ccccc21 748057827 OIGJLCPVBXDXEN-UHFFFAOYSA-N 461.544 0.435 50 20 JCGD Cc1c(F)cc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 751261100 ITKGTLIQQDDFJH-UHFFFAOYSA-N 459.477 0.706 50 20 JCGD CS(=O)(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1 751282445 LQUILWPWRDUSMQ-UHFFFAOYSA-N 496.386 0.654 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)nc2)cc1[C@]1(C)NC(=O)NC1=O 917746568 KNXAEUPFKLJAEP-KRWDZBQOSA-N 453.864 0.422 50 20 JCGD O=C(CSc1nnc(C2CC2)n1Cc1ccccc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886078 TYOBFRTUGFVCON-HNNXBMFYSA-N 464.573 0.813 50 20 JCGD O=C(Cc1ccc(NS(=O)(=O)c2cccs2)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919889367 LNNGCZOSIXKURZ-AWEZNQCLSA-N 472.570 0.609 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)C[C@@H](C)n1ccnc1)N(S(C)(=O)=O)CC2 920596048 DKKZDLTXYROOGM-PBHICJAKSA-N 479.559 0.948 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnc[nH]1)C2 1778091743 PTHDBZZHRHFBAP-VJDWAPLVSA-N 469.546 0.990 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1778095285 VTLVYANKDHZXQE-QZICUBQQSA-N 489.577 0.007 50 20 JCGD COc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1779030541 BVPZITSDXIVCHN-JOCHJYFZSA-N 454.487 0.154 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)SCC(=O)N4)CCO2)C1 1779030873 YVXDHCPAWOXMGF-HSZRJFAPSA-N 496.549 0.487 50 20 JCGD O=C(CS[C@@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779409035 PCXLYHCIRWOJPZ-KJXAQDMKSA-N 476.404 0.754 50 20 JCGD CN(C)c1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1780373246 YPOIKOMENJCYKT-RCZVLFRGSA-N 465.359 0.874 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CCc3ncc[nH]3)CCO2)C1)NC(=O)NCc1ccccc1 1780968584 FIOIJRCEBKGKIR-XMMPIXPASA-N 483.573 0.518 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1)n1ccnn1 1782764701 GLWMBWWHQVSZMO-WZONZLPQSA-N 484.561 0.015 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1782786594 ASDMDSJPIASKDI-CJNGLKHVSA-N 461.244 0.277 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1783339136 OXWQALWAGKRUQM-NJSLBKSFSA-N 478.384 0.875 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1783537774 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492.579 0.987 50 20 JCGD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2)C1 918001663 FBHULAIWHINUNX-INIZCTEOSA-N 487.586 0.826 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)cc1 919885206 NVPGBQHHBKIRKY-QGZVFWFLSA-N 494.551 0.821 50 20 JCGD CCCCCCOc1ccc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 920449362 QGLBFAHLIAKJLQ-UHFFFAOYSA-N 456.503 0.854 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCO3)C2)C1 1778282885 YNTRBVIDIXXRBV-SXWKCWPCSA-N 465.978 0.971 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)OCCO3)C1 1778444497 WAKTXOMSVWPVRP-HYBUGGRVSA-N 474.558 0.958 50 20 JCGD Cc1ccc(NCCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(C)c1 1779117529 UCUPGKVTRMWWBT-VWLOTQADSA-N 465.359 0.929 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097725 GORZOAGVAFBTGE-JLCFBVMHSA-N 491.501 0.671 50 20 JCGD CN1CCCC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1780592599 VXQUOLHCKBYSFB-YCRNBWNJSA-N 458.563 0.297 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)nc3cccnn13)C2)[C@H](F)Br 1780773502 FZFSFBHLGARKEA-ACWOFJMJSA-N 482.310 0.908 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)CC1 1781330638 ZVILOLVBIMRJIP-CZUORRHYSA-N 470.361 0.178 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334117 VJSWAWURZKYNRO-PKOBYXMFSA-N 499.374 0.593 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccc3nc[nH]c13)C2 1782211843 BGLCZDLWNQZJID-OPAMFIHVSA-N 457.535 0.458 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1782671935 GDMKIHXKUAGFMK-TYILLQQXSA-N 453.337 0.813 50 20 JCGD O=C([C@H](O)N1CCOCC1)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783021517 CTNOYIYJJJXKGQ-KAGYGMCKSA-N 496.402 0.473 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)COCCOCCOCCOC)C2)C1 1783685531 DISDXSDYORVURU-PXNSSMCTSA-N 495.411 0.686 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1 1783966965 NFOHZFFRDUEZOW-HYFYGGESSA-N 450.330 0.062 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)CCn3cncn3)C2)C1 1784338939 FMYDVGMFGPVCNG-NRFANRHFSA-N 472.458 0.645 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)c3cccn3C)C2)C1 1784608360 ZKHXHZLDWGZROF-VCOZGABYSA-N 454.487 0.172 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COCCO)C[C@@H]21 1785078776 AXZQTVPVQVSNKD-VGWMRTNUSA-N 463.959 0.107 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CC1 1785317321 RNNGVPHKYRUUTO-KKSFZXQISA-N 457.955 0.983 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3N(C)C)[C@H]2C1 1785756424 MQVXTOMTYAPQSW-YUCXHDEDSA-N 481.557 0.875 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(C)n3)[C@H]2C1)NC(=O)NCc1ccccc1 1786084699 MLIHIYWGMJAKDA-ZJOUEHCJSA-N 483.573 0.360 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cnc(C(F)(F)F)cn1 1787247460 UXKVRLZDHNNXLE-QRTARXTBSA-N 478.236 0.082 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c[nH]nc34)C[C@@H]21 1788610257 NAIILNIYRZGRKT-JVPBZIDWSA-N 463.498 0.469 50 20 JCGD CC(F)(F)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611742 XYEROSPTLFKWTR-RCBQFDQVSA-N 453.490 0.960 50 20 JCGD Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(C(F)(F)F)n1 1788896484 HEDXIMPGKSXIAO-QRTARXTBSA-N 480.252 0.026 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1OC 1789545759 VBBIGYORDPLRBE-ZWOKBUDYSA-N 462.547 0.670 50 20 JCGD CC(=O)C[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1791221701 DQZZYBQWIBIYOC-MNAPGUCWSA-N 487.601 0.928 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1O 1792729193 VRSCDQCZHUKXGM-JKWNGSSESA-N 483.525 0.667 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccc(F)cn3)CC1)C2)[C@@H](O)CCl 1792984412 ZVOPRUCXKRELLA-HIRMHNASSA-N 454.930 0.626 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795115229 RDWHGHVJMYDFFM-UMPJEAMMSA-N 478.384 0.637 50 20 JCGD CCn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c2ccccc21 1796020585 FMCXMMIEFSACBJ-YVWYUNDQSA-N 477.525 0.572 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796187791 FHMBTBZZPNRGTF-WKCHPHFGSA-N 489.337 0.233 50 20 JCGD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)n(-c2cccc(=O)n2C)n1 1796391711 ZWKLGJFLIKRSMG-BCDXTJNWSA-N 483.573 0.504 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(C(F)(F)F)c1 1798251076 SGYUWCZHKGJELP-FVCICTRLSA-N 478.431 0.616 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1798640503 FOBBAIKJXHISQJ-RCJHGTSTSA-N 476.486 0.923 50 20 JCGD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1)n1cnnn1 1799869534 SKZGOLUBOLDRQC-KANFNMMFSA-N 469.550 0.219 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2 1800757277 CLYKEUVYFYSEGN-DNVSUFBTSA-N 460.350 0.472 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOCCNC(=O)OC(C)(C)C)C2 1800971118 QGEMCMPHWPPICZ-KYHPRHEASA-N 477.986 0.761 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC(=O)N1C(=O)OC(C)(C)C)C2 1800980859 GMCKKJKVZYZXGI-SVZOTFJBSA-N 473.954 0.756 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)c2c1 1801011614 RYOQGBUEYSQKAA-YEZVWNJWSA-N 457.531 0.753 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1801375075 QTSCFEQBLXPRNU-WRHDZBKDSA-N 497.600 0.455 50 20 JCGD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1cncn1 1802960973 LXLHVKPRPHYIGK-RSPOEFSDSA-N 468.562 0.824 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H]1COc2ccccc2O1 1804196631 KBUDVSBZIJYIEG-WDJPJFJCSA-N 487.321 0.921 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)COc2cccnc2)[C@@H]1c1cccnc1 1804338757 GDMILYCMNFYCIZ-MBSDFSHPSA-N 454.531 0.934 50 20 JCGD CCc1[nH]nc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1805174883 DIHAWGAFRPUPCE-IERDGZPVSA-N 465.294 0.819 50 20 JCGD O=C(CCBr)N1CCC2(CCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)CC1 1806699309 GSWSSRBMOSCZLO-UHFFFAOYSA-N 464.426 0.733 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807363676 CFVXTRRENXPWDG-AUSIDOKSSA-N 461.331 0.664 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368180 ZOJSJFNSOVEBJA-XMSQKQJNSA-N 459.315 0.538 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCc2cnccn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375584 SYYJUIZRAPAQLO-XXBNENTESA-N 459.315 0.504 50 20 JCGD Cn1cc(CCC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1807427967 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O=C(CCC(=O)N1CCCC1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336860 GRQZWCKGORCBPW-MRXNPFEDSA-N 470.360 0.451 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCc3nc[nH]c3C1)CC2)c1cccc(B(O)O)c1 1815361751 QITFTQUAWPEMLL-UKRRQHHQSA-N 465.344 0.577 50 20 JCGD C[C@](O)(C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(F)(F)F 1815527551 DEKMZDGMNWTBQA-KSSFIOAISA-N 454.214 0.709 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)/C=N/O[C@H]3CCCCO3)sc2C1 1819905346 ZPWDHZRFOXGTPT-UMMVRMJUSA-N 487.542 0.896 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1825126854 DDLNLEWGZHRFTG-IBGZPJMESA-N 484.517 0.723 50 20 JCGD NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551140 KENZYLCTDZOPJR-HTAPYJJXSA-N 480.949 0.304 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829041454 MRPSXXMTUFAHFF-NRFANRHFSA-N 464.331 0.633 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CNC(C)=O)C2)C1 1829341181 YBOJXYGBMWOPTL-WMZHIEFXSA-N 494.976 0.828 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)C(O)O)CC1)NC(=O)NCc1ccccc1 1830165090 LQTMBSPOFXFWHD-IBGZPJMESA-N 461.563 0.263 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2)CC1 1830720295 WNPTXEAEDOFSAY-OFNKIYASSA-N 480.993 0.108 50 20 JCGD O=C(c1ccc(CCN2CCCC2)nc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728960 ZITHGLFQRJJYQF-REWPJTCUSA-N 480.993 0.390 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830996679 NTNNWJXWFGGTGX-FSBGXSNOSA-N 489.997 0.736 50 20 JCGD O=C(Cc1ccc(F)cc1Cl)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832274418 FRGCZBRSRRYZJX-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)CCO2)C1 1833024282 INJHEMDCIZQHDV-FPTDNZKUSA-N 482.965 0.714 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1 1833033155 PTLBWVPRMVSBHM-FZKQIMNGSA-N 474.377 0.718 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1 1833264831 LXBWMMHUEYDPGX-HUUCEWRRSA-N 495.484 0.917 50 20 JCGD O=C(c1cnc(-c2ccccn2)nc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833289768 ZPPVCBBEGPPRSB-LAUBAEHRSA-N 461.906 0.208 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C(F)(F)C(F)(F)C(=O)O)CC2)CC1 1833663680 QTDROFKCJRXFPV-UHFFFAOYSA-N 497.490 0.286 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn(C)c1)CCO2 1833851926 UBRFISFBRXZHQK-ZHNJOBQTSA-N 456.503 0.229 50 20 JCGD C[C@H](Cn1cccn1)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833885957 PQXCQDRFTZMHTR-GOSISDBHSA-N 467.379 0.084 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1835095199 MMMGJZVPPXEWHK-ROUUACIJSA-N 491.029 0.697 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)COc3cccnn3)CC2)CC1 1835117988 DQYVHOQARCZGQS-OGLMXYFKSA-N 496.572 0.561 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CCn3ccnn3)CC2)CC1 1835117999 GNXZUEISKZHXLR-WPWMEQJKSA-N 483.577 0.374 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1835737164 QYMHEASGHJAGMR-UHFFFAOYSA-N 481.557 0.588 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(C(N)=O)cc3)CC2)CC1 1835737416 RZXBHMPRCMPYII-UHFFFAOYSA-N 493.568 0.283 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1 1835930756 YIYRERIZQNUQCT-HSZRJFAPSA-N 498.732 0.280 50 20 JCGD O=C(c1ccc(-c2cc[nH]n2)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932087 NCXSPPDJYRVGIX-VWLOTQADSA-N 490.325 0.140 50 20 JCGD CC(C)n1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1836182370 PUCKALYCFKITRL-UHFFFAOYSA-N 467.379 0.643 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C\C(=O)NC3CC3)CCO2)C1 1837247020 KYOOMHJJJGONFS-LFSDFAJISA-N 458.353 0.309 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccoc3C(F)(F)F)C2)C1 1837457635 LGNYHQNVBCMDEZ-FQEVSTJZSA-N 497.430 0.681 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4occc34)C2)C1 1837457783 QXYIADXSMSGVHG-QHCPKHFHSA-N 480.481 0.210 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(Cl)c3)C2)C1 1837459251 AFVUISZDMSJFOD-JOCHJYFZSA-N 473.917 0.722 50 20 JCGD Cc1nccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1837919478 WJXSQWUBSGEPTF-UHFFFAOYSA-N 452.320 0.391 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)nc1Br 1838378064 ZOPDDCSHZKEILM-FZKQIMNGSA-N 492.754 0.522 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839044366 BUMDPZBWGQAQTD-GOSISDBHSA-N 477.370 0.152 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccncc3)CCO2)C1 1839059340 DBUOVJRQXUDEKP-NWJFTTBMSA-N 468.514 0.215 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1839965143 OBOADNDGRDLNHN-MEDUHNTESA-N 460.285 0.561 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1840032875 MQCYOFTYLCHMQH-HACGYAERSA-N 461.382 0.253 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1 1840154848 HTTLSWJTJURURI-LAUBAEHRSA-N 453.898 0.950 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187241 OVFHOMRFUNDIGJ-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840911482 FZSYNBASZHZHRU-IZZLDSCCSA-N 487.981 0.440 50 20 JCGD N#Cc1ccc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c(C(F)(F)F)n1 1843011001 FCQUOXTUIVZQHL-UHFFFAOYSA-N 458.205 0.783 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)CC1 1843015566 PRBJZPIAYRNFCM-UHFFFAOYSA-N 471.363 0.831 50 20 JCGD CN1CCN(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC1 1848099544 NMCMUKKUKQBUBR-BZSNNMDCSA-N 472.030 0.958 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Nc1cccnc1OC)c(=O)n2Cc1ccccc1 726874969 DICYHGNKAKRHFX-UHFFFAOYSA-N 492.496 0.684 50 20 JCGD COc1cc(C=NNC(=O)Cc2csc(N3CCOCC3)n2)cc(OC)c1OCC(N)=O 730543211 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4ccnc4c3)C2)C1 1778567881 GVRKKQIEQQINRI-LRULAXNGSA-N 463.498 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCc3c[nH]c4ncccc34)CCO2)C1 1779035723 MGGSKVKSOOAARB-XMMPIXPASA-N 477.525 0.638 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1cn3c(nc1=O)SCC3)CCO2 1779299666 DFIXBNLIUOUVSJ-FQEVSTJZSA-N 466.636 0.573 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)ccn1 1779561397 TWTNQYUPXYVDRL-RUZDIDTESA-N 496.568 0.880 50 20 JCGD COc1cccc(OC)c1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1780538937 LWSAAHLOCWNZMF-QHCPKHFHSA-N 469.498 0.460 50 20 JCGD COCCOCCOCCOCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1780797879 UNYAZODYHDNTNR-WOIUINJBSA-N 495.013 0.186 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1c(F)ccc(O)c1F 1781091100 YOBHPIOHYXUCKC-WZONZLPQSA-N 474.269 0.792 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCN(C)CC1)C2 1781901950 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2nccc-2c1 1796194756 GMHRFANWCBIOOX-ZDEVRQBLSA-N 463.498 0.852 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCO3)C2 1796441854 ANRYHFXETCYJAJ-IHHIPJHASA-N 469.502 0.003 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796445750 IVLNKPVGFMKCRZ-HVNKAIIDSA-N 485.541 0.465 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798442162 ZBTBVJAYHITDBP-QDMKHBRRSA-N 460.535 0.850 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)C1 1799350444 RBHPDRWVYYQXGF-KHMAMNHCSA-N 494.358 0.902 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])C2)NC(=O)NCc1ccccc1 1799871673 UNKLWJAROYCLBX-BJWYYQGGSA-N 484.517 0.916 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@H](C)Br)C2 1800762562 VIXLBCYABLYDSV-JGFGOLAASA-N 497.390 0.995 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccc(Cl)cc3n1)C2 1801011369 IJBBABBVSFQKDJ-VTEUUUEMSA-N 462.938 0.564 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1CNc3ccccc3O1)C2 1801011607 QTQNUVIPFYFUGN-IPPNXFFKSA-N 459.547 0.212 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1Cl 1801791368 CDCJZZBCXKERJI-CWPLJXCYSA-N 458.707 0.545 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1802243295 KDTZXISWXJWDPD-IZZQQSIFSA-N 489.378 0.121 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1806340885 PLLVOACOSKVIQK-CJNGLKHVSA-N 463.269 0.597 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)CCC(N)=O)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807452511 IIFOWIWPLZBPDJ-RDPSFJRHSA-N 495.584 0.699 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)C(=O)N(C)C)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807452666 KQPNYYABNNSLRB-RBBKRZOGSA-N 495.584 0.522 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)c2ccco2)[C@@H]1c1cccnc1 1810295719 WIXREIOWAIREEW-CWFSZBLJSA-N 464.482 0.726 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1 1810301922 DXESXFWBAYRKFA-HRAATJIYSA-N 485.508 0.756 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810301998 FPYQPINDXRARJE-VQIMIIECSA-N 477.529 0.886 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1 1810302242 GYYPLKJPBKBTTF-OXJNMPFZSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1 1810303072 PCKRFHOBAYSQQI-SUMWQHHRSA-N 479.457 0.345 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810305200 JAUHVDRDKYRHRF-VGSWGCGISA-N 476.541 0.982 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)N1CCN(C)CC1 1810306123 UPNHGMDDNQUBSC-SFGWALBWSA-N 494.600 0.036 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1 1811315586 MMKLTNLDDAJPKI-JXFKEZNVSA-N 468.514 0.898 50 20 JCGD CC(C)(NCCC#N)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1814976210 ABPAEQWKGQLTMG-HNNXBMFYSA-N 455.349 0.331 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815359729 BGRLVCIWUFAKEK-SMDDNHRTSA-N 461.305 0.610 50 20 JCGD Cn1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cc1O 1816123727 UKBJYJXWWAELGF-HNNXBMFYSA-N 453.463 0.467 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817475654 QFOQVWDGQVBEED-KXBFYZLASA-N 450.308 0.928 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nc2ncccn2n1 1818617598 GCNNXDNUXJWYKH-INIZCTEOSA-N 460.263 0.147 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403380 HXJQGTDISDGEDX-BLLLJJGKSA-N 454.491 0.405 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1 1819610063 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Cc1cn2c(=O)c(C(=O)N3CCOC[C@]4(CN(C(=O)CCBr)CCO4)C3)cnc2s1 1834821744 WQAPRPMIIVUHLT-IBGZPJMESA-N 499.387 0.919 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835117969 BZYGUHJHCUZQRE-WJGWSCHNSA-N 473.578 0.217 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)nc4cccnn34)CC2)CC1 1836101174 PBZIDZJRXDHEFZ-QGZVFWFLSA-N 476.965 0.529 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1836215620 GLYSMJFTXAWJDU-CJXDPKRBSA-N 479.933 0.348 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(NC(C)=O)cc3)CCO2)C1 1836666270 CRXHDMPKYGVTSR-UGKGYDQZSA-N 467.950 0.898 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1 1836717318 TWWCUJXVANCMKH-GOSISDBHSA-N 468.982 0.885 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)CCO2 1836797314 UHZBCKCTERTOMU-DEOSSOPVSA-N 499.279 0.510 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)N1C[C@H]2C[C@@H]2C1 1838370518 PXOVBOKWRNRQKO-GUDVDZBRSA-N 463.623 0.698 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1 1838740289 IQRICUVNUTXBST-SJORKVTESA-N 450.985 0.816 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC2)CC1 1838789200 KWNPTKMRPACFQX-IYARVYRRSA-N 452.596 0.909 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2 1838862394 OVLYWBICWHNZQF-QFIPXVFZSA-N 475.452 0.347 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839203087 ZFDGQMYAELXZLQ-OHNRDTAOSA-N 487.326 0.347 50 20 JCGD NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802006 JTMADZIFQIQWEJ-DYESRHJHSA-N 482.375 0.715 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccnn3)C2)C1 1839967564 QJBPUSOMNJBFAL-KDOFPFPSSA-N 457.325 0.485 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1 1840154909 JOYWFJKRUNYHMN-QFBILLFUSA-N 457.867 0.624 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(O)cc4)CC3)C2)C1 1840182565 NPYMYMPSMQEJGF-QHCPKHFHSA-N 474.558 0.253 50 20 JCGD Cc1csc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c1 1840183059 ZYJHHKQKPHTFDZ-JOCHJYFZSA-N 466.604 0.819 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1cccs1 1840374508 ZCBOHJRXBVXHDU-AOMKIAJQSA-N 458.345 0.302 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCc2cncnc2)C1)NC(=O)NCc1ccccc1 1843054031 YMKMKYSESFXZMZ-UHFFFAOYSA-N 465.558 0.959 50 20 JCGD C[C@@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1cncn1 1846600478 DGRYQXSTMMRQBY-KRWDZBQOSA-N 454.535 0.389 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847568688 IJFWFHVSIYTIMY-ZQDZILKHSA-N 475.974 0.130 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O 12802082 UROIZBSHUUQKGG-CQSZACIVSA-N 485.522 0.830 50 20 JCGD O=C(NNC(=O)c1ccc(N2CCOCC2)nc1)c1ccc(S(=O)(=O)N2CCCC2)cc1 14347828 CEAUURHQQIZERN-UHFFFAOYSA-N 459.528 0.778 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cccnc1S 29232694 ZOLAKWXQUAPKGN-UHFFFAOYSA-N 450.542 0.785 50 20 JCGD NC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)CCCc3ccccc3)CC2)o1 727845047 BNZNSVXIVRCCOA-UHFFFAOYSA-N 463.516 0.449 50 20 JCGD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728846226 VJORMMKNARCPSV-UHFFFAOYSA-N 457.882 0.792 50 20 JCGD COc1ccc(NC(=S)NNC(=O)CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)cn1 729693171 MJTHJJKGHRGVFL-UHFFFAOYSA-N 466.545 0.687 50 20 JCGD COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)o1 730766316 KRDADUDOTNBQTM-UHFFFAOYSA-N 457.486 0.474 50 20 JCGD Cc1nn(C)c(C)c1[C@@H](C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 746760511 VRNXONDONOCKEO-OAHLLOKOSA-N 477.587 0.942 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2nn(-c3ccccc3F)c(C)cc2=O)n1 762653493 TVIZOCUXAGCDQP-UHFFFAOYSA-N 459.459 0.992 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1OC 768961209 LBUPIZFMMMBFLF-LBPRGKRZSA-N 455.464 0.736 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)c1 818323453 YHSPFFFARWQQIX-XFXZXTDPSA-N 466.541 0.783 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)C[C@@H](C)O1 912919060 HWMXYSDZMMAPJA-TXEJJXNPSA-N 467.375 0.918 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)CSCC(=O)NNc1ncccn1 913044433 ZPYJJCFJYFJPFO-UHFFFAOYSA-N 496.571 0.321 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1ccc(-n2cnnn2)cc1 913155919 DULDBLKEJVSHDJ-UHFFFAOYSA-N 465.495 0.945 50 20 JCGD NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)=NN1c1ccc(F)cc1 913471152 GDEDHUYPPGAEFL-INIZCTEOSA-N 451.418 0.598 50 20 JCGD Cc1cc(C)n(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 915889889 PIONCZHQZVPSAT-UHFFFAOYSA-N 464.548 0.555 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCCCN1CCCC1)N(S(C)(=O)=O)CC2 916196159 PJOZIPCEMALURM-SFHVURJKSA-N 497.618 0.769 50 20 JCGD Cc1ccc(C)c(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)c1 916391849 JGRRLKXSCSPZSA-UHFFFAOYSA-N 453.499 0.785 50 20 JCGD O=C(NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 916649102 IJUDMXKPOHSYSS-UZLBHIALSA-N 490.538 0.814 50 20 JCGD Cc1nccc(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC(C)C)n(Cc3ccccc3)c2=O)n1 917392859 UXNUKBDWRKDRDT-UHFFFAOYSA-N 490.524 0.624 50 20 JCGD O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1C1CC1)NNC(=O)c1nn(-c2ccccc2)cc1O 920274941 JUQGBCMYSCCDLF-OAQYLSRUSA-N 474.477 0.815 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)c1cc2n(n1)CCCNC2=O 1778916922 OPBNGRNPLPNMQK-OXQOHEQNSA-N 482.379 0.929 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)C1 1779029612 VRSZFDLEJAATHC-OBWXTZQISA-N 487.557 0.498 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4nccnc4c3)CCO2)C1 1779031932 HVHBKHJGQFAAEG-HSZRJFAPSA-N 461.482 0.386 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCC1)C2 1779375755 SPMNFSDFWJWTRP-AUSIDOKSSA-N 458.563 0.299 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2)n1ccccc1=O 1779527384 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ALNVUOSFEOFGKU-GFCCVEGCSA-N 465.557 0.765 50 20 JCGD C[C@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)C1=O 22245148 HXAXWWVWZZBAPC-HSZRJFAPSA-N 499.549 0.647 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1 24400050 PIULWKVHCOLQQN-UHFFFAOYSA-N 459.528 0.750 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc2[nH]cnc2c1 28580982 IJNNHXCFVFLSPR-UHFFFAOYSA-N 457.512 0.978 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cn1C 726642832 JOMBXDVEJDFUMH-UHFFFAOYSA-N 457.896 0.055 50 20 JCGD CNS(=O)(=O)c1ccccc1N1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1 727832346 SBKVAOCKZOHRGW-UHFFFAOYSA-N 476.515 0.086 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1 730516924 PIOQZIMGDMOXIQ-KRWDZBQOSA-N 488.522 0.522 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)C1(C(=O)NC3CC3)CC1)N(S(C)(=O)=O)CC2 749721470 XLKBWOBZMDUATP-MRXNPFEDSA-N 494.570 0.159 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)ccc1Br 751281072 ANRTUAYMWYFJTD-UHFFFAOYSA-N 460.262 0.568 50 20 JCGD O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 912638422 FVWPRVAAINGNDF-HDICACEKSA-N 492.554 0.034 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1csc(N2CCOCC2)n1 912852231 UICMEDMADHDOGF-UHFFFAOYSA-N 475.552 0.872 50 20 JCGD CN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1 916225877 HKYYICKXQGOFNE-UHFFFAOYSA-N 461.544 0.788 50 20 JCGD CN1C(=O)N(CC(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C(=O)C12CCCCC2 917243440 UIXYPLVOGNXQKR-UHFFFAOYSA-N 461.431 0.496 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3cccc(N(C)C)c3)n[nH]c2n1 917388269 YJVHZWGPKNZUOZ-UHFFFAOYSA-N 458.552 0.424 50 20 JCGD C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 917719942 PEIDISJCIPXZDP-UHFFFAOYSA-N 466.541 0.476 50 20 JCGD COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 917722665 ZCRSUDQOZNSFKF-UHFFFAOYSA-N 497.551 0.646 50 20 JCGD CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 1334439144 HSDYJEVNYHSRFG-UHFFFAOYSA-N 460.582 0.128 50 20 JCGD Cc1cccnc1CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029141 RNSZUWCPHLVNGS-HSZRJFAPSA-N 452.515 0.465 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1n[nH]c2cccc(F)c12 1781392651 AQSTWDCJICFABR-NTKDMRAZSA-N 480.305 0.823 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782544064 RBJWKCXRYKZMSV-HCLVMJGWSA-N 454.336 0.027 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1783532006 HAAVXPFSDVOVIB-YVEFUNNKSA-N 460.350 0.712 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)CCO2 1783533542 ZNSTWKXZYJOMLP-KZDUYQQSSA-N 490.395 0.970 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)CCO2 1783538429 VHPVCTFLDBTVAB-YYQBIWNASA-N 490.395 0.828 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)CCO2 1783538921 YVBVVQYKAYOJHE-KSMMKXTCSA-N 478.384 0.875 50 20 JCGD C=C1C[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)N(C(=O)OC(C)(C)C)C1 1784089366 CSNBEIAVAQSHQT-CPJSRVTESA-N 499.373 0.376 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCC(=O)NC3)C[C@@H]21 1785074676 XYIGUHUDNUTXLH-XAJHFOFHSA-N 486.997 0.624 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)C(=O)CC4)C[C@@H]21)c1ccc(B(O)O)cc1 1786981659 DNDLCLZXKGOMMS-HARLFGEKSA-N 462.311 0.402 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3COCCN3C(=O)OC(C)(C)C)[C@H]2C1 1787422008 KUVHLLUPMQCVCB-JCECYMMASA-N 489.997 0.856 50 20 JCGD C[C@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cnccc5C(=O)NN)C[C@@H]43)n[nH]c21 1787953712 ZVGQRHGJYVEBBJ-LUVWLHFXSA-N 467.530 0.365 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[nH]c4nccc3-4)C[C@@H]21 1788610348 NCELZIFEQSPYQF-AGRHKRQWSA-N 463.498 0.420 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CC(O)C3)C[C@@H]21 1789221119 VBKMXBBUIQBTHE-CIBGEVFRSA-N 461.471 0.884 50 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Nc1nc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)ccc2s1 1795734819 ULKLCAUULHRAHD-CCWDJLKJSA-N 466.328 0.075 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccccc1)C2 1796440842 BPEDGWWIJSSVJR-GJPBQQDYSA-N 451.483 0.593 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1797699528 DLAWXCKKJCBZJT-FIIQBIKZSA-N 491.501 0.431 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](N)c1cccc(Cl)c1)C2 1797750763 SDDCJOQFBQNWIN-GTYSZEQSSA-N 472.933 0.242 50 20 JCGD COc1nc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1798246409 QNTZBDZJUHKEDS-SIQZSBGDSA-N 468.514 0.736 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095449 XOZVLXROLFGIAA-JHDGKUDLSA-N 497.600 0.586 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc(-c2cnco2)c1 1799646996 UAQANEJCOIASRP-HATOLVCRSA-N 461.283 0.538 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802334039 GIXBYNJUEDZZPF-XDCWJTEKSA-N 483.610 0.926 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C(=O)C1 1804524500 IHMTVSWEUMOVDK-FZKCQIBNSA-N 472.970 0.304 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1804577907 ZHQONXFLFDEBBV-NFBKMPQASA-N 461.331 0.595 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368024 WMRTXUNUPRRSSN-WIYYLYMNSA-N 475.314 0.374 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1807368530 UXMATBVTHWVZFT-HKUYNNGSSA-N 451.288 0.034 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1 1807373627 CSDGNKOQEAMOQJ-XMSQKQJNSA-N 476.298 0.946 50 20 JCGD O=C(Cc1ccc(F)cn1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807477155 HLMIVUGGOLEOFS-WZONZLPQSA-N 462.290 0.858 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1cncn1 1810306880 BELXBPROEKEWKG-IDHHARJASA-N 463.502 0.252 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1 1813075213 XXAOYJJQDQRBNA-GAJHUEQPSA-N 469.546 0.589 50 20 JCGD O=C1COc2ccc(C(=O)N[C@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)cc2N1 1815344310 SNLWFRAIYOXFAY-HNNXBMFYSA-N 492.322 0.693 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccn3c(O)nnc23)n[nH]1 1817968151 PLUNYUYDWDGKDY-HNNXBMFYSA-N 469.506 0.837 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)n1ccccc1=O 1820123742 CANQUJDHJJGHFP-BBRMVZONSA-N 466.328 0.472 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(O)c([N+](=O)[O-])c1 1823224460 XQSQFTWUDVNRFB-CQSZACIVSA-N 482.283 0.976 50 20 JCGD Cc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c(=O)[nH]c1C 1827050701 UXSXZFQHDVLPNW-FQEVSTJZSA-N 466.347 0.614 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=N)N)CCN2C(=O)OCc2ccccc2)C1 1828972210 ANVSDGJTBPERLT-HTAPYJJXSA-N 478.981 0.939 50 20 JCGD O=C(Cn1cccn1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829017662 NQLUIOJYADNHMY-CVDCTZTESA-N 489.960 0.935 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cncnc3)C2)C1 1830538288 AZAULAVRCCRTPS-DNVCBOLYSA-N 455.353 0.897 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1830538373 DQNANPPHVMYXBT-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD O=C(c1cnc(C(F)(F)F)cn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830722727 HFNCRORWAWOBCV-LRDDRELGSA-N 452.817 0.165 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830732455 YNGPINDWYZDJQH-URZJWIJPSA-N 489.997 0.690 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c([N+](=O)[O-])c1 1830736233 SAPUYZBVQAOEDF-OXJNMPFZSA-N 485.877 0.051 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830738736 SYCMYISCBXKQJF-AVYPCKFXSA-N 463.959 0.203 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnco3)C2)C1 1832549452 PSGDWMCOHGLMLL-VBKZILBWSA-N 472.926 0.877 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccn1 1833371019 RZXWSEJWKLCHHH-VWLOTQADSA-N 496.568 0.761 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833397059 RNZUNVNSLFBSTR-FQEVSTJZSA-N 473.979 0.820 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(=O)n3O)CCO2)C1 1833469114 ZXCIRHLMIREPKI-ACJLOTCBSA-N 458.309 0.187 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)ncn3)CC2)CC1 1833554223 PWSBLIHHLVJNMY-RWPZCVJISA-N 482.545 0.501 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)ccn1 1834800982 DOQLWYLJGVWHGS-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD O=C(Cc1cscn1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834838792 ZZMQRIDKFMPPJO-UHFFFAOYSA-N 456.377 0.251 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCN3C)CC2)CC1 1835116748 ZWVXWCNTMFRDFW-XLKFHUSGSA-N 471.606 0.786 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1 1835931283 KZQZFJKOSRBJJK-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD O=C(c1cccc(-c2cnco2)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939282 KGGCBZVGDQBMBI-RUZDIDTESA-N 491.309 0.405 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cn4ccccc4n3)CC2)CC1 1837920198 HHKPDADVAAXAMX-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD Cc1nnsc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838139610 PCIIEYDKUXHBBU-UHFFFAOYSA-N 452.581 0.832 50 20 JCGD CC(=O)C[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838395321 CKYJLYDVMGLMJR-OAHLLOKOSA-N 459.547 0.913 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3)C2)C1)NC(=O)NCc1ccccc1 1839054094 GTNNVWANUFMFIB-RUZDIDTESA-N 496.568 0.498 50 20 JCGD O=C(/C=C/C1CCCCC1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839182733 NYOKJBDMIMVXCY-HBRDYDSTSA-N 456.348 0.573 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1 1839203740 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CC1(CC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CN(C(=O)OC(C)(C)C)C1 1847140976 STLCGVNQWYHSKS-UHFFFAOYSA-N 471.363 0.831 50 20 JCGD O=C(COC(=O)CCN1C(=O)c2ccccc2C1=O)NNC(=O)[C@@H]1COc2ccccc2O1 8647531 ZVPXYLWYKZONGM-KRWDZBQOSA-N 453.407 0.203 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c1C 9845149 XBPBOELYVIOYPA-MJOIQJIUSA-N 457.487 0.625 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)Cc1ccc(Cl)cc1 14935665 HJWORXATMALZSJ-QGZVFWFLSA-N 487.987 0.812 50 20 JCGD CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)ccc21 15245303 IHNHJUGQMBJJSE-UHFFFAOYSA-N 472.932 0.520 50 20 JCGD CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)CC2)cc1 16785892 CCALRZPISPAPQW-QGZVFWFLSA-N 471.601 0.793 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(C)c(S(N)(=O)=O)c2)cc1OC 105813502 RTYKEKRTARCDCD-UHFFFAOYSA-N 451.457 0.278 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CCCN(C(=O)N4CCCC4)C3)cc2)CC1 728214134 LVLWOCKHLLWCCL-SFHVURJKSA-N 478.619 0.994 50 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0.878 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)OCCO4)CCO2)C1 1779030664 SSCQWHKNPSUPLU-HSZRJFAPSA-N 467.482 0.214 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(Br)cn3)CCO2)C1 1779032569 UEOBOUFBGSFTOE-FQEVSTJZSA-N 489.330 0.600 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779034049 KEQRTYQPOUAWSG-HSZRJFAPSA-N 455.490 0.819 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)C(C)C 1779206254 SXNGQBBFWCGVQE-ZRCGQRJVSA-N 460.336 0.082 50 20 JCGD Cc1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)ccc1F 1779371173 NLWXCAZAAJXPOL-AUSIDOKSSA-N 470.505 0.969 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CNC(=O)C1)C2 1780055349 QFOSVIPGHWVMOQ-NFHUAXAMSA-N 488.497 0.784 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3ncccn3)CCO2)C1 1780095851 XRJJKEBWOGQQSD-JOCHJYFZSA-N 469.454 0.996 50 20 JCGD 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JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)[C@H]2C1 1789768339 DAZAFBGIPFCBEN-MMRYBOCRSA-N 498.584 0.501 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C[C@@H]21 1791291138 NJRFRMSAVYADAO-KKHBGXIRSA-N 469.542 0.375 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1792255380 KDUKMZXWOYREBJ-VIQHNZTISA-N 457.955 0.482 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792981289 JCKWHRJDEWYXAL-ZQNQSHIBSA-N 481.924 0.820 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1793872454 IVUFCZVJSLCNFS-YYIAUSFCSA-N 457.955 0.743 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)c(C)n1 1794353827 OSRNZWIJTGWOAH-RVQRMFQJSA-N 456.478 0.866 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc([N+](=O)[O-])c1)C2)c1cccc(B(O)O)c1 1795737637 FGOYKZYFHQKGMN-OPMZPASUSA-N 467.287 0.111 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)C2)c1cccc(B(O)O)c1 1795740986 VBHSSGKYHSXJDA-DVKRWUGUSA-N 477.370 0.234 50 20 JCGD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)n(-c2cccc(=O)n2C)n1 1796189327 YSKMLQXXNQOJNL-ACDBMABISA-N 489.341 0.125 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1C#N)C2 1796445508 CNELHKVCLCMWJM-ZMQIZJGTSA-N 478.509 0.661 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1C(=O)C=CC1=O)C2 1796890910 OTUPDEJRJOHXQI-BDHJUDLHSA-N 454.487 0.074 50 20 JCGD CN1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)CC1 1797237653 TUVCAPBDCZDOEL-IIZPIQPGSA-N 493.446 0.830 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccc2)[nH]n1 1798666652 JQYBQKYEXYRMQV-FAQVEIGNSA-N 454.531 0.653 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1799074975 QETMWEGJIOSZCT-XCCSTKFXSA-N 475.340 0.172 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(F)(C1)C3)C2)NC(=O)NCc1ccccc1 1799095421 UESHFVHRZSLKRS-HBYYELINSA-N 473.549 0.814 50 20 JCGD CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCOCCOCCOC 1800848473 FMWDMEQNIVRQKP-SFNKJDCFSA-N 450.960 0.290 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2 1800977701 CTPJOUGSGPVKJP-SSTJLMRISA-N 465.978 0.731 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cc(Cl)c1 1801757337 QQARDVJLEBRVMD-IVWMJMPLSA-N 461.881 0.995 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nc1 1803141157 LSLLSKAJYZLZTJ-JLSDUUJJSA-N 466.947 0.799 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1804375864 ABZDZJNFRRUQQT-YYAJDYIMSA-N 484.557 0.854 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365081 VONVNLKLSUQFNX-PUHATCMVSA-N 473.342 0.046 50 20 JCGD CN(C)c1ccncc1C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1 1807761725 RQWDRWGHLPBYHQ-UHFFFAOYSA-N 450.348 0.986 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1[nH]nc2ncccc12 1808107017 OJCHMYIJGGZZMO-DYESRHJHSA-N 470.298 0.666 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3c3cccnc3)c(C)n2n1 1813069725 BSOLORLIBPEVCT-WZONZLPQSA-N 493.572 0.829 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cn3c(nc2=O)SCC3)[nH]n1)[C@H](O)CCl 1814873790 ZSORCKRDGZHOCM-ZIAGYGMSSA-N 466.951 0.907 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347763 NWXVCTVNSXOUJL-LRDDRELGSA-N 453.333 0.815 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)n1cccc1C=O 1815382447 ZEPVDTVMCOYJOL-CZUORRHYSA-N 466.328 0.924 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3ccncc23)[nH]n1)c1cccc(B(O)O)c1 1817476324 QATVQUXZWFMCLI-SFHVURJKSA-N 459.275 0.752 50 20 JCGD Cc1cc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)nn1C 1819401783 SASMNCMEELSGBZ-SFHVURJKSA-N 465.518 0.999 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1819433192 SCONYORVONYOPO-DLBZAZTESA-N 480.522 0.270 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCCCC2=O)n[nH]1 1822302202 IVDNWFVXEUZQOF-QGZVFWFLSA-N 468.518 0.727 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1 1825994080 HKGLZLHWNCUPRG-MXWKQRLJSA-N 452.986 0.637 50 20 JCGD CC(=O)c1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n[nH]1 1827050800 ZDKXUDZUBXAZAX-NRFANRHFSA-N 452.320 0.839 50 20 JCGD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)N1CCN(C)CC1 1827052609 RLAZGMRHDKWOQD-CVDCTZTESA-N 470.423 0.236 50 20 JCGD C[C@@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1827401670 REVFTEAQXZECSZ-BXUZGUMPSA-N 466.340 0.829 50 20 JCGD CNc1nsnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1829748698 DEWLLQOALPEFIE-ZBEGNZNMSA-N 462.370 0.681 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1F 1830723876 SNBWYWOOFRZWEW-FKIZINRSSA-N 478.876 0.652 50 20 JCGD O=C(c1cccc(C(F)(F)F)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731393 LGBNIGUMGNAIEE-CXAGYDPISA-N 451.829 0.770 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1 1831280794 BIBMUVQEVZCQFN-PMACEKPBSA-N 462.377 0.177 50 20 JCGD O=C([C@@H]1COc2ccccc2O1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1832500220 RMFQHYRBIGCKMJ-BXWFABGCSA-N 473.295 0.973 50 20 JCGD O=C(COc1cccnc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833758861 BDTLGWCKZAVVRH-UHFFFAOYSA-N 466.347 0.026 50 20 JCGD O=C(/C=C/c1cccnc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833856219 AZXAIPBDWQAQJU-VOTSOKGWSA-N 462.359 0.660 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(F)(F)F)CCO2 1834115270 PNJVXJLRTIZXHO-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD Cc1cc(Br)cnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1834550569 KFPYZYQSOZVWQU-RDTXWAMCSA-N 476.755 0.822 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1scnc1C(F)(F)F)CCO2 1834574967 SURUSKOYZREWEU-SFHVURJKSA-N 493.508 0.605 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C(=O)c3ccccc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797900 JMJSYVJJYRJJLP-UHFFFAOYSA-N 463.343 0.435 50 20 JCGD CC(C)n1nccc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798347 KIAYXWGKHRERMF-UHFFFAOYSA-N 467.379 0.643 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n(C(F)F)n1 1834800930 BGMJTZJWHCKDRW-UHFFFAOYSA-N 489.332 0.765 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccnc3C(N)=O)CC2)CC1 1837250902 SWPJWMSQJAYPHF-UHFFFAOYSA-N 474.562 0.166 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1C 1837459367 DNKLXTQIXARKLE-XMMPIXPASA-N 467.526 0.686 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837637077 UVBUTDNYASBYGX-SQBHOSFOSA-N 484.347 0.692 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnn3)CCO2)C1 1837875280 XXSTVPDLMCUURL-JOCHJYFZSA-N 485.453 0.694 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc2NC1=O 1838585576 LQLSMQPDVIAEAM-PCMMCCAGSA-N 467.906 0.076 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(-c3cnccn3)c1)CCO2 1838593509 YURPCLGELCSVQN-RUZDIDTESA-N 496.568 0.587 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C3CC3)C2)C1)NC(=O)NCc1ccccc1 1839054680 IYFINFDELLBHGF-HSZRJFAPSA-N 459.547 0.199 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198272 BUVSPUSWHBOIOZ-DZGCQCFKSA-N 457.318 0.040 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1nc3ccc(F)cn3n1)CCO2 1839623859 FPWRVEIBRVWUEO-SFHVURJKSA-N 470.299 0.723 50 20 JCGD CC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839861009 ZPDNMOLVFHYHLF-RXVVDRJESA-N 482.375 0.585 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1 1840035544 VKVCROSZICLKEU-OGHNNQOOSA-N 451.314 0.788 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)C1 1840155072 PDFDJSVRQPRRQB-VBKZILBWSA-N 481.893 0.795 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185190 GWDBJAWYWBLEAL-QFIPXVFZSA-N 497.980 0.577 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015283 ANPMCYPNMIQLDA-GOSISDBHSA-N 455.320 0.100 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2nn(-c3ccccc3)c3c2COC3)C1 1843227540 NQVNBIHRSIBAQT-UHFFFAOYSA-N 472.310 0.713 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnc(O)nc2O)C1 1843352652 HZMPKLOVGJLQCR-UHFFFAOYSA-N 457.399 0.852 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1847014233 JUZKQNXUNXNISV-OAQYLSRUSA-N 467.306 0.070 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccc1 17171106 OKERJMKNASBWIV-MRXNPFEDSA-N 473.960 0.883 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=S)NCC2CCC2)c1 727865887 DQVYPGCFOLUWSE-UHFFFAOYSA-N 455.606 0.742 50 20 JCGD CC(=NNC(=O)[C@H](C)NS(C)(=O)=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1 728435796 ACNPKHKMUGBNME-XJKSGUPXSA-N 474.561 0.092 50 20 JCGD COC(=O)c1ccccc1-c1ccc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)o1 730569363 WTICOOWDKSDIHK-UHFFFAOYSA-N 457.468 0.768 50 20 JCGD NC(=O)COc1ccc(C=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 745984570 OZDKCUDAWHSBNF-UHFFFAOYSA-N 474.539 0.655 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1cccs1 751206075 BAAKVGPHYQODKG-GFCCVEGCSA-N 456.571 0.930 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1OC 781789784 UIHDISRYKCHQOR-UHFFFAOYSA-N 476.486 0.509 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc2c(c1)C(=O)N(C)C2=O 861632888 KDAQSCGRALGXNY-UHFFFAOYSA-N 465.513 0.137 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)N1CC[C@H](B(O)O)C1 864234064 OVVFRNGBQZGHKW-SMDDNHRTSA-N 465.200 0.924 50 20 JCGD O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)NC1CC1 895013261 ZTIRINURKLBKLC-UHFFFAOYSA-N 460.468 0.298 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C1(C#N)CCCC1)c(=O)n2Cc1ccccc1 914605179 ZOYWVDIBUJTRHY-UHFFFAOYSA-N 463.498 0.659 50 20 JCGD O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCN1CCN(c2ncccn2)CC1 916266755 DBMDHEISEBFDMT-UHFFFAOYSA-N 458.479 0.306 50 20 JCGD CN(C)Cc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 916568839 DTWSKFUMYFJBMN-UHFFFAOYSA-N 475.571 0.913 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)N[C@H]1CCS(=O)(=O)C1 919883075 AIVRVLMNUPCUPP-AWEZNQCLSA-N 478.980 0.258 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCN2C(=O)CN(C)C2=O)c1 921232421 DACUPQLOWAJICP-UHFFFAOYSA-N 453.521 0.152 50 20 JCGD O=C(COC(=O)Cn1cc(C(F)(F)F)ccc1=O)NNC(=O)[C@@H]1COc2ccccc2O1 1317690979 JBHLJNPIFMMODE-AWEZNQCLSA-N 455.345 0.398 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ccccn3n2)C1 1777815749 AYTGFXYHNZOYFP-OPAMFIHVSA-N 457.535 0.230 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc3cc(Cl)ccn13)CCO2 1779030058 GELPMTGENBQFDX-JOCHJYFZSA-N 483.916 0.744 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cccc1C=O 1779030756 HPLXPXBUJMAULD-OYHNWAKOSA-N 454.487 0.004 50 20 JCGD CCc1noc(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779775495 ZWIPFRQWBQPXJU-WZONZLPQSA-N 470.530 0.985 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nc1 1780962692 MCYOQBGGAAZIRE-XMMPIXPASA-N 467.331 0.371 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCN1C)CCO2)NC(=O)NCc1ccccc1 1780968969 LPKCZLDBSQXLIC-GBXCKJPGSA-N 472.590 0.257 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969359 YIGDTULZFPAUPT-FTCDTSOASA-N 486.573 0.202 50 20 JCGD COC(=O)[C@H]1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)C1 1782169686 RPKBRGHDTNVEAC-RAFPRUQASA-N 486.374 0.473 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)C2 1782208994 FWHKFOHCJNYJTG-HOOSLVGPSA-N 495.621 0.883 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1 1783882035 PISUNKUWABBOKY-YJYMSZOUSA-N 454.936 0.823 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CNC(=O)OC(C)(C)C)[C@H]2C1 1783989911 IRJBZNOECUPUEC-GVRJEKJASA-N 492.411 0.883 50 20 JCGD Cc1ccncc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785317031 OQJNATAMMKPLEU-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCCN(C)C(=O)OC(C)(C)C)C2)C1 1785588686 UUBNJTNLHPRADA-HSZRJFAPSA-N 483.610 0.836 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)C1 1787450192 WRBVJSKGICZZKF-MOMPZSSISA-N 463.934 0.872 50 20 JCGD COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)n1 1787509045 YFHGVLICDFWDJG-TVHLAIKQSA-N 468.514 0.818 50 20 JCGD Cc1c(F)ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1N 1788610789 UTNFKVJLQFSCQB-IXDGSTSKSA-N 470.505 0.622 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)[C@@H]1SC(=N)NC1=O 1788762528 DMFFTYHZJUSMBW-YGJAXBLXSA-N 456.641 0.620 50 20 JCGD CN1CCN(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)CC1 1789179285 UAEHPSJMCTZTNJ-UHFFFAOYSA-N 450.348 0.362 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1 1791063663 OXRXFDLLFAOLHP-QAETUUGQSA-N 465.385 0.819 50 20 JCGD COc1cc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c(F)c1 1791293797 JTSZRVOYDZKRPB-YEWWUXTCSA-N 468.501 0.940 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C 1793086418 ZZTWVPPACNQEFM-RBZJEDDUSA-N 492.411 0.883 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)n1 1796721019 SWPJWBBIOZUXRZ-NVVZYBJKSA-N 461.244 0.892 50 20 JCGD Cn1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1C(F)(F)F 1797075322 PDPAOIZCNWOFHV-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD COc1ccc([C@H]2C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797748584 KGAJULSBKRXSEY-VSJCFDMZSA-N 479.537 0.701 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3O1)C2 1797754481 YUMINLFUHIYJKX-VAKZPMALSA-N 465.510 0.282 50 20 JCGD CC(C)O[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1797861652 NMDAXYLVJMTIOW-KMQSCTNJSA-N 475.590 0.736 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1800299121 GKWZQGJQHVUCME-QSMSVPEVSA-N 484.366 0.902 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2 1800980486 BDAIHSQFMIZOLO-WUUQAYSMSA-N 475.970 0.202 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(S(C)(=O)=O)c(F)c1)C2 1800983365 ZYULCAXXUYAINJ-UMPJEAMMSA-N 462.927 0.686 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCN1C(=O)c3ccccc3C1=O)C2 1801010517 AFRPQSGYZGASCE-GPVSGQMNSA-N 499.568 0.025 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(N3CCOCC3)cn1)C2 1802332389 BNBNAWHNSSXHLT-BCDXTJNWSA-N 458.563 0.543 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363656 NHWPQJDQLTZEHN-QPPBQGQZSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CN2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365538 XMIDOEKLFMNYDQ-ZKMPZPQNSA-N 484.365 0.796 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]1c1cccnc1 1808668316 ODQXAKBXFGBLOD-RGCMKSIDSA-N 461.288 0.842 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC2(CCCN(C(=O)CC[C@H](N)C(N)=O)C2)CC1 1809818633 BECADHFCCSXOPJ-HOTGVXAUSA-N 488.029 0.943 50 20 JCGD CN1CCCn2nc(C(=O)NC[C@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)cc2C1 1812287669 JWKIPJUYTTZFOM-NTKDMRAZSA-N 496.616 0.806 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CSCC(=O)O)[C@@H]1c1cccnc1 1813072379 BMEIBOYSOAGTFP-FOIQADDNSA-N 451.549 0.278 50 20 JCGD O=C(/C=C/c1cnccn1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813483806 XANXVOVBDLOVRJ-NGVNFNDYSA-N 457.299 0.584 50 20 JCGD O=C(CN1CCCCC1=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361621 LPUXXJXPBVSFEM-OAHLLOKOSA-N 456.333 0.061 50 20 JCGD CCOc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nn1 1817472204 ASVATLFGNVFXBE-GOSISDBHSA-N 464.291 0.898 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCc3nc[nH]c3C1)CC2 1819801223 HAMXCEMNCOVDGW-NEPJUHHUSA-N 480.554 0.896 50 20 JCGD CCOC(=O)c1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)ccn1 1821583446 NXJKJFCWBIRFNU-MRXNPFEDSA-N 494.338 0.934 50 20 JCGD Cc1cc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)no1 1826638414 IBMOXFIVAMQYDH-NSHDSACASA-N 455.500 0.907 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3CS(C)(=O)=O)C2)C1 1830358574 PLAPPTMSHZXSLL-OAQYLSRUSA-N 488.006 0.961 50 20 JCGD Cc1ncc(Br)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726555 ZYJRZLOOUBJEBP-MAUKXSAKSA-N 476.755 0.822 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830735020 CBIGOXVHWYZLPK-OCHXJIAHSA-N 487.981 0.155 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832250956 BYKFHANHXWSOCI-YGRLFVJLSA-N 464.796 0.052 50 20 JCGD Cc1ccn(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)n1 1832549526 SZJQBXNBFDTAMV-JTSKRJEESA-N 499.996 0.780 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832872328 AQVGXQUUOZUMBA-MGPUTAFESA-N 485.379 0.622 50 20 JCGD Cc1cncc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1832958473 DGFHBFUBENVPEI-XMMPIXPASA-N 482.541 0.091 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833310249 FBEVMVHHZCXKSZ-DLBZAZTESA-N 477.002 0.043 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(C(F)(F)F)c1)CCO2 1833794932 ZFBDHZMVEJMCKI-NRFANRHFSA-N 493.247 0.164 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1833925262 DCNAGZBJHPEWPI-UHFFFAOYSA-N 487.605 0.598 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C)nc1)CCO2 1833992775 FDEYUHCKZMKBSP-OINMWHHXSA-N 468.514 0.594 50 20 JCGD Cc1nscc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797243 AIBRHUOYTNXIBS-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc2cn[nH]c2cn1 1835639917 OSGYIHGMAGZQRV-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H]3C[C@@]3(F)Cl)CC2)CC1 1835738165 KJAIGOLFBXSKNY-UTKZUKDTSA-N 466.945 0.795 50 20 JCGD O=C(CCCc1ccccc1F)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926525 QFGPAEKCOZJJEO-VWLOTQADSA-N 484.333 0.598 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1 1835930648 RUVJWOZAJDLTKN-RUZDIDTESA-N 475.310 0.298 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1 1835931309 MLTKDIDSRNIJJR-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD COc1cc(Cl)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835933841 HIMRCPWUEJBCLK-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837949749 YRDHSWOXUDIRDY-DIFFPNOSSA-N 457.281 0.028 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)cc(Cl)n1)CCO2 1838240173 PXFVLCUHXPFBKL-OAQYLSRUSA-N 494.140 0.452 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C)c1 1839023952 NHOGTNPAWKTUSR-XMMPIXPASA-N 468.315 0.067 50 20 JCGD Cc1cc(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839285242 WZJLQPCPOIZNOU-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cc2s1 1839524213 BEGYNJMUOPTILJ-HSZRJFAPSA-N 498.565 0.920 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839693614 PZAAAUWKPMPHFL-PXNSSMCTSA-N 485.354 0.530 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)N3CCN(C)CC3)C2)C1 1839966179 WUPSKJUDUNBJPW-HLIPFELVSA-N 475.428 0.252 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1840034015 YBVYYUPJSADWMX-ACJLOTCBSA-N 455.309 0.260 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCOC1)CCO2 1840874442 IOOBJVZQAGCHRM-HRJSYZDASA-N 461.519 0.003 50 20 JCGD CC(C)(CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)NC(=O)OC(C)(C)C 1841371250 GILDVNGZJDDSIN-UHFFFAOYSA-N 459.352 0.877 50 20 JCGD COc1ccc(Cn2cc(CC(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)cn2)cc1 1843010733 WXQCDZFHZBRPAH-UHFFFAOYSA-N 488.353 0.680 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012347 FTAIWJKFOGMRCJ-KRWDZBQOSA-N 471.319 0.110 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nc3ccccc3n(C)c2=O)C1 1843743509 JGCGAFJGKPFEOK-JFLMPSFJSA-N 475.509 0.885 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)COc1cccc(C)c1)c(=O)n2Cc1ccccc1 16005431 CIAHOAXPGFGDBC-UHFFFAOYSA-N 490.520 0.963 50 20 JCGD O=C(NNC(=O)c1ccc(=O)[nH]c1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 21971312 OUSRWHZOXLOULD-UHFFFAOYSA-N 495.561 0.956 50 20 JCGD O=C(CSC[C@@H]1CCCCO1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 727293264 JNZQTAVENSIAOI-INIZCTEOSA-N 457.574 0.771 50 20 JCGD O=C(NNC(=O)N1CCN(CC(=O)N2CCCc3ccccc32)CC1)c1ccc(-n2cnnn2)cc1 731358498 XWJKBWCSVULSJH-UHFFFAOYSA-N 489.540 0.614 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(-n2cnnn2)cc1)c1cccc(S(=O)(=O)N2CCCC2)c1 747409618 HRZOFUMUFDMWSJ-UHFFFAOYSA-N 477.528 0.070 50 20 JCGD CCS(=O)(=O)N1CCC(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1 747450895 WXQFFNGEPZAXPK-UHFFFAOYSA-N 451.593 0.408 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNC(=O)c1ccc2c(c1)OCO2 913391850 ISZRYRKCHHDBTP-UHFFFAOYSA-N 453.499 0.505 50 20 JCGD NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=O)c1ccc(F)cc1Br 918641581 HOAFJIMOEAHJNG-UHFFFAOYSA-N 487.263 0.605 50 20 JCGD O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1C1CC1)NNC(=O)c1nn(-c2ccccc2)cc1O 920274940 JUQGBCMYSCCDLF-NRFANRHFSA-N 474.477 0.815 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncnn1C)C2 1778091404 OXMMEJIWXKLBCY-PMPSQQHASA-N 456.507 0.077 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnnn1C)C2 1778091487 HKUAPODRPMYJRN-ZNUZEINGSA-N 456.507 0.077 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1779072828 MVLLTWADRYTYGR-QGTPRVQTSA-N 453.319 0.547 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371288 LYJZFGNAAUPKFZ-UZUQRXQVSA-N 475.546 0.544 50 20 JCGD Cc1c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)cn2[nH]cnc(=O)c12 1780018281 LSHFTALSBVUWJF-BXTJHSDWSA-N 451.911 0.058 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3n(n1)CCC3)CCO2)NC(=O)NCc1ccccc1 1780967905 CGUWOBJRMPRITJ-VWLOTQADSA-N 495.584 0.619 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1onc2ccccc12 1781304765 PUOIJYYTVQVBCA-HYBUGGRVSA-N 463.299 0.949 50 20 JCGD CC[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)NC(=O)OC(C)(C)C 1781357876 PCFYDYNBRSVXIY-CYFREDJKSA-N 489.378 0.503 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782572356 NZJKWEUFLUGHDU-LZBHBKQYSA-N 482.541 0.675 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1783185728 FLGGNFRLEWYFRM-DNVFCKCGSA-N 474.562 0.117 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1783257853 YMEKWWOICDXPKH-QCIUDXLNSA-N 493.369 0.312 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)c3ccc[nH]3)[C@H]2C1 1785249970 VAXHBDJSIHCOMR-HOSILWTGSA-N 455.353 0.898 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4c(O)nnc34)[C@H]2C1 1787386416 BQSHOJSOLCUQMG-RAKJEAAFSA-N 494.512 0.162 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4CN3)C[C@@H]21 1787509170 XIZFXTMSGYKPQS-QASITTDWSA-N 492.580 0.815 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc2c1OCCO2 1787940524 CDFJGDTZCBQKCS-LRQRDZAKSA-N 466.299 0.045 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)c3cnccn3)[C@H]2C1 1788701420 QJPMJIBSWKUORS-FDPKGLCPSA-N 451.955 0.982 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-n4ccnc4)ccn3)[C@H]2C1 1789376503 XYOUUYKZWBRADF-QRFRQXIXSA-N 469.546 0.234 50 20 JCGD Cc1cn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)c(=O)nc1O 1789872176 BDIMQEBFSHVKLV-WFTHSTBKSA-N 461.346 0.473 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21)n1ccnn1 1790642423 JXQDLGRFUKFRKD-VMXMFDLUSA-N 498.588 0.165 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)ccc1F 1791944129 JLPUSBYGASADEA-VHFSOBRXSA-N 471.489 0.740 50 20 JCGD COc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc(OC)c1OC 1792974798 CJRYCBREPVDVPQ-NXEZDXNNSA-N 456.923 0.444 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1793040941 DVJREONVAKVSMK-NNXHMXCWSA-N 471.982 0.965 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)c1ccccc1 1795379784 ORYYVJSXHPYLPV-UKBRNAERSA-N 453.499 0.444 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncsc1Br)C2)c1cccc(B(O)O)c1 1795739041 RWRUXTMQEDCRBF-DABQJJPHSA-N 480.149 0.102 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(F)cc(F)cc3[nH]1)C2)c1cccc(B(O)O)c1 1795739231 UWQQODZPCFPUAG-GFENJXEQSA-N 469.253 0.643 50 20 JCGD Nc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)sc2nccnc12 1796187027 HOCGMBDMSRPYDB-QDMKHBRRSA-N 451.317 0.519 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@@H]1C[C@@]12C(=O)Nc1ccccc12 1796192270 UYDTUFAHCMDUFN-UFZBXBPUSA-N 459.311 0.528 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCNC(=O)OC(C)(C)C 1799350494 UFSAFFBAFDMHMG-IBEHDNSVSA-N 492.411 0.883 50 20 JCGD CC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)c1ccc(F)cc1 1799817007 XXEFXABSZPQFOR-LRSLUSHPSA-N 467.306 0.635 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C)CN(C(=O)OC(C)(C)C)C1)C2 1801011590 PWPTXLBECAUEFN-HGKCTWBKSA-N 481.594 0.206 50 20 JCGD O=C(CN1C(=O)CNC1=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1804090482 HUACPYAHZFMGTC-CXAGYDPISA-N 452.309 0.424 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1804183425 NTHXSZBTNCSTNJ-HACGYAERSA-N 466.336 0.670 50 20 JCGD CN(C)c1ncc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1 1805344049 QCIJKXNQTSQHFC-YLJYHZDGSA-N 463.303 0.449 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361698 CVPMEHOBQHMOAG-APWZRJJASA-N 460.137 0.866 50 20 JCGD CCn1nc(C)cc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807984970 XXBNDYHGQTXCBS-KNQAVFIVSA-N 461.331 0.920 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1nc[nH]c1[N+](=O)[O-] 1808368119 NEWWXBVXFJKCFJ-QAPCUYQASA-N 464.247 0.026 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CNCP(=O)(O)O)C2)CC1 1809657500 WVXXANZPDPZJLH-ZDUSSCGKSA-N 454.302 0.973 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1 1809912366 YOKWLHADXKYHSA-VGSWGCGISA-N 464.530 0.817 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C(=O)Nc2cccnc2)[C@H]1c1cccnc1 1810302859 NVBLCLFHCCTCGJ-JXFKEZNVSA-N 488.508 0.433 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1813028786 WEGJXSUXCYVKFJ-AOIWGVFYSA-N 472.995 0.072 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344228 OWVVEBTYAWMHKH-DOMZBBRYSA-N 466.332 0.339 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(=O)oc2)n[nH]1 1816644168 JIXGQHRCUFBCNP-INIZCTEOSA-N 451.443 0.981 50 20 JCGD C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816674182 NSCPWOJUIRNTHO-GYKQLYQFSA-N 471.330 0.731 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)[nH]n1 1818111349 FMHJPGNAYRJEJZ-FCUAXUHVSA-N 483.489 0.088 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1)c1cccc(B(O)O)c1 1819024314 ZZHRFHKSRABSQQ-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052130 PNPAMMDMDJJSLX-LAUBAEHRSA-N 457.380 0.905 50 20 JCGD O=C1CC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](O)CCl)CCN3C(=O)OCc3ccccc3)C2)N1 1828551155 KTYOUPFWWLVHTB-YZZKKUAISA-N 492.960 0.317 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CNC(N)=O)C2)C1 1829340839 QAJRCKBYZQNVIC-HTAPYJJXSA-N 495.964 0.361 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1830574653 KGDYJIQJPXVCRJ-KKSFZXQISA-N 489.642 0.180 50 20 JCGD O=C(CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)Nc1ccccc1 1830668269 SHLQGQGATUVFGX-GCJKJVERSA-N 467.950 0.852 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnoc3)C2)C1 1832549580 UZYSWWKAOWSJEN-YWZLYKJASA-N 472.926 0.877 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1 1833398513 GIMWRFXDEVSRND-SFHVURJKSA-N 490.376 0.340 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4cccnc4n3)CC2)CC1)c1ccc(B(O)O)cc1 1834798657 VSAVIGGGPMPADS-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cn4c(F)cccc4n3)CC2)CC1)c1ccc(B(O)O)cc1 1834799074 NHQHFNBNOXKUHS-UHFFFAOYSA-N 493.348 0.652 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3(C(F)(F)F)CC3)CC2)CC1)c1cccc(B(O)O)c1 1834800024 NCIDGZJMQWOVLO-UHFFFAOYSA-N 467.297 0.894 50 20 JCGD Cc1nn2cc(CC(=O)N3CCOC[C@]4(CN(C(=O)CCBr)CCO4)C3)nc2s1 1834819800 WWRTZWZPFATTJX-SFHVURJKSA-N 486.392 0.883 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CC3)C2)C1 1835926232 ISQPFKDPCKTKGS-XMMPIXPASA-N 464.327 0.168 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc43)C2)C1 1835939575 BBKWSEVGTWPZMC-DHLKQENFSA-N 464.327 0.166 50 20 JCGD C[C@@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)Oc1ccccc1 1837459398 FDIPEGQTHHFKOJ-BVZFJXPGSA-N 497.552 0.613 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837849832 RQNBTEJGNDPJNF-MGPUTAFESA-N 460.579 0.671 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc(F)nc3)CC2)CC1 1837919254 UXTCSZMZTLIGGP-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1 1838012135 KHQPPYGCUFRRDE-KKSFZXQISA-N 463.922 0.796 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCN(C(C)=O)CC3)CC2)CC1 1838300987 KQBYEZBCHKQRHX-FQEVSTJZSA-N 473.014 0.403 50 20 JCGD COc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838876246 MLGXFKWOZHQTAI-HSZRJFAPSA-N 469.498 0.078 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(O)cc1)CCO2 1838969814 FCUPKNUMZVENGW-AJPHYDNBSA-N 469.498 0.596 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)CCO2 1839109779 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CC(=O)N1CCN(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)Br)C3)CC1 1778910606 PRABLLNRAPIXAD-WRWLIDTKSA-N 473.412 0.448 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3c1OCCC3)C2 1779374607 RXXQCWBWNJIWCW-WZONZLPQSA-N 483.529 0.105 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1 1779597486 MZGXRFVKERSIHK-RUZDIDTESA-N 489.536 0.687 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCNC(=O)C1)CCO2 1780098068 AUXHFMDEVQVEDN-IVZQSRNASA-N 474.470 0.490 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1780098756 UZWGCONWWXFVFS-FQEVSTJZSA-N 490.498 0.874 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1780950539 XFVGHMXJTLBXCO-JEWPKMHUSA-N 478.513 0.236 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)Cc2ccccc2)C1 1781896171 NBWGYQXQZXBVDU-YOSAUDMPSA-N 460.575 0.477 50 20 JCGD 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COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CNC(=N)N)CCN2C(=O)OCc2ccccc2)C1 1828974952 QXKXYBXBIVWUAC-JTSKRJEESA-N 494.980 0.175 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1830535662 RVMSBOHJXMUDKW-DJJJIMSYSA-N 469.336 0.282 50 20 JCGD COc1ccc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)[nH]c2c1 1830727787 FGZSBKIRWJDNTH-NQIIRXRSSA-N 451.907 0.846 50 20 JCGD O=C(c1csc(C(F)(F)F)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731544 LGBHWXIGLIBHNJ-IAQYHMDHSA-N 457.858 0.832 50 20 JCGD CN(C)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549206 HFUBVVYNVSKNMW-HRAATJIYSA-N 477.002 0.527 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833312486 WBBVQYYDPLQFFJ-HNAYVOBHSA-N 465.982 0.371 50 20 JCGD CN1CCCC[C@H]1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833321651 PXKWZEHCUYYFJM-NRFANRHFSA-N 471.606 0.355 50 20 JCGD Cc1noc(C)c1CC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833728312 KBYKZFDIGUUXKG-UHFFFAOYSA-N 468.363 0.399 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnn3)CC2)CC1 1834896139 KPZAGVRRLOYGCM-SFHVURJKSA-N 498.028 0.982 50 20 JCGD O=C1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)N1 1835312374 VIEUPAHTPYINOU-SVMVAKDDSA-N 494.386 0.728 50 20 JCGD CSc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1O 1835938380 TZZLROZRYQDCBG-QHCPKHFHSA-N 486.355 0.178 50 20 JCGD C[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)Oc1ccccc1 1835939857 LGOZLAGOWIICBV-CLOONOSVSA-N 482.342 0.294 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc(Cl)ncn1 1836026622 YLRXNMLBRZBJPU-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD Cc1nnc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)s1 1836075008 GWUDTECJMHZFFT-SJCJKPOMSA-N 461.382 0.876 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1 1836399645 HTRWCUANWOQUFK-HNAYVOBHSA-N 467.394 0.859 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1 1837531494 NTFOIWSJPZCZEK-NTUGGBQKSA-N 457.600 0.823 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)C#CC(=O)O)CCO2)C1 1840044599 NLLMVKSJIFCKFG-NAVGAYGYSA-N 459.405 0.416 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)CC1 1840156355 NFHWSQHCLWCGSQ-LAUBAEHRSA-N 475.970 0.565 50 20 JCGD CCCC(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1842657318 WWCSGBXDVHGKNI-IBGZPJMESA-N 473.379 0.806 50 20 JCGD COc1cc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)nn1-c1ccccc1F 1843185399 UZRGSBPMPYWYFD-UHFFFAOYSA-N 478.289 0.831 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)cc1 10931792 SGJHUPZSSKTCMZ-UHFFFAOYSA-N 479.486 0.773 50 20 JCGD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)C1 725871648 JXIFIAPMHIGPGM-HOTGVXAUSA-N 464.592 0.341 50 20 JCGD CCn1cc(NC(=S)NNC(=O)Cn2c(=O)c3c(ncn3CC)n(Cc3ccccc3)c2=O)cn1 726122226 QGVFHYBMQILVDB-UHFFFAOYSA-N 495.569 0.662 50 20 JCGD O=C(NCCCN1CCCS1(=O)=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 726276927 RCMQQYWDNVKEOQ-UHFFFAOYSA-N 498.569 0.758 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCNC(=O)c1n[nH]c2ccccc12 726883712 FFDAZRXVOPFXLC-UHFFFAOYSA-N 457.516 0.746 50 20 JCGD O=C(COC(=O)CCn1c(=O)nc(O)c2ccccc21)NNC(=O)[C@H]1COc2ccccc2O1 728320232 FZNZXXNLOYDDKE-QGZVFWFLSA-N 468.422 0.023 50 20 JCGD CCCCn1c(N)c(N(CC(C)C)C(=O)CCC(=O)NNC(=O)N2CCOCC2)c(O)nc1=O 745991639 APFSSPVGLHZTND-UHFFFAOYSA-N 481.554 0.173 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1 751207218 SRLNMSRQYVBYGY-GXDHUFHOSA-N 460.512 0.870 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1ccc(-n2cnnn2)cc1 807135252 IQZYHKYXDNAGNQ-UHFFFAOYSA-N 474.478 0.162 50 20 JCGD COc1ccc(NS(=O)(=O)c2ccc(O)c(C(=O)NNC(=O)C(=O)NC(C)C)c2)cc1 822054511 YGCPQMMYLUIFBW-UHFFFAOYSA-N 450.473 0.487 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccc(CN2C(=O)CNC2=O)c1 825117082 CCWOTPXTNTYVPS-UHFFFAOYSA-N 464.526 0.712 50 20 JCGD COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 913573009 FZPYEOQWXVMREM-GFCCVEGCSA-N 459.484 0.070 50 20 JCGD O=C(NC[C@@]1(N2CCOCC2)CCSC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 916637226 VMWBWNYOSPYESH-NRFANRHFSA-N 497.643 0.623 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(C(=O)C(=O)NC2CC2)CC1 918777494 MJCZOPWEFKHOHL-LBPRGKRZSA-N 482.335 0.380 50 20 JCGD COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919883884 DUCSSZIZMQVUSA-TZMCWYRMSA-N 458.562 0.064 50 20 JCGD CSCC[C@@H](NC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(=O)NNC(=O)NC1CC1 920766456 UZIQSKBYCZUDHQ-QGZVFWFLSA-N 499.615 0.052 50 20 JCGD O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccccc1Cl 1317882320 UBSYMTTUBWCCLN-UHFFFAOYSA-N 466.951 0.831 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1778069868 JCXGASXTASPCEV-YBOAYWMSSA-N 472.376 0.451 50 20 JCGD COc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)cn1 1778091106 FXBUEVAFHGTSQN-XROPCUMXSA-N 483.529 0.747 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCN2CCOC2=O)C1 1778778989 DXXQYQFKGUONSF-QZICUBQQSA-N 488.545 0.477 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1778999309 DNBGDZWYARMVBD-QHCPKHFHSA-N 456.424 0.861 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1 1779034052 KNAVKSAACVQVDH-QHCPKHFHSA-N 453.499 0.467 50 20 JCGD CNC(=S)NCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779034768 HCWXFHYVWLGGNV-XOBRGWDASA-N 492.042 0.432 50 20 JCGD CN(C)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371267 YVBCGRPXFOJVLQ-HYBUGGRVSA-N 481.557 0.587 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)C1(O)CCC1 1779371497 AERDZROYEAMNBX-QXATTWAWSA-N 459.547 0.364 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)no1 1779376063 VNYFLQWQZKJHPB-XMSQKQJNSA-N 456.503 0.352 50 20 JCGD COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc(Cl)n1 1779882639 CPUUVGNSDNCJBR-WZONZLPQSA-N 487.749 0.865 50 20 JCGD O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1780005229 MOTYQWDRNOSTQY-SANMLTNESA-N 487.321 0.081 50 20 JCGD Cn1c(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc2c[nH]c3nccc-3c21 1780036723 DTJKAXDXDREQBG-VWLOTQADSA-N 487.325 0.443 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ncn(C)n3)CCO2)C1 1780095085 FQAUAQGJXWARQF-FQEVSTJZSA-N 458.431 0.406 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1780918390 LNTASUVKTDWAAF-LAUBAEHRSA-N 450.923 0.952 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1[N+](=O)[O-] 1781307278 VDWOEXUZZXSFTG-JOCHJYFZSA-N 461.519 0.649 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2nn[nH]c2c1 1781441360 APAPKEWDNFXGEK-NFBKMPQASA-N 463.303 0.079 50 20 JCGD COc1cc(F)c(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(F)c1 1781706193 HGBBPWGOYVKHSR-QFIPXVFZSA-N 460.242 0.411 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2n1 1782574979 RGYBLXCAMJGUET-DEOSSOPVSA-N 462.315 0.388 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1 1783419584 RAMQWXNKIRZSHE-XMMPIXPASA-N 465.510 0.306 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(Br)c(O)c1)CCO2 1783934389 FRPJEKHALSIUPM-HXUWFJFHSA-N 483.363 0.971 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1cc(Br)ccc1O)CCO2 1783935211 RDLGYADPMIAFRM-OAQYLSRUSA-N 497.390 0.900 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cn1 1783946222 YSUXAXQJZKHONZ-KRWDZBQOSA-N 450.344 0.873 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc(Cl)ccc3F)[C@H]2C1 1785477093 PJOSUKBJUPWAGT-YDHLFZDLSA-N 455.918 0.840 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)nc1 1785750538 SPCIAGBAXKXSSA-DCPHZVHLSA-N 467.530 0.053 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnc(-c4ccccc4)o3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979790 RAWISVCPDYQOFM-IHPCNDPISA-N 476.298 0.324 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1N(C)C 1786981644 BQSYWIILOIUGMX-LEDOBFOHSA-N 481.358 0.348 50 20 JCGD COc1ccccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786985224 SXCRKBZRPVSZDH-VCOUNFBDSA-N 452.316 0.211 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3cc4n(n3)CCNC4=O)CCC2)cc1)c1ccc(B(O)O)cc1 1788140764 TZZWXMRDCIJWEG-UHFFFAOYSA-N 473.298 0.368 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788548779 FXUOUIXVZANCAJ-USKVXJDGSA-N 479.342 0.223 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4O3)C[C@@H]21 1788611339 VLNZHSHQPAGTNW-MEGFKASBSA-N 465.510 0.282 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)N1CSCSC1 1788685558 JNCYIJUFUCZNNW-QAETUUGQSA-N 473.665 0.382 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789683620 AJZXDLIBNCRRTM-IHPCNDPISA-N 488.390 0.718 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C[C@@H]21 1791061101 RJBVYELXIRUTGY-MJDBTJCESA-N 464.357 0.593 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1793087794 OGZOLDUTFLYDRJ-XVIXHAIJSA-N 482.347 0.542 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(O)C(F)(F)F 1793688537 NJEQIINHZHQTHO-WHPCJCSSSA-N 459.425 0.023 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(=O)n1C 1794587321 QWDGDOMWDMRLCL-USGNIVHTSA-N 484.465 0.736 50 20 JCGD O=C1CN(c2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)n2)CCCN1 1795112421 GWQWCBZETUPUIF-YVWYUNDQSA-N 494.390 0.396 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNc1ccc(F)cc1 1795542776 QXJWBUPSVRSNLU-VTEUUUEMSA-N 456.478 0.140 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc(C(F)(F)F)c1 1795735804 FFBXBOVXFAFQNW-CWPLJXCYSA-N 492.259 0.911 50 20 JCGD Cc1ccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)c2c1 1797750986 ZOFPASUIGLZESF-YVWYUNDQSA-N 463.498 0.158 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1 1797956381 STMVNNBZCUAHCD-KMOPNRPKSA-N 485.654 0.655 50 20 JCGD Cc1nccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798279524 RYTJWSOGFKGWNS-HATOLVCRSA-N 481.557 0.334 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799346193 ILBJENYGFYRVMO-JLZCTACVSA-N 494.358 0.637 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799349379 UGJIKOOCQCYYGN-AYRXBEOTSA-N 482.347 0.808 50 20 JCGD COc1cccc2[nH]cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)c12 1800003274 UJARKWBRCSOTNQ-GFENJXEQSA-N 478.509 0.692 50 20 JCGD CN(C)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Cl)cc1 1800305862 ZQQJXXIDQHZDMU-UDKICSLYSA-N 485.777 0.526 50 20 JCGD O=C1C[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)Cc2ccccc2)CN1 1800437266 TZYNGIWQWMAXOP-LVEJAMMSSA-N 464.360 0.718 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)n1)C2 1800757289 KKPRHBGRBVJYAC-ZXFNITATSA-N 467.364 0.905 50 20 JCGD COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c([N+](=O)[O-])c1 1800791319 GSUPQWRFQJKLRN-BCDXTJNWSA-N 481.270 0.627 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]cnc1-c1cccnc1)C2 1801011874 NYTNYSMXBOZSDZ-HGKCTWBKSA-N 455.519 0.048 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cn2cccc([N+](=O)[O-])c2=O)[C@@H]1c1cccnc1)[C@H](O)CCl 1803148558 TUGBWFKJJYISBY-YXJHDRRASA-N 463.878 0.457 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(C)(C)NCCC#N)[C@@H]1c1cccnc1 1807151620 WGGBCQQJAVXPQR-NQIIRXRSSA-N 457.579 0.742 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1C 1807360458 KOYNXEAWCBRHJQ-UWJYYQICSA-N 463.303 0.137 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1(O)CCC1 1807365321 NGASYEFGNLCUQV-LKUPVBHCSA-N 451.332 0.632 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)N1C[C@@H]2C[C@H]2C1 1807374797 JJYCKSJZEANBAU-GGKYTPRKSA-N 462.359 0.421 50 20 JCGD COCc1oncc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807377111 XZRPPMYJRMWZRF-DYESRHJHSA-N 464.287 0.529 50 20 JCGD CN1CCC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)C1 1807552009 QUFIMHJPGOPLME-LVCYWYKZSA-N 465.558 0.742 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnn3cccnc23)[C@H]1c1cccnc1 1809745520 SFRAQVQEMDDEFZ-LAUBAEHRSA-N 464.530 0.817 50 20 JCGD Cn1c(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cccc1=O 1810297255 BISKQHHJQLXVCP-HRAATJIYSA-N 475.509 0.412 50 20 JCGD CCOc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1 1811621517 SDTXZAMMQOSQDZ-GCJKJVERSA-N 475.314 0.584 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccc(-n2cncn2)c1 1811824692 VJXKMHWOCHRJLL-URXFXBBRSA-N 496.336 0.976 50 20 JCGD CC(=O)N[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(C)(C)C 1815057174 HSXPKLIJEVLDOE-QUCCMNQESA-N 469.351 0.946 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1cc(=O)n2[nH]cnc2n1 1815330408 OGTYVMGWJKRGCM-KGFZYKRKSA-N 470.284 0.790 50 20 JCGD O=C1Cc2cccc(C(=O)N[C@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)c2N1 1815348376 LTRZZMFFYATEKX-HNNXBMFYSA-N 476.323 0.857 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)N(C)C)CC2 1817276490 UCGSVXJGUBUQPJ-BUGPSZFBSA-N 474.547 0.460 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2 1817277592 YUOZBOJCTLOXQK-BUGPSZFBSA-N 499.513 0.994 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3c2OCCC3)[nH]n1)c1cccc(B(O)O)c1 1817476900 GPLXDEHGXGGQIL-SFHVURJKSA-N 464.291 0.688 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cnn4ccncc34)sc2C1)c1cccc(B(O)O)c1 1818501816 ANPMYQBZFFLGKO-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)[C@@H]1SC(=N)NC1=O 1819403079 UNZLDZBHPMUKAQ-FSBGKCOPSA-N 499.557 0.517 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403799 GFMLQNRJPSYHGL-XLNAKTSKSA-N 454.491 0.754 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)c1ccco1)CC2 1819790113 FLNOJEMLCGFIBO-QFYYESIMSA-N 456.484 0.694 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cccc([N+](=O)[O-])c2=O)n[nH]1 1821739072 XFFOHDHNXBUNQH-OAHLLOKOSA-N 488.505 0.545 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923298 BSPYYDJVANCQRW-DNVCBOLYSA-N 494.618 0.246 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829074158 YWUCDNOYVFGVDC-LAUBAEHRSA-N 457.380 0.905 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)ccn3C)C2)C1 1830543121 KFOQQMBKYFDPDT-KUHUBIRLSA-N 456.337 0.486 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1830734983 BQFCVVIDLLNEDW-FVMIAERFSA-N 480.871 0.199 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CS(=O)(=O)CC)CCO2)C1 1831341107 HRWHKJHGPQGADA-BBRMVZONSA-N 455.371 0.051 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)CC1 1831897340 GAYPOFNIYAZNQY-KRWDZBQOSA-N 469.269 0.278 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)s1 1832884460 KRQMJJJLUDUHPS-HSZRJFAPSA-N 472.372 0.439 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccnc1S 1833080025 UVMXDQSNNJIQAW-UHFFFAOYSA-N 468.388 0.549 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833313834 VEFHWVNIKJALSY-OXJNMPFZSA-N 464.994 0.976 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCNC(=O)c3ccc[nH]3)CC2)CC1 1833800165 JJVWLHOIHZCYEB-GOSISDBHSA-N 467.998 0.960 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(=O)n3C)CCO2)C1 1833876328 OBPVLPRFNHMBER-KUHUBIRLSA-N 456.337 0.629 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c4nccc-4c3)CC2)CC1)c1cccc(B(O)O)c1 1834800177 WROFUIICPRIIIG-UHFFFAOYSA-N 475.358 0.693 50 20 JCGD Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)sc1C 1834800937 BLGQTYFLXWJIQR-UHFFFAOYSA-N 470.404 0.939 50 20 JCGD CCn1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1C 1834801137 NGVCMYNZMJWZNM-UHFFFAOYSA-N 467.379 0.390 50 20 JCGD C[C@@H]1CCc2c(C(=O)NC3CCN(C4CCN(C(=O)c5cnccc5C(=O)NN)CC4)CC3)n[nH]c21 1835360546 NRBZINLPXJLUAH-OAHLLOKOSA-N 494.600 0.957 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cn4ncccc4n3)CC2)CC1 1835394317 HKWHUCMXNSFKJH-UHFFFAOYSA-N 470.578 0.288 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cc2n(n1)CCCNC2=O 1835515677 MVDWEKKJJGBQTN-QGZVFWFLSA-N 454.934 0.736 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n[nH]1 1835738038 RAIVSIAMXWOCFA-UHFFFAOYSA-N 454.535 0.216 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ccc(F)c1F 1835941967 VEXPYWMLOIRSOX-HSZRJFAPSA-N 474.269 0.337 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836717147 KFTDSHNQPDFHRN-QZTJIDSGSA-N 462.927 0.080 50 20 JCGD O=C(c1cccn2c(O)nnc12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836718494 YZIQGULQLZHQCZ-INIZCTEOSA-N 451.911 0.647 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3C(=O)C=CC3=O)CC2)CC1 1836996138 RMFMPMOJKLUZMW-KRWDZBQOSA-N 455.939 0.554 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)C1=O 1837140185 SKAZACBXOLPUDQ-LJQANCHMSA-N 456.282 0.695 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837711862 ULQAQUUHODBMHT-KKSFZXQISA-N 489.642 0.180 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)[C@H]1SC(=N)NC1=O 1839152293 VDSKSDZVBCMFCU-CMKMFDCUSA-N 481.402 0.482 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)no1 1839201275 TWFBRWKFHCKFGW-NVXWUHKLSA-N 477.287 0.459 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1839642487 QYHTWQCDSHEUID-HJPURHCSSA-N 492.529 0.930 50 20 JCGD CCCCC[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839903991 OTSCRMRGBCOBIJ-HXOBKFHXSA-N 461.563 0.972 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1 1839965211 QQLVYGQKAPNDMK-IIBYNOLFSA-N 499.406 0.917 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839988491 SWQVMDDAAZRNKP-CXAGYDPISA-N 468.320 0.658 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1 1840030716 UQOLLGKBHNEDTN-LIRRHRJNSA-N 466.336 0.671 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCc4sccc4C3)C2)C1 1840151326 YNMGGTSCVFDEKG-UWJYYQICSA-N 472.007 0.816 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(Cl)c(F)c3)C2)C1 1840182367 AVUTXMXAXBHMEX-JOCHJYFZSA-N 484.956 0.851 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)NC(=O)c1ccccc1)CCO2 1840902741 ICDZLDITYBTZIX-TVTNDZMWSA-N 467.950 0.515 50 20 JCGD COc1nccnc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1842219926 JWZLBVCCIXYHJT-UHFFFAOYSA-N 467.530 0.648 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)COC(=O)C(F)(F)F)C2)NC(=O)NCc1ccccc1 1845039035 WEEBMSGVDAHZPC-UHFFFAOYSA-N 485.463 0.642 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCc1cnccn1)C2)NC(=O)NCc1ccccc1 1845039464 RDOGTHBILHMXEK-UHFFFAOYSA-N 465.558 0.959 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1847014232 JUZKQNXUNXNISV-NRFANRHFSA-N 467.306 0.070 50 20 JCGD O=C(COC(=O)CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1cccs1 10762049 YJNVXRNELOSKRS-UHFFFAOYSA-N 454.482 0.688 50 20 JCGD CCn1nc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(OC)cc2)c2ccccc2c1=O 17190989 UZULYFFJQKNLEL-ZDUSSCGKSA-N 473.511 0.553 50 20 JCGD COC(=O)c1cccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 24258395 DHAOAJJCYMKHRQ-UHFFFAOYSA-N 455.514 0.412 50 20 JCGD Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 28617291 ZGMUITDOXFZDKR-UHFFFAOYSA-N 491.551 0.226 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)c2ccccc2c1=O 726277956 SNZQJQXNOSNYLN-QGZVFWFLSA-N 457.535 0.303 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)c3cnccn3)cc2)C1 728261114 XRVANIYTGFQFJJ-OKILXGFUSA-N 453.546 0.767 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1sccc1S(=O)(=O)N1CCOCC1 728847427 DYWHEBCPOFEITB-UHFFFAOYSA-N 480.572 0.237 50 20 JCGD COc1cc(Cl)ccc1C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1 789911079 FRXIMSNUBCVVCQ-UHFFFAOYSA-N 468.919 0.907 50 20 JCGD CCC(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 917393769 VZHXMGWLDYPGIH-INIZCTEOSA-N 456.590 0.880 50 20 JCGD O=C(NNC(=O)C1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1)NC1CC1 920822871 CJDQZRGJPHCIJG-UHFFFAOYSA-N 496.546 0.325 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1779028338 JJNFJJTWWFLAQO-QFIPXVFZSA-N 455.519 0.394 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C2\C(=O)Nc3ccccc32)C1 1779285530 QGGNGNDFJAFFFS-GGHGQZRTSA-N 483.569 0.909 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1779317021 YQYLWXDGQRGWAL-GCJKJVERSA-N 492.485 0.115 50 20 JCGD CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)no1 1779372682 WDIXLDOBWYPNHF-XMSQKQJNSA-N 456.503 0.677 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1780203833 WPUBVHSIRBFHQD-FZKQIMNGSA-N 484.282 0.813 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780933874 FXEDVSDFOATGCF-HXUWFJFHSA-N 466.636 0.573 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)[C@@H]1SC(=N)NC1=O 1781229466 HZBONWLQRVRZIQ-NXKWAJLKSA-N 451.376 0.855 50 20 JCGD Cc1cccn2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)c12 1781415146 PNGSXQWTALXYTA-PXDATVDWSA-N 476.342 0.764 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CSCN3C(=O)[C@@H]3CCC(=O)N3)C2)C1 1782871669 LPZUQBFHJQBYCS-PDSXEYIOSA-N 487.022 0.261 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1 1783336673 SGYCPTQUKHKCHI-GSLOIJSKSA-N 467.526 0.554 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(C)CC3)[C@H]2C1 1783597232 IRSNZNSPGVUHFT-QXDWZXEQSA-N 458.563 0.442 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C)nn3-c3cccc(=O)n3C)CCO2)C1 1783875963 QDCJBYSMQBYNKG-ZHRRBRCNSA-N 477.949 0.577 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4sccc4[nH]3)C[C@@H]21)c1cccc(B(O)O)c1 1786984293 ZPVVBVWWOODBII-QOKNQOGYSA-N 453.329 0.816 50 20 JCGD CCn1nc(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1787288438 OYJCADKQCAFZTC-XWOIHUEZSA-N 469.546 0.939 50 20 JCGD Cc1ccn2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cnccc5C(=O)NN)[C@H]4C3)c2c1 1788610142 GEFUGWOSRCKLNN-ZRCAFCQKSA-N 477.525 0.548 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1 1789521378 BKDOGFCXTDGCJA-FQEVSTJZSA-N 497.508 0.928 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(F)c1 1790048682 VVJMYGRWEBZJJI-ZRCAFCQKSA-N 456.279 0.421 50 20 JCGD COC(=O)C12CCC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]4C3)(CC1)CC2 1791290832 ABCKIAHOULFMFY-FXCWXOCZSA-N 492.617 0.853 50 20 JCGD CN(C)c1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1791468249 QELBGQUNHWPHQL-OYDLWJJNSA-N 479.386 0.659 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccnc1C(N)=O 1794562303 UAAGJLURPWEFBL-DTENLMNISA-N 451.487 0.566 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)C1 1795732846 MYGYPQHFUMKDTO-FJWRRNOESA-N 499.373 0.039 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnn(C)c1)C2 1796440513 OITNRRRROUJJNK-RUUUSXTRSA-N 455.519 0.076 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Cl)n1)C2 1796441699 SEXHVIVSPUEGSQ-WPLOUJSJSA-N 459.894 0.467 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(F)CCCCC1(F)F 1797207963 RQUNQKALVLQPRY-DOHHPOSVSA-N 454.254 0.487 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(C(F)(F)F)cc1 1798955379 HOJQNWZMFWIRSV-HGKCTWBKSA-N 462.233 0.902 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)C1 1799198041 RGPNBEOVYNLUAP-VJTDZRGJSA-N 466.362 0.608 50 20 JCGD COc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)ccc1[N+](=O)[O-] 1799252259 VFGVWRCCUOKQIS-MFKICJERSA-N 477.518 0.109 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(F)c(OC)c1F 1799738849 MQNLAWJLDXMKHV-VTEUUUEMSA-N 490.268 0.179 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)C(C)(C)C 1805806840 TZYPQEKHVXSKQV-HXUWFJFHSA-N 457.380 0.762 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374892 KXMCCTCHVLNAKD-OXJNMPFZSA-N 463.259 0.631 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807951290 YQHYSRJXPLIWOU-MFKMUULPSA-N 451.274 0.331 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1 1808416124 FATHRGXDZWRZAZ-MZKCJKBZSA-N 477.529 0.903 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809969881 UUBDRUVTDVSLLZ-UHFFFAOYSA-N 496.398 0.116 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(=O)Nc2cccnc2)[C@H]1c1cccnc1 1810464723 DQEQVGAEYAXKBJ-LAUBAEHRSA-N 467.530 0.494 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(=O)Nc2cccnc2)[C@@H]1c1cccnc1 1810464732 DQEQVGAEYAXKBJ-UWJYYQICSA-N 467.530 0.494 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cccn4c(O)nnc34)C2)CC1 1810769003 BVEKZXSVTBPQHO-UHFFFAOYSA-N 463.303 0.273 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nn1C 1813069233 WGDQMKBNLAGZLI-WZONZLPQSA-N 455.563 0.745 50 20 JCGD CC(=O)NCC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815339786 YGCFXIYOCZCQIJ-SFHVURJKSA-N 455.324 0.558 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCCO3)CC2)c1ccc(B(O)O)cc1 1815344030 CSZNBFMQIZRYPZ-AWEZNQCLSA-N 467.316 0.342 50 20 JCGD CC(=O)c1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n[nH]1 1815354964 JIWYBNGTIUZWCW-ZDUSSCGKSA-N 453.289 0.288 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnncc1C(=O)O)CC2 1817281798 PLULCKPWHRXVDX-WCJGGXHISA-N 496.509 0.991 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCNC(=O)C1)CC2 1817283103 UZQLNFUJIKNBPK-RQPXNKNVSA-N 471.543 0.715 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1 1817973138 UBOGMJJDHCVLOV-BFHYXJOUSA-N 459.931 0.887 50 20 JCGD COC(=O)C12CC(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)CCC(=O)NN(C)C)CC4)(C1)C2 1825558641 NLAYVITWMGPUNK-BQXHSLBWSA-N 463.560 0.771 50 20 JCGD CN(C)c1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)o1 1825753773 CTMXPBPEELQFBC-IBGZPJMESA-N 454.336 0.968 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827058020 OYQXOZXTZBEIOY-LJQANCHMSA-N 494.382 0.983 50 20 JCGD O=C(COCCO)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829055768 BJZVNEPHZVUVKN-WIYYLYMNSA-N 471.913 0.982 50 20 JCGD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)nn1C 1829844395 JAIDMNVDRILGAG-LJQANCHMSA-N 469.546 0.974 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1 1830221996 WVMAZJIPKROAOI-LIVBEALHSA-N 471.348 0.968 50 20 JCGD O=C(c1ccncc1C(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728596 VQZZPWZPEUHRLN-WMLDXEAASA-N 451.829 0.770 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1 1832551934 VZKGZGXZDWKYON-OCHXJIAHSA-N 487.981 0.467 50 20 JCGD CC(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n[nH]1 1834801275 UYKJJTRWNFLTMF-UHFFFAOYSA-N 467.379 0.712 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834824559 BEGVFZAHDQRRJG-OWMRDYPQSA-N 484.347 0.998 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1 1835100587 CDUWCCGAMPXWCZ-MZJWZYIUSA-N 499.532 0.637 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc4ncnn4c3)CC2)CC1 1835633195 SSPKFPVSYUGFER-UHFFFAOYSA-N 470.578 0.288 50 20 JCGD CCn1nccc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737096 MSILGPQIZNMOIF-UHFFFAOYSA-N 468.562 0.401 50 20 JCGD CC(C)[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835926142 HMXDVRXMSPURHC-JYFHCDHNSA-N 480.370 0.876 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4[nH]ccc4s3)C2)C1 1835930786 ZPTGFFUBYZRKBC-JOCHJYFZSA-N 469.328 0.293 50 20 JCGD COc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ccc(F)c1F 1835931980 JSHMIABNWUARCH-HSZRJFAPSA-N 490.268 0.037 50 20 JCGD CCC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)n1cccc1 1835937424 VPDWIRVZXDNGEL-ZJSXRUAMSA-N 469.347 0.279 50 20 JCGD O=C(CCN1Cc2ccccc2C1=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836589930 HJUHDLSTCOVAJN-PGRDOPGGSA-N 465.934 0.089 50 20 JCGD Cc1cc2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)[nH]c2cc1C 1837345383 ZAXAJMRUORQHPR-RUZDIDTESA-N 492.341 0.243 50 20 JCGD Cn1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c2c1CCC2 1837713358 YXUPRTGBENFUFN-NRFANRHFSA-N 450.612 0.830 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)[C@@H](C)O4)CCO2)C1 1838589208 MZYAAOKUXVQURH-WEBUEUPWSA-N 481.933 0.730 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)COc3cccnn3)CC2)CC1 1838789234 MKMJQANWLSNPRK-UHFFFAOYSA-N 462.551 0.227 50 20 JCGD O=C(c1ccc2ncnn2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200001 BWXIGAKMBFZKDR-YOEHRIQHSA-N 456.272 0.490 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1OC 1839399131 LAKMOZZEGIBHIY-RUZDIDTESA-N 498.341 0.076 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(O)c4ccn(C)c34)C2)C1 1840154537 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475.970 0.300 50 20 JCGD Cc1cccc(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1836763596 RAZSSISVRVCGBN-UHFFFAOYSA-N 465.359 0.925 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cnc1Cl)CCO2 1837855356 FFIMYCOYKQMMLS-OAQYLSRUSA-N 492.895 0.256 50 20 JCGD O=C(CCCn1ccnc1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920832 ILULLXHCQNIHNI-UHFFFAOYSA-N 468.363 0.656 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(-c3ccccc3)no1)CCO2 1837996445 ALCUXAGGFCNSCK-RUZDIDTESA-N 491.309 0.405 50 20 JCGD CCc1noc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1838055597 GMYWXFMWUDEQNV-XTVKVDEJSA-N 486.529 0.749 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)CCO2)C1 1838484061 XMODVNWZKCIQSP-GAJHUEQPSA-N 489.960 0.894 50 20 JCGD N#Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1Cl 1838595793 BYKZANNQXILMBP-HSZRJFAPSA-N 483.717 0.275 50 20 JCGD CCOc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1 1839198102 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COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccc(C)cc34)C2)C1 1840152798 UCVXJMBOPCUJKJ-LAUBAEHRSA-N 450.923 0.967 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccoc3C(F)(F)F)C2)C1 1840184309 ZFKAAPXJZWPIMR-IBGZPJMESA-N 476.452 0.741 50 20 JCGD Cc1ccc(F)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840184809 CIVIASRBFQSJOV-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185407 PRUPXFKIZDYDCX-HSZRJFAPSA-N 496.992 0.721 50 20 JCGD CC(C)(C)OC(=O)N1Cc2nccnc2C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841354356 VNAOQIRYSSOGJM-DLBZAZTESA-N 479.965 0.942 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1841358076 XGBNUGOGHCGEPR-CQSZACIVSA-N 460.535 0.663 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C[C@@H]2COc3ccccc3O2)C1 1841549755 ZOFYMMOXNRYXPM-OAHLLOKOSA-N 451.483 0.732 50 20 JCGD COC(=O)C12CCC(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)(CC1)CC2 1843013952 HWJZADZRWAHGKJ-UHFFFAOYSA-N 454.332 0.697 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CNC(=O)c1cc(C)on1)C2 1843416279 RIVRLVCMACILCO-ZVHZXABRSA-N 455.475 0.050 50 20 JCGD COC(=O)C12CCC(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)(CC1)CC2 1843942191 JXQJPXAXNXULGJ-UHFFFAOYSA-N 454.332 0.697 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)c([N+](=O)[O-])c1 1846385740 PWLLGOIBLIYCIB-UHFFFAOYSA-N 461.475 0.571 50 20 JCGD O=C1COc2ccc(Cl)cc2N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1848035506 OIAIFXZGOBFQKN-ROUUACIJSA-N 483.717 0.261 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCCN(C(=O)NNC(=O)c2c(C)nc3ccccn23)CC1 9747971 CKKVINVDCDKZTF-UHFFFAOYSA-N 475.531 0.999 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)c1ccc(-n2cnnn2)cc1 23787649 DTWHTYZIWWBROX-HNNXBMFYSA-N 473.490 0.663 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cn1c(=O)cnc2ccccc21 28580957 KTCXIVGBRNVKSZ-UHFFFAOYSA-N 499.549 0.198 50 20 JCGD C=C1c2ccccc2C(=O)N1CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 28663236 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JCGD NC(=O)[C@H](N)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1828990347 NSUNMESRGUIIMX-NRJQMVOHSA-N 497.955 0.566 50 20 JCGD O=C(CN1CCc2sccc2C1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726341 QBPZECQIYLIWEV-UZLBHIALSA-N 457.980 0.162 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1831299716 DUXZRHJAOAOWJI-JCYRPKCISA-N 494.353 0.249 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832552111 XOOIYTYMRVUERT-QEEYODRMSA-N 498.404 0.829 50 20 JCGD O=C(/C=C/C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)NCc1ccco1 1833312347 MAAGNBCPUHPZKD-RTLBZRNLSA-N 466.966 0.623 50 20 JCGD Cc1nn(C)c(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1F 1834030248 LEUZVUBUEYFSCO-UHFFFAOYSA-N 465.574 0.426 50 20 JCGD CNCCCC(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1834711766 KBMWXKOFUWOHOG-WPWMEQJKSA-N 459.595 0.692 50 20 JCGD CNc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1834797951 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C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1847062181 SCGFZUVRCXFJED-OAHLLOKOSA-N 450.499 0.321 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cnccc3C(=O)NN)CC2=O)c1 1847214072 PHZJYTYAEPPKPB-JHVJFLLYSA-N 492.536 0.562 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)C(=O)NC1CC1 10215459 BFOMVSSKHXLWCE-CYBMUJFWSA-N 493.405 0.275 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)c2cc(Br)c[nH]2)cc(OC)c1OC 24123834 ZLMRIJXKXFIUGH-UHFFFAOYSA-N 455.265 0.994 50 20 JCGD CCN(CCNC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O)C1CC1 726281523 XFJQKKZOBNMQJN-SFHVURJKSA-N 497.618 0.767 50 20 JCGD Cc1noc2ncc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc12 726764141 APVWHPYJCQTTTP-UHFFFAOYSA-N 465.513 0.939 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCn3nnc4ccccc4c3=O)cc2)CC1 728213064 DAIJBLKXYNZBBQ-UHFFFAOYSA-N 471.543 0.261 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cscn1)N(S(C)(=O)=O)CC2 728600810 UOYHDVPOAYJGQA-AWEZNQCLSA-N 454.530 0.870 50 20 JCGD COc1ccc(N2CCN(CCNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1 743363688 VWWRTAGVJRGSEF-UHFFFAOYSA-N 465.518 0.437 50 20 JCGD Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)cn1C 750663445 OAOKNNXOKNHODY-JTQLQIEISA-N 474.337 0.384 50 20 JCGD C[C@H]1CN(C[C@H](C)C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)C[C@@H](C)O1 874090907 IBVLEVXAVGWKNA-OKZBNKHCSA-N 456.547 0.727 50 20 JCGD NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1 913416688 OXUCOQQKZZEMFH-QAPCUYQASA-N 456.455 0.534 50 20 JCGD C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1F 914880610 RFMODDDTVQAHRS-UHFFFAOYSA-N 469.520 0.658 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1 920297405 HMAKSNYEHOOFEN-LLVKDONJSA-N 474.948 0.840 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778115827 BLIPOYZXZATNHH-MAUKXSAKSA-N 480.425 0.661 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1 1778874334 LBROOLUQMKTJRZ-PBGFEDEFSA-N 494.508 0.685 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1780826969 MHBKDXDMTFWXNU-AUSIDOKSSA-N 469.546 0.395 50 20 JCGD Cc1nn(C)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969671 NSWOVBXCTGBSMT-XMMPIXPASA-N 483.573 0.518 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1782214220 ODOCEFCDZCMFCP-JODTVWMVSA-N 490.557 0.704 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1782996334 PCERVODTEMVIAT-RCZVLFRGSA-N 479.342 0.766 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1783511597 FNLAXIIKUSVTCT-KOSHJBKYSA-N 489.573 0.504 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(NC(=O)C3CC3)cc1)CCO2 1783935667 WSFPMBWISHDURR-DEOSSOPVSA-N 471.558 0.852 50 20 JCGD COc1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784264636 HIKPMTXNKALFOR-RRPUWOKSSA-N 466.343 0.601 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1C 1784841600 ZTGPJYYBAMXTBT-RRPUWOKSSA-N 466.343 0.519 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCc4sccc4C3)[C@H]2C1 1785100219 HMHPRRFBLBJCRZ-VDGAXYAQSA-N 498.609 0.398 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786407471 ZKNLAIWKAMQLQK-PWNZVWSESA-N 464.357 0.594 50 20 JCGD Cc1cc2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)[nH]c2cc1C 1786979664 IPSFWNMKNUXCRX-JLMWRMLUSA-N 476.342 0.767 50 20 JCGD COc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1OC 1786981863 NOZYKUKRHNKJIL-KNBMTAEXSA-N 486.305 0.430 50 20 JCGD COc1ccc(COCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786986675 XKQKAFPBGBHHBF-VJBMBRPKSA-N 482.342 0.185 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cnc2cc(Cl)ccn12 1787238392 HCWTUZRYQKJDHA-QSFXBCCZSA-N 482.733 0.575 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCCCC3)C[C@@H]21 1787508788 MUDOXHCCOKOMQE-QYVIPLSYSA-N 472.590 0.976 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C[C@@H]21 1787509194 YWGPVRVVIWPAIZ-RJSLJBRQSA-N 472.462 0.045 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609943 UNXXJWWRUVUXDO-CIJNOWTPSA-N 485.541 0.034 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)OCO4)C[C@@H]21 1788610622 MRAPREHPUMFCNL-XERREHJYSA-N 481.509 0.250 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C[C@@H]21 1788611104 MLZNBEORHJBLLE-DCPHZVHLSA-N 467.530 0.125 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C 1793087829 PYWBZXUNRLFKSN-UXXRCYHCSA-N 478.384 0.635 50 20 JCGD COc1ccc([C@H]2C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795737631 DSNZHKNHBCDGMU-HLSZOSTASA-N 464.327 0.382 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(C(F)(F)F)cn1 1796069258 YUQSENOEMJPVHS-CULMDFNYSA-N 479.419 0.011 50 20 JCGD Cc1ccccc1NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797750447 FRFLJRAYDAGIPM-VPTLXERWSA-N 452.515 0.309 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c(O)cc1O 1799444990 AAZWXWSQBJGLRH-SLAYPKMVSA-N 454.911 0.327 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1 1807358630 MPHDSCVORZNTRY-GRDNDAEWSA-N 459.894 0.386 50 20 JCGD Cn1cc(CCC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1807362181 FKLMVXCWZWVFQJ-NFBKMPQASA-N 461.331 0.447 50 20 JCGD NC[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccc1 1807370397 COELZMFXOBJNBD-NHTMILBNSA-N 472.354 0.824 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3nonc3c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376138 SRBUTORDXNWQRD-GCJKJVERSA-N 471.282 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2[nH]nc3ccncc23)[C@H]1c1cccnc1 1808101832 HHTSWMSKUFBFPY-QVKFZJNVSA-N 485.508 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1 1810302016 DNXMKXHRIDCPBD-IERDGZPVSA-N 485.508 0.756 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc(Cl)nn1 1810680230 CRRGBNMBOIRGTN-JXFKEZNVSA-N 465.706 0.838 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@@H]1c1cccnc1 1813074460 RFSCWDKVVRHMQB-RDTXWAMCSA-N 472.468 0.139 50 20 JCGD O=C1Nc2c(C(=O)N[C@@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)cccc2C1=O 1815356317 BVJSDZSPRSAEFO-CYBMUJFWSA-N 490.306 0.497 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc(OCF)cn2)[nH]n1)c1ccc(B(O)O)cc1 1817470895 LEVJAYWZBRPJPR-QGZVFWFLSA-N 468.254 0.805 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(=O)oc2)[nH]n1 1819401943 GPKVTXKTYUGDRU-INIZCTEOSA-N 451.443 0.981 50 20 JCGD Cc1cn(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c(=O)nc1O 1822418004 UAZLIGOLGNSHGW-OAHLLOKOSA-N 474.522 0.046 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1CCc2nc[nH]c2C1 1822686333 BIYSEGQZJGRZAW-FOIQADDNSA-N 462.319 0.924 50 20 JCGD C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(CCO)CCO)CC2 1822870196 URVLJXTYBNQBQK-APPDUMDISA-N 453.392 0.578 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cccc(B(O)O)c1 1823002171 AOADXGSWCOFDNW-GXFFZTMASA-N 456.102 0.739 50 20 JCGD CN1CCCn2nc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)CCC(=O)NN(C)C)CC4)cc2C1 1824385775 YMJLCIUKKKAGBE-CQSZACIVSA-N 488.618 0.774 50 20 JCGD O=C(c1ccc2nncn2c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057523 HNBXEQWFIRXKIF-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD Cc1nnc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)o1 1828926136 AEKKFZZMKAOMRY-SFHVURJKSA-N 455.519 0.853 50 20 JCGD O=C(CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)Nc1ccccc1 1830719984 QISLZXBVTDFLNF-AVRDEDQJSA-N 467.950 0.852 50 20 JCGD O=C(c1ccc(Br)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731407 LIDSCUIOLUMUPQ-RHSMWYFYSA-N 462.728 0.514 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830737902 JVFHKSZFVNWWFK-ZXJYCPGTSA-N 487.981 0.442 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2CCOC2=O)CC1 1831873064 HVSHYVDVNNAKGU-GOSISDBHSA-N 451.568 0.821 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cncc(N(C)C)c1)CCO2 1833361110 HVNQQWXBOQDKTO-FXZATJRASA-N 497.556 0.352 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nccs1)CCO2 1834434498 GBFZZLNSIAZWJT-BTVXTAIASA-N 460.516 0.347 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797422 JNEIPFSAJSNFLN-UHFFFAOYSA-N 473.379 0.283 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnoc3C3CC3)CC2)CC1)c1ccc(B(O)O)cc1 1834797902 JQBWLQFOTSHXQJ-UHFFFAOYSA-N 466.347 0.731 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4nc[nH]c4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798654 VNVXHXWIBGMBMO-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4nonc4c3)CC2)CC1)c1cccc(B(O)O)c1 1834800121 RIBTYLSRQGBBBK-UHFFFAOYSA-N 477.330 0.402 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1n[nH]c2c1CS(=O)(=O)C2 1834913259 DFUDGDCQXFROHC-UHFFFAOYSA-N 478.402 0.827 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1837483026 HXTBWKUIWNIEQF-KYNGSXCRSA-N 460.362 0.970 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1837717638 KXMZGPJKXBEHAM-SFHVURJKSA-N 475.665 0.155 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921301 WOJWJKNOVXMMBM-KRWDZBQOSA-N 473.379 0.283 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1838022796 GMNGWYISDFNRHT-CQSZACIVSA-N 496.366 0.598 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1 1838513499 VKOLPLGDKVWTRJ-PIGZYNQJSA-N 470.349 0.940 50 20 JCGD Cc1c(Br)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)nn1C 1838768376 GVAMVZCUZKNVEB-YVEFUNNKSA-N 479.759 0.161 50 20 JCGD CCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054158 JAYORXRWLLXGFG-HSZRJFAPSA-N 461.563 0.589 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCOC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1840190373 UEFFNXXUEJBLMR-JLTOFOAXSA-N 496.388 0.882 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)CCO2 1840219567 SGSVIAPDSLXSMB-USCONSEESA-N 489.997 0.832 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1C 1840645259 LJISMVZROHVXAY-QHCPKHFHSA-N 462.547 0.447 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1840895743 JPWVBBLWAWJQPJ-INIZCTEOSA-N 480.406 0.088 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@@H]2CCCN2C(=O)c2ccc(F)cc2)C1 1841308188 JTLJUKXJMOAHPH-NRFANRHFSA-N 479.317 0.627 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1841746556 QXNKSMSROFLFKZ-SFHVURJKSA-N 457.336 0.653 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012690 MHUDNSOZCIYHMD-OAQYLSRUSA-N 467.306 0.070 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCC(=O)N2C)C1)NC(=O)NCc1ccccc1 1845238647 XSNSEBYLVRNRDZ-SFHVURJKSA-N 456.547 0.157 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@@]21C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846189078 BZQDKLQJYZMRFT-XDHUDOTRSA-N 469.347 0.583 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846200347 NIJNQOKOYYFEOL-SFHVURJKSA-N 457.336 0.583 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](NS(=O)(=O)c2ccc(C)c(C)c2)[C@@H](C)O)cc1 9084215 DMXPDTMQHZDKLY-OXQOHEQNSA-N 477.539 0.644 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 16594293 BBPFEQSMKIPDSN-AWEZNQCLSA-N 468.557 0.373 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1 16786176 PDWUUAFQSUQZAN-MSGBMKDASA-N 455.558 0.281 50 20 JCGD COc1ccc(CC(=O)NNC(=O)COc2ccccc2F)cc1S(=O)(=O)N1CCOCC1 26695612 BGHIMTAMBLYXLV-UHFFFAOYSA-N 481.502 0.624 50 20 JCGD CCCn1c(=O)[nH]c(=O)c2c(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc(C(C)C)nc21 105869593 IYGIEEZEXUGGOE-UHFFFAOYSA-N 477.485 0.669 50 20 JCGD CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)NNC(=O)C(=O)N2CCCC2)CC1 727605233 FJEVCMKUKXSAGT-UHFFFAOYSA-N 466.583 0.217 50 20 JCGD CC(=NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 729819736 QSKYOVLNUNGTNS-UHFFFAOYSA-N 494.599 0.959 50 20 JCGD O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNC(=O)N2CCOCC2)cc1 745991632 AJQYBLVSEIYKFF-MRXNPFEDSA-N 474.543 0.796 50 20 JCGD CSCC[C@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1C(=O)[C@H]2CCCC[C@H]2C1=O 746110176 ZQLATQGLWVQEHQ-IXDOHACOSA-N 485.566 0.991 50 20 JCGD CC(C)NS(=O)(=O)CCNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1 746512756 ZQMVNYALLNZSIB-LLVKDONJSA-N 451.343 0.875 50 20 JCGD CN(CC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 747900639 TVMQCSWXGMCQCS-VXKWHMMOSA-N 470.595 0.880 50 20 JCGD COc1ccc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)CNC(=O)c2cccs2)c(OC)c1 751209605 SZJUHIPTBPFRHF-HNNXBMFYSA-N 460.512 0.947 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1ccc2c(c1)OCCO2 791012384 JXQDTBQWIPUPNA-UHFFFAOYSA-N 465.459 0.693 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCN(C(C)=O)CC3)cc2)cc1 825541900 CQJRABJJDAPEBY-UHFFFAOYSA-N 489.554 0.421 50 20 JCGD CN(C)N(C(=O)CCCCC/N=C1/NS(=O)(=O)c2ccccc21)[C@H]1CCS(=O)(=O)C1 849193432 UOIZJTHXGIQLSN-HNNXBMFYSA-N 456.590 0.778 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(Cl)ccc3O)c2)CCN1 910492634 HDCCGXGMVIFQCX-UHFFFAOYSA-N 452.876 0.241 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1 914451924 IVNUNADIWKMHDG-UHFFFAOYSA-N 463.516 0.660 50 20 JCGD O=C(NNC(=O)c1cc[nH]n1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 916144917 XRWMGOONAIWJIL-UHFFFAOYSA-N 468.539 0.991 50 20 JCGD CC(=NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1 916351929 OARBHKWLHFXRIU-UHFFFAOYSA-N 457.472 0.569 50 20 JCGD CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1 916485859 JXKVRAVBKJANCW-UHFFFAOYSA-N 474.587 0.637 50 20 JCGD Cc1ccc(C)c(-n2c(C)nnc2SCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 919883880 GHUKOGCDUMQGOJ-AWEZNQCLSA-N 452.562 0.802 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNC(=O)NCCCOC)CC2=O)cc1 920862580 XHZSIOOYPIORAR-HNNXBMFYSA-N 469.564 0.437 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)no1 1778074921 LFYNDZATKZJPGJ-UZUQRXQVSA-N 499.528 0.138 50 20 JCGD Cn1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)c(C(F)F)n1 1778357048 GDSJYRIEBZRCOT-OPAMFIHVSA-N 491.499 0.798 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3ccccn23)C1 1778587488 FEUOUDHYKFWCQW-WZONZLPQSA-N 456.547 0.835 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3ncccc13)CCO2 1779030198 IXGBFLUNQQFNKS-DEOSSOPVSA-N 460.494 0.991 50 20 JCGD Cn1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C(F)(F)F)c1 1779030222 KRRJOEUTEQIWBM-FQEVSTJZSA-N 480.447 0.800 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1 1779037174 SSZZRCFMBXZFAX-XMMPIXPASA-N 478.509 0.327 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1 1780069872 DNOADIKVPGOIKE-UQQIOGDDSA-N 482.526 0.664 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc[n+]([O-])c3)CCO2)C1 1780095231 LCNGAYIFNMXDOC-JOCHJYFZSA-N 470.438 0.911 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1cccc(Cl)c1 1780929456 NOQNYBDGIXKCTG-HLIPFELVSA-N 458.342 0.947 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1)NC(=O)NCc1ccccc1 1780968745 PIAZQUSPTITOAK-JOWQQVNMSA-N 499.616 0.634 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccccc1F 1781416065 LVWIBUAMIBSCJQ-RPWUZVMVSA-N 491.564 0.380 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)COc3ccc(O)nn3)C2)C1 1782673533 MOGLCDSATRAWKK-QKKBWIMNSA-N 499.952 0.523 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(C)n1 1784294442 NLAMCALULTXBQR-XMMPIXPASA-N 451.332 0.455 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C(=O)Nc4ccccc4)CC3)C[C@@H]21)c1cccc(B(O)O)c1 1786982824 INHSLGQHTXZKMA-NYVOZVTQSA-N 491.353 0.379 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982825 DLQZJYINLKKRHA-JLMWRMLUSA-N 466.299 0.258 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4c(O)nnc34)[C@H]2C1 1787387841 QNORRMRSYAVUNV-IMIFBBOLSA-N 452.309 0.812 50 20 JCGD Cc1ccn2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cnccc5C(=O)NN)[C@H]4C3)cnc2c1 1788610036 XPDUFUJZHMNLEK-QSFXBCCZSA-N 477.525 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cc(Cl)ccc4n3)C[C@@H]21 1791290823 AOQAMFWQQFPUPM-ZVZYQTTQSA-N 476.965 0.954 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1 1791292394 CHAPAZHOAVMLNC-RVMXOQNASA-N 454.351 0.655 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1792007738 DGMKIEFWGGGXKP-NDXORKPFSA-N 480.525 0.551 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)C1 1792970117 SMGKHUYBXOOOSV-PXQNEATLSA-N 473.530 0.299 50 20 JCGD Cc1cccc(C)c1N1C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)CC1=O 1793869873 DGMIKJJOLWRQSX-JNIAIEOXSA-N 463.962 0.846 50 20 JCGD O=C(C[C@H]1COc2ccccc2O1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796189795 BFTVPQVFJDFYEX-YRPNKDGESA-N 450.300 0.848 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3)C2 1796443847 NWQIDRYKBXDCCD-UIZNVDRRSA-N 478.509 0.518 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)ccc(O)c1F 1799728108 PWMUFPGERWJVQV-XGISUXEOSA-N 461.425 0.186 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2 1802022317 MISWYDDYOVUBFH-YVSFHVDLSA-N 497.593 0.454 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)C2 1802338029 MUQLOSBVYQPTEI-ILOCAZANSA-N 481.594 0.225 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@@H]1SC(=N)NC1=O 1803139630 RWGHLOHWLWIVHB-NBRWMIFNSA-N 453.952 0.490 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cc2cnccn2)[C@H]1c1cccnc1 1803302608 WNADPEUWIQRSQG-HRAATJIYSA-N 460.498 0.432 50 20 JCGD CC1CCN(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1803387852 KEHFBSGHQHUISZ-URXFXBBRSA-N 464.375 0.813 50 20 JCGD CCCNC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1803446460 FNYDTNYJJFNASI-FDDCHVKYSA-N 460.579 0.767 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1804096966 ZNFIADIIYGFZAO-NORZTCDRSA-N 452.309 0.423 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)on1 1804260254 XSBCZYXVJOZGAP-HRAATJIYSA-N 463.498 0.939 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C 1804433301 UWMJPGHIXSDIMJ-KHMAMNHCSA-N 460.959 0.647 50 20 JCGD N=C(N)SCCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1807127808 QJCOHMPJBGZWEK-KBXCAEBGSA-N 470.559 0.416 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807359898 MSIKBZXOPOOTOE-BVSLBCMMSA-N 450.348 0.565 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374346 GSLBCQIJDBYNET-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809971365 UCYGWQBXNDOGGE-KRWDZBQOSA-N 451.336 0.502 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(=O)ccn2C)[C@H]1c1cccnc1 1811366711 PZFAOOFTLQSSHC-HTAPYJJXSA-N 454.531 0.473 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1 1812118395 JKPCCLDVKWFZNF-OXQOHEQNSA-N 490.524 0.693 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812715630 UVQJRIVYOJXWAL-NQIIRXRSSA-N 452.628 0.226 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(C(N)=O)cc2)[C@@H]1c1cccnc1 1813739785 SGMCWCMDMLGFCN-UGKGYDQZSA-N 466.542 0.873 50 20 JCGD Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)s1 1815577664 QAMSPRHPOUPLMN-JTQLQIEISA-N 472.556 0.770 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3cccnc13)CC2 1819797738 ZBNUIRWNGUZVMZ-NSHDSACASA-N 477.510 0.724 50 20 JCGD C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1cccn1 1819801380 KTNGEVFJYWPDLI-RYUDHWBXSA-N 454.516 0.825 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])CC1 1827646563 UXEVGAIRBWRTKI-QGZVFWFLSA-N 455.280 0.545 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccc(Cl)cc1 1830259837 BONVKHSOJWUOLX-MZNJEOGPSA-N 486.761 0.894 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731681 MECWKRQQPLOQSP-AVRDEDQJSA-N 483.949 0.309 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731760 MLXGUUZJZYNPAB-WBMJQRKESA-N 454.833 0.109 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830739010 XJLOKQOOYJSLBB-AUSJPIAWSA-N 496.026 0.299 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832078574 IRUCDPMAQRBEDJ-JKSBSHDWSA-N 489.997 0.832 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnnc3)C2)C1 1832549621 VPHUIFJNHGGHJW-HRAATJIYSA-N 483.953 0.679 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4cccn4cn3)CC2)CC1)c1cccc(B(O)O)c1 1834799949 HSOJGDVMJULYSH-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnccc3F)CC2)CC1)c1cccc(B(O)O)c1 1834800147 SQOCYCZJDJILTL-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1834823665 BNPDHPGHMQEUGT-GOSISDBHSA-N 459.293 0.658 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)C)CCO2)NC(=O)NCc1ccccc1 1834904511 ITEYTAKGBMXYLV-DEOSSOPVSA-N 475.590 0.835 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccc2[nH]ncc12 1834998330 USWOFQBPSJDNFO-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CC2)CC1)[C@@H](F)Cl 1835079652 LFVYYNKLUGVYGZ-MRXNPFEDSA-N 461.947 0.558 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C2)C1 1835927082 DFSNPEGOVPRYNI-CBNMVNINSA-N 482.264 0.169 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3cccnc3n1)CCO2 1836834449 MAUBOJXFUYTTJA-QHCPKHFHSA-N 470.530 0.073 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cnc4ncccn34)CC2)CC1 1837919387 LLLZCKCZLFNUFB-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838418066 TZTCMWWJCHXBTF-ORAYPTAESA-N 499.387 1.000 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cnc3snnc3c1)CCO2 1838506316 JFDNPTOMHPARIM-KRWDZBQOSA-N 470.349 0.941 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccccc1F 1839233882 PNJSWYYDZQXWLP-QIJUGHKUSA-N 485.940 0.233 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)c(F)c1)CCO2 1839270925 BZZCOMWVZGUDNY-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCNC3=N)C2)C1 1839743264 HCNGCURJJWNRNT-AKMURLTLSA-N 488.495 0.168 50 20 JCGD C[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)Oc1ccccc1 1839748115 XDDRESKTHOGDKE-IQGLISFBSA-N 497.552 0.613 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1 1839964761 BSWULDOSCSARBC-BEFAXECRSA-N 466.336 0.973 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1839964965 JXICOHYWMLGIOO-AUUYWEPGSA-N 471.352 0.909 50 20 JCGD CC[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1840057953 JLFZWSLXQJQTSN-XFAGBWLFSA-N 473.574 0.972 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)C1 1840151172 XAZBGSBKLGUTPX-GCJKJVERSA-N 482.965 0.242 50 20 JCGD O=C(COCCOCCOCc1ccccc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012410 MOGBDPACNIKHLX-UHFFFAOYSA-N 496.369 0.433 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CN2CCN(C)CC2)C1 1843914957 PBFAZFDRXXEAJB-UHFFFAOYSA-N 459.503 0.585 50 20 JCGD C[C@@H](C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1)n1cncn1 1845039485 TTXNVINLSULFDH-KRWDZBQOSA-N 454.535 0.389 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1 1845940344 KJNSEIMBCUSTLG-GOSISDBHSA-N 498.443 0.926 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O)C2 1846365689 OWDVKBGGMMRJPG-OAHLLOKOSA-N 472.970 0.523 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CSCC(=O)N3CCCCC3)cc2)CC1 728215378 YJCSELHSZLGFFS-UHFFFAOYSA-N 469.633 0.812 50 20 JCGD C#Cc1ccc(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC)n(Cc3ccccc3)c2=O)nc1 728858953 FWWQKTGSFKTJRV-UHFFFAOYSA-N 471.477 0.265 50 20 JCGD Cn1[nH]c(Br)c2c(=NCCNC(=O)NNC(=O)COc3ccccc3O)ncnc1-2 730911912 RURIOHGXKVYURG-UHFFFAOYSA-N 479.295 0.026 50 20 JCGD CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)C(=O)N2CCCC2)ccc1Br 748241018 NJOHPNWRTSRLBH-UHFFFAOYSA-N 475.365 0.909 50 20 JCGD CS(=O)(=O)N1CCCc2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc21 804545332 WRYXPNXERUXLHG-LJQANCHMSA-N 489.506 0.543 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCN(C(=O)N(C)C)CC2)c1 916107646 FQRYBCMXQWGDLH-UHFFFAOYSA-N 453.565 0.872 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCCc2ccc(OCC(=O)NC3CC3)cc2)c2ccccc2c1=O 918107037 BRBSIPPSVYLCFY-UHFFFAOYSA-N 478.509 0.778 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCCC(=O)N(C)C)N(S(C)(=O)=O)CC2 919923462 GNZNTBNPHMTYMZ-MRXNPFEDSA-N 499.590 0.152 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)CC2)c1 1318234625 QCPXBKLXSFHIJH-AWEZNQCLSA-N 453.517 0.138 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1 1778874333 LBROOLUQMKTJRZ-NRYSQFAASA-N 494.508 0.685 50 20 JCGD COc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028691 IHIXHZXLIAHKEH-OAQYLSRUSA-N 474.905 0.499 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)COc3cccc(Cl)c3)CCO2)C1 1779029636 WJRKMKWJZFZLKV-JOCHJYFZSA-N 473.917 0.861 50 20 JCGD COCc1c[nH]c(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)c1 1780969022 SFIWCPBZLDDIGP-RUZDIDTESA-N 498.584 0.951 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1)NC(=O)NCc1ccccc1 1780970638 WEEALFSGRTYESS-PXDATVDWSA-N 487.601 0.979 50 20 JCGD COc1ccc(C2(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)CCC2)cc1 1781209041 OSZYGBUOGFHGSE-VWLOTQADSA-N 478.354 0.940 50 20 JCGD N#Cc1cc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)ccc1F 1781298277 FJOLBSQTZJEIHJ-QHCPKHFHSA-N 451.263 0.063 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ccccn3n1)C2 1782212068 RPUJCBQBHNVNKV-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD O=C(CCCc1cccnc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782650486 MAEHPGSZVAAPLF-RCZVLFRGSA-N 465.359 0.912 50 20 JCGD C[C@@H]1[C@@H](C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CCN1C(=O)OC(C)(C)C 1785744792 XESQAFWLTMSZQH-YTZAWJCFSA-N 495.621 0.835 50 20 JCGD CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c2ccccc21 1787214564 RNSCXQLMDZPGCB-XJABCFGWSA-N 476.342 0.643 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ccccc34)[C@H]2C1 1787853236 ZZXGJQPRXGNCIX-DCPHZVHLSA-N 463.498 0.240 50 20 JCGD COC(=O)[C@H]1CCC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)C1 1788609717 CNYMKICDSSTPSO-UKSSEWCLSA-N 487.557 0.258 50 20 JCGD COc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1F 1788610369 NWSVVEKINGSYID-ZLIFDBKOSA-N 472.477 0.135 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCCn3cccc3)[C@H]2C1 1788711310 WTDJKSQSOKYQER-YYWHXJBOSA-N 468.558 0.950 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]2C1 1791257630 MERWNDNKHGFKCG-FJIDUMEYSA-N 450.960 0.290 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cnc3O)C[C@@H]21 1791287327 YECIFVWPLXMTTL-RCBQFDQVSA-N 453.927 0.407 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791492054 RDXDFVGYYXAOAJ-ALGWMNEGSA-N 466.542 0.552 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1792265176 UOXSENMKLCBZTA-JYLNKSEXSA-N 471.982 0.964 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2 1792881124 XRVVBEORSKPRMH-LNBCOLIQSA-N 473.574 0.177 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1792887003 MRBDXKATQQBXFA-FPYNETTCSA-N 468.320 0.152 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792975838 ZIHXMGJPFWNUMA-NNXHMXCWSA-N 471.982 0.965 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)(C1)C2 1792983731 MLMWEOJHLVHQCY-COZCDLTHSA-N 457.955 0.623 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3cccc(Cl)c3)CC1)C2)c1cccc(B(O)O)c1 1795739083 NOTWCGNACHHLBW-UPHUGPLXSA-N 468.746 0.955 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1796393116 QDGNZITTYJWHDU-XVIXHAIJSA-N 482.347 0.806 50 20 JCGD Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(C)n1 1797754298 QNXSCIRQXYBHKO-OPMZPASUSA-N 466.542 0.533 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1ccnn1)C2 1798523064 QLXHZXDPJGMKHK-FIIQBIKZSA-N 472.458 0.576 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799044153 AILRDBUNOFLGPT-BBIADKPPSA-N 490.325 0.252 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccs1)C2)NC(=O)NCc1ccccc1 1799095109 ULVBUZFIXCGVPB-IZZQQSIFSA-N 472.571 0.693 50 20 JCGD CN(C)c1c(F)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1F 1799834471 UKLBVQVIQBAMFC-HBCWATKFSA-N 488.495 0.546 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2 1800975823 UYHBAXHHQPUDRC-YALNPMBYSA-N 459.952 0.083 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cc1)C2 1801012481 JMDOMTZYUQGJSX-CCWDJLKJSA-N 454.474 0.864 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccc(O)nn1)NC(=O)NCc1ccccc1 1801267536 ZSJFCAQARUYTMR-REPLKXPHSA-N 497.556 0.545 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)C1 1805383653 GVAWBNHVUSJKJI-LBPRGKRZSA-N 466.340 0.688 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnc2[nH]ncc2c1 1809702528 HYUGFLNFXZDCGW-LAUBAEHRSA-N 470.298 0.666 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810300564 ZHWAVYNSCQEYAY-BEFAXECRSA-N 478.513 0.456 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1 1810301669 BSRJLEOWAFEZJR-QAPCUYQASA-N 486.496 0.151 50 20 JCGD CC(C)NCCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303752 VMFVNMWKNBWWOZ-LAUBAEHRSA-N 453.547 0.788 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)/C=C/c2cnccn2)[C@@H]1c1cccnc1 1810307032 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Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn2[nH]cnc(=O)c12 1817476491 IQYQYWBELBHURB-GOSISDBHSA-N 489.301 0.354 50 20 JCGD C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1ccccc1=O 1819797373 BELMCDSKWMGJSQ-QWHCGFSZSA-N 481.538 0.790 50 20 JCGD O=C(C#CC1(O)CCCCC1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1819844387 UNJSCBNXDCIROK-QGZVFWFLSA-N 467.356 0.747 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc(-n4ccnc4)ccn3)sc2C1)c1ccc(B(O)O)cc1 1821686881 JXHADUGBLKHRAP-INIZCTEOSA-N 488.338 0.943 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCS3(=O)=O)sc2C1 1824938748 GWMYLZLDDYHZEB-BXUZGUMPSA-N 457.578 0.005 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827056170 UVOVNWQZXPDFPM-NRFANRHFSA-N 457.380 0.762 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1830450579 VJMURTSVCXJQFL-NSYGIPOTSA-N 497.552 0.567 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1830539051 ZWAXMAQVVYWGOB-JLTOFOAXSA-N 484.347 0.954 50 20 JCGD CC(C)(C)n1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1Cl 1830724989 KSHHRAUYAHRTOI-IFXJQAMLSA-N 463.362 0.961 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C[C@H]2C[C@H]21 1830748101 FZSYNBASZHZHRU-VXSSCFTMSA-N 487.981 0.440 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2 1830811084 RHUTWLITJXFZMR-XMMPIXPASA-N 495.536 0.193 50 20 JCGD Cc1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)[nH]1 1831857829 HGJWKSZCIGBZCL-XMMPIXPASA-N 499.572 0.134 50 20 JCGD CN(C)c1cccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1832526029 NHJYWCIYEFNKTK-RXVVDRJESA-N 455.939 0.188 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc[nH]3)C2)C1 1832549089 DUSCYEVOZVFGDH-XOBRGWDASA-N 471.942 0.612 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833263711 RNRNBIYUZWZYIJ-OAHLLOKOSA-N 480.212 0.583 50 20 JCGD CC(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939555 SVYQGFKEVJHRRX-RUZDIDTESA-N 466.343 0.874 50 20 JCGD N#Cc1c[nH]c(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1836169437 RKEWCTIHPRTUBO-UHFFFAOYSA-N 464.530 0.384 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)N1CCN(C)CC1 1836372348 SMLSUVYRZKWUFL-QGZVFWFLSA-N 472.472 0.979 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3cncn3c1)CCO2 1837121626 URHCDOVIQOKSQM-FXZATJRASA-N 493.524 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccco4)no3)C2)C1 1837457956 YIVCRHILOBPABQ-HSZRJFAPSA-N 496.480 0.317 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839019219 KRZZRONGYIFTIZ-DEOSSOPVSA-N 483.525 0.468 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3F)C2)C1)NC(=O)NCc1ccccc1 1839054091 GQIBNYGFXIDXSY-YCRNBWNJSA-N 477.537 0.147 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)N1CCN(C)CC1 1839105716 LUDGOGOVHBDGKQ-DBVUQKKJSA-N 465.422 0.315 50 20 JCGD CN1CCN(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)CC1 1839152055 MAOYGICYBBDXTK-WOJBJXKFSA-N 465.422 0.317 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cncn3)C2)C1 1839743300 IQXFNXBGXYKBQM-DVQZYHKASA-N 472.452 0.620 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CNC(=O)C3)C2)C1 1839744062 MQRVHCCUGJNWTE-FNBZOWKBSA-N 474.464 0.464 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1 1840033124 UYWOUPFVKWGJSX-UQASEVPWSA-N 466.376 0.941 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1840033470 GIPDLCDNDDNVPC-YGRLFVJLSA-N 461.231 0.332 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)C2)C1 1840150582 NXTDKQLFUVOLHE-QYWGDWMGSA-N 477.986 0.857 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)CCO2 1840219565 SGSVIAPDSLXSMB-KNXBSLHKSA-N 489.997 0.832 50 20 JCGD C/C(=C\c1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840413782 YZFXEJBAQJHNET-OBZJUVQRSA-N 480.525 0.254 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCc3nc(O)nc(O)c3C2)C1 1842058280 ZTCQQOQPEMKJSA-ZKJHFGPLSA-N 481.513 0.330 50 20 JCGD CO[C@@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C1 1843428719 MYNHHUKGFIREAG-LPHOPBHVSA-N 489.378 0.041 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)C[C@](C)(O)CC(=O)O)C1 1846382035 ZUHAJDKYITVNCO-FQEVSTJZSA-N 463.443 0.953 50 20 JCGD CC(=O)NCCCC[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847562524 HLTTXLQPTKLCJP-IVAOSVALSA-N 493.004 0.893 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1 9930856 SGPRKPKUKQSUCB-CYBMUJFWSA-N 463.965 0.710 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)NC(C)C)ccc2F)n1 728723788 VTJRFGRQKNWNJT-UHFFFAOYSA-N 472.520 0.824 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1cccc(C#N)c1 728873004 SKBGPAQNFCYUKA-XGCMIMOYSA-N 490.563 0.713 50 20 JCGD CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728944432 YLGSMJXJUFMSCL-UHFFFAOYSA-N 475.575 0.910 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(N(C)S(=O)(=O)c2cccs2)cc1 729274928 HSOHRHTYZDKMDT-GFCCVEGCSA-N 490.585 0.037 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 748130029 RTLVGJJVFKRLDG-UHFFFAOYSA-N 482.540 0.019 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3c(c2)C[C@H](C)N3S(C)(=O)=O)n1 762195305 LDLDNUISDZEZMY-LBPRGKRZSA-N 466.541 0.709 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1 892837109 WVHLGOKRUOOMTQ-UHFFFAOYSA-N 471.499 0.508 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)cc1 914748181 LRTDUPVPKIWIET-GFCCVEGCSA-N 450.439 0.174 50 20 JCGD Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 914846703 RQJLQBCMWMNGMG-UHFFFAOYSA-N 458.504 0.250 50 20 JCGD CC(=NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(S(=O)(=O)NCC(=O)O)cc1 916316317 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C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)CCO2 1779298348 GFIRKVCORIEEIL-LJQANCHMSA-N 452.540 0.438 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3csc(C(F)(F)F)n3)C2)C1 1779755309 JSRUGYCWEXORBF-GOSISDBHSA-N 469.250 0.599 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1780098438 MCNRRUKKYVAZDF-QHCPKHFHSA-N 488.497 0.976 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)NC(=O)NCc1ccccc1 1780559009 SKVOFVVLLVNGSX-YCRNBWNJSA-N 496.008 0.446 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)NC=O)C1 1780723724 DRKUDPJLTAYWMM-BPSNYSSFSA-N 476.486 0.782 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)s1 1780896842 AFJKNHOBLAMIRV-JOCHJYFZSA-N 487.538 0.219 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968203 GPESJTJQPWCGMF-CYFREDJKSA-N 488.589 0.963 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781331050 JXUOJOFODDMISZ-FHSNZYRGSA-N 481.363 0.749 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)c(O)c3)C2)C1 1781697257 POWLNMBTLJIIEJ-OAQYLSRUSA-N 489.131 0.592 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1781860884 KQNCKHXFBSCTCG-GLKRBJQHSA-N 454.293 0.350 50 20 JCGD COc1cc(C)c(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1OC 1781890249 HCMYQSVLUKNQQT-DEOSSOPVSA-N 468.315 0.449 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1 1783540071 QOIDLFMLXFEBCN-WBHUJUFNSA-N 456.341 0.070 50 20 JCGD O=C(Cc1ccc(F)cc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784926551 CKKCMZXBUUKXTP-LRQRDZAKSA-N 474.725 0.995 50 20 JCGD O=C(CCc1ccc(F)nc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785232993 CKGJFLDCJRMFNG-IHPCNDPISA-N 455.295 0.127 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)C(C)(C)O 1785609900 MJTITWSWJSQPCO-JZKQVHKSSA-N 463.959 0.080 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3C(F)(F)F)C[C@@H]21)c1cccc(B(O)O)c1 1786984247 ULHIOEPWZBZYJP-ZVZYQTTQSA-N 477.248 0.687 50 20 JCGD Cc1cc(C)nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1787189650 KGEWYYPTXIFZKQ-QSFXBCCZSA-N 452.515 0.604 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(Br)cnn3C)[C@H]2C1 1787777641 FCWMOYFUFGSHIK-YDHLFZDLSA-N 485.383 0.149 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)C1=NO[C@H](c2ccccc2)C1 1788142790 ORRCNTRZIOGXTK-HMNCIZAVSA-N 477.326 0.477 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2n(n1)CCCNC2=O 1788256596 ATMCFPJAPPSYKH-XEZPLFJOSA-N 468.352 0.395 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3ON=C(c4ccccc4)O3)[C@H]2C1 1788521827 NEZNRLOWCIWPKK-ORQYLMBXSA-N 473.530 0.074 50 20 JCGD C[C@H](Cc1ccco1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610917 DYRTZTGTWREKDI-QBTDHISASA-N 455.515 0.750 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cn3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724983 VKNIIHOGIMBYQI-VCOUNFBDSA-N 496.568 0.727 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)C1 1789808337 BSGSSFJWYYSUHT-RMEBNNNOSA-N 480.389 0.998 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1791600148 QVSUPIFHMHTFAK-UHFFFAOYSA-N 452.320 0.487 50 20 JCGD CC(C)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)C(=O)OC(C)(C)C 1792598638 JVCAZBZDVWFJMD-UPHUGPLXSA-N 483.610 0.595 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C1CC1)NC(=O)NCc1ccccc1 1793017950 PRIJKIZJMDFOOL-IJVIZSLASA-N 455.559 0.888 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCOC1=O 1793162334 FRONSWSUFOTOKQ-FQLMCAECSA-N 474.942 0.160 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nc[nH]c2c1 1797409850 DDRSLPRITZWEFV-UIZNVDRRSA-N 463.498 0.900 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#Cc1ccccc1)C2)NC(=O)NCc1ccccc1 1799094757 IYGYFBWAFLZWBZ-MWZSMPGESA-N 489.576 0.974 50 20 JCGD CC(=O)Nc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)ccc1C 1799716517 ZFGKZMXTIBUEKL-OPMZPASUSA-N 459.547 0.530 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1n[nH]c2c(Cl)cccc12 1799899838 VFKWCFRUVGCFKE-ZSBFGKGUSA-N 468.706 0.413 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H](CNC(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1 1804007044 OLJRAZRMLVMFBS-ZBFHGGJFSA-N 453.201 0.981 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)n(C)c1=O 1804390785 XIJHRVXZVYJAGL-LXZKKBNFSA-N 491.911 0.069 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1 1804421188 NLYVHNAPECUKEJ-KKSFZXQISA-N 472.506 0.265 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)cco2)[C@@H]1c1cccnc1 1806130835 HDPRKFLPELXXSQ-YWZLYKJASA-N 462.466 0.667 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCSCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359538 JJQDGPRMFAVFMP-KNQAVFIVSA-N 468.388 0.130 50 20 JCGD COc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc1 1807363002 OARFWPIOUMTSIM-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CN2CCN(C)CC2)[C@@H]1c1cccnc1 1809601589 JGAAQMIGDSGQPI-XLAYELQVSA-N 494.600 0.469 50 20 JCGD CCn1nc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1C 1811019088 BCQMYUNMXUVPTR-DENIHFKCSA-N 461.331 0.920 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813089847 AJXNHANHTAETFJ-YZGWKJHDSA-N 457.361 0.195 50 20 JCGD CCOC(CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)OCC 1813205079 KWAICKJSMJAGKG-CVDCTZTESA-N 469.347 0.870 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1nn[nH]c1C(F)(F)F)CC2)c1cccc(B(O)O)c1 1815360344 GGAAMVROURKFAR-SNVBAGLBSA-N 480.237 0.499 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3ncccn3n2)[nH]n1)c1cccc(B(O)O)c1 1817476303 PJZUHMDBQXVWMU-SFHVURJKSA-N 459.275 0.752 50 20 JCGD COC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)cn1 1817536561 BYLMZMPLWINBOA-OAHLLOKOSA-N 480.311 0.544 50 20 JCGD O=C1Nc2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3ccc(B(O)O)cc3)CC4)cccc2C1=O 1819344667 ILXAHPCAALTXRC-CYBMUJFWSA-N 490.306 0.497 50 20 JCGD CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n(C)n1 1819797754 IREHGBHPKUPQJN-LBPRGKRZSA-N 468.543 0.977 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](O)N3CCOCC3)sc2C1)[C@@H](F)Br 1819891128 OJHHWXFGTNFPTN-UGQGEIBHSA-N 451.318 0.396 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc2nn[nH]c2c1 1821605434 CJDLXJGPYOHWOP-IBGZPJMESA-N 459.275 0.981 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825815625 ZMQZOAXUNQLQBT-IUODEOHRSA-N 488.375 0.962 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)Cc2cccnc2)CC1 1828926327 GFWHRFOBKJHQJZ-FCHUYYIVSA-N 479.585 0.883 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1830252031 SZNJFNVCHBEWPF-JOCHJYFZSA-N 497.644 0.698 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCC4)C2)C1 1830539075 AIVVRCLGWKTITE-AUUYWEPGSA-N 455.353 0.930 50 20 JCGD O=C(c1cc(Cl)cc2nn[nH]c12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731381 JCUOGESGEPFMGV-KBXCAEBGSA-N 458.302 0.281 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c2cc(O)ccc2n1 1830732161 VLIIMVHDCQBZAH-KNQAVFIVSA-N 463.918 0.919 50 20 JCGD O=C([C@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)CN(CCO)CCO)CC1 1831489690 GVVDRKAYMMMSHR-RDJZCZTQSA-N 452.365 0.583 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1833272058 SRIOLOLJYZWDOQ-IAGOWNOFSA-N 477.002 0.043 50 20 JCGD CC1CCN(CC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)CC1 1833407537 QNHDDNPJAGCHNL-UHFFFAOYSA-N 464.655 0.663 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1834823504 YAZFOBNNFCIHFJ-SFHVURJKSA-N 452.309 0.584 50 20 JCGD CO[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1 1834927560 BFUXRLUIYQBBBW-GGAORHGYSA-N 462.547 0.204 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1835116291 FONALNDZHOATSN-VBYICHLGSA-N 466.970 0.292 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cc3ccn(C)n3)CC2)CC1 1835118218 IBDPBGLHNAWYRX-WPWMEQJKSA-N 482.589 0.668 50 20 JCGD CC(C)N(C)CC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737415 RSDQSOZBPNOEEU-UHFFFAOYSA-N 459.595 0.211 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)CC1 1835738005 QAFHHTVRHFODNR-UHFFFAOYSA-N 494.552 0.913 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835931927 HDDIYLIFGPGHJM-RUZDIDTESA-N 466.343 0.378 50 20 JCGD COc1ccc2oc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2c1 1835936772 CJKFFNROQVVDHO-RUZDIDTESA-N 494.309 0.505 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc(C)c1O 1835941060 FGQKFNOOZQKUJV-DEOSSOPVSA-N 468.315 0.073 50 20 JCGD CCc1noc(C)c1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835959510 FOXNDYXTYGHNLG-UHFFFAOYSA-N 468.363 0.724 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1836589126 VYYHSDZMFASCTJ-SSKFGXFMSA-N 489.997 0.690 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836718376 XCGPORIBIQVZIL-KRWDZBQOSA-N 485.006 0.490 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1 1836884369 VXPWDNLPMSCQHV-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1 1837459548 JLNWATMKOQBVML-QFIPXVFZSA-N 475.452 0.347 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837632743 WIIYJWIBFTWGSR-KXBFYZLASA-N 469.336 0.650 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cn3)CCO2)C1 1837897831 HLYGUXIJWYERTM-NRFANRHFSA-N 474.905 0.117 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc(Cl)ncn3)CC2)CC1 1837921218 NMRIQGHASIMUTF-UHFFFAOYSA-N 472.738 0.736 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@@H]3F)C2)C1 1838527079 GSLYMDNUQNLOPJ-LDBYXDLTSA-N 465.434 0.948 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)ccc1C 1838986980 QDLRWPARIBQYMS-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)cn2[nH]cnc(=O)c12 1839153741 QRHRKKHCKHRICN-WOJBJXKFSA-N 486.356 0.637 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1839155273 PVXUXFIGGQGABV-MOPGFXCFSA-N 461.346 0.808 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1 1839578638 LFSDWZYEBXWDII-BLVKFPJESA-N 499.387 0.979 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1839962942 VXBCETOZZYNXTA-MGPUTAFESA-N 485.379 0.765 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccccc3)C2)C1 1840156273 MEJIBILHHOCVRG-GCJKJVERSA-N 467.950 0.517 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1 1840820370 MCLFGYIYKVOSSA-LAUBAEHRSA-N 451.907 0.647 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)C[C@H]2C1 1843012414 NBSQZCIJPJCPIB-BVZFJXPGSA-N 483.374 0.831 50 20 JCGD O=C(c1ccc(Br)nc1F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013394 DRMFWMXRABLVGJ-UHFFFAOYSA-N 462.084 0.794 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2 1843416721 SNESRFKKZBYZFH-ANDSAHIGSA-N 462.507 0.167 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)C1CC1 1844263374 XSYOJPDPECFOJD-UHFFFAOYSA-N 472.546 0.902 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C#N)(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1 1845137341 KMOGVHCHFULWQG-UHFFFAOYSA-N 496.373 0.724 50 20 JCGD CNS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)c1 747410519 UNQJZAWTYPATKA-UHFFFAOYSA-N 496.596 0.639 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1)C(=O)N1CCCC1 748246568 LWEXYXFIYUDQNN-UHFFFAOYSA-N 476.477 0.876 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cc3c(=O)n4ccccc4nc3n2C)cc1OC 917351061 RPZTYYQNUCGLHA-UHFFFAOYSA-N 479.449 0.821 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccnc(-n2cncn2)c1 919742994 QLKFZORMCWQASS-UHFFFAOYSA-N 485.526 0.077 50 20 JCGD CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 1317736741 NHKKGMRONIDCHY-UHFFFAOYSA-N 483.572 0.426 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc4cc[nH]c4cc3F)C2)C1 1780160337 NBJTWLGOFNQLLN-QHCPKHFHSA-N 451.263 0.744 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1 1780712071 JDBYAYMTXULVMF-VVWQDTPRSA-N 452.379 0.888 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781509670 LMVHJWZCIRBBRW-QXATTWAWSA-N 462.308 0.056 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc4occc4c3O)C2)C1 1782394889 NTZUETIVMDDVSG-HSZRJFAPSA-N 450.256 0.576 50 20 JCGD Cc1c(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nc2ccc(Cl)cn12 1782495591 WXRHYNJFMMXWRN-HSZRJFAPSA-N 482.733 0.733 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C[C@@H]21)[C@H](O)CCl 1784091198 LEOPNGMKAJKZPJ-SJWGOKEGSA-N 453.879 0.723 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)CCCn3ccnc3)C2)C1)NC(=O)NCc1ccccc1 1784400018 KCMNYEVZSVOJNS-RUZDIDTESA-N 497.600 0.839 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786406586 YSAQOTJLJOJPTN-YHUYYLMFSA-N 463.325 0.246 50 20 JCGD CC[C@@H](C)[C@@H](N)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786820715 KEZKWRKKZSPLKE-NSMXDQILSA-N 488.633 0.686 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c[nH]c4ccccc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786982000 WGDUGBLMMJPPQI-HYVJGQCMSA-N 461.327 0.684 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cccn2c(O)nnc12 1787387240 ALEZDOYKTJWTGO-BQUFFADESA-N 456.272 0.719 50 20 JCGD O=C(/C=C/C(=O)c1cccs1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1787512687 ZENRQOADPSUXKC-PHWOFBRTSA-N 468.340 0.460 50 20 JCGD O=C(NC1(c2ccc(NC(=O)c3nc4ncccn4n3)cc2)CCC1)c1cccc(B(O)O)c1 1788996660 SLCICGBKYYUJRU-UHFFFAOYSA-N 456.271 0.866 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(Cl)cc2nn[nH]c12 1789282314 RAANTNUVFDRZFR-IXDGSTSKSA-N 483.721 0.198 50 20 JCGD Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1[N+](=O)[O-] 1789910520 BFQHPWWPVRCSEP-VCOUNFBDSA-N 481.314 0.419 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)Nc2ccc(C3(NC(=O)[C@@H](O)CCl)CCC3)cc2)N1 1791142668 ICKMFZQXBQJICK-BBWFWOEESA-N 495.001 0.900 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(c2cccc(OC)c2)C1 1792428619 FTMIJFBAQWTQOO-NESBCBRFSA-N 479.961 0.892 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CN(C(=O)c2ccccc2OC)C1 1792815259 SHDDWVABABYNQH-YNVMFWSZSA-N 479.961 0.611 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(Cc3ccccn3)CC1)C2)[C@@H](O)CCl 1792975405 QOFJYKPBBYFVKE-HNJRGHQBSA-N 450.967 0.483 50 20 JCGD CC(C)CNC(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793880099 OWYMIGRRBZPUMA-FZKCQIBNSA-N 474.986 0.480 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCc2sccc2C1)c1ccc(B(O)O)cc1 1794160297 HWERTVZSSVNDSO-ACDBMABISA-N 453.373 0.738 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](N)c1cccc(Cl)c1 1795626219 PFMMNJFNJXWIOE-GTYSZEQSSA-N 472.933 0.242 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccccc1[N+](=O)[O-])C2)c1ccc(B(O)O)cc1 1795737159 YNPVFHOBNXPLJA-VPTLXERWSA-N 485.327 0.270 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)n(-c2cccc(=O)n2C)n1 1796363586 SVJWSGZUBONPFV-JGTCGTHISA-N 451.886 0.617 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1S)C2 1796439803 BBELMDOXGCIXIZ-LVTGYEAHSA-N 456.528 0.708 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(C)CCN(C(=O)OC(C)(C)C)C1 1797183084 VUUXQDSXFFYPNW-JJLPPOTMSA-N 495.621 0.596 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(C(F)(F)F)[nH]1 1797987014 AXXOMRLUJCPTFC-FVCICTRLSA-N 451.210 0.230 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc[nH]1)C2)NC(=O)NCc1ccccc1 1799094726 HLLBFFZZGVWAIM-IRJINJETSA-N 482.585 0.883 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(F)CCC1)C2)NC(=O)NCc1ccccc1 1799098217 BYYYGWFHWLCVAO-OPVJXMOQSA-N 461.538 0.814 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CCl)C2 1799384539 YJMOZEUUJNYAPT-OPVJXMOQSA-N 479.014 0.927 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(NC(=O)C2CC2)cc1 1799441983 FMYZOSUFZPFTQT-OPMZPASUSA-N 471.558 0.611 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Br)c(C#N)c1 1799710627 AYCQETRMMBKQNI-CWPLJXCYSA-N 492.374 0.897 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1800370934 NGJDVQQMOBXYGC-WGVRVLLMSA-N 469.517 0.906 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21 1800737711 SWACFHSUSZRENA-XGFXEOLMSA-N 471.982 0.943 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3n(C)c1=O)C2 1800757485 MADAMYAGGPJHNU-JFILPPLUSA-N 463.332 0.920 50 20 JCGD COC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)c1ccccc1 1801008794 BLRHQTBIHOKBMA-HRQSHJORSA-N 475.546 0.046 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1801315530 DOXKWLGEUDMLPX-DFYYWFRZSA-N 455.345 0.145 50 20 JCGD COc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(F)c1 1805082664 IDIUJNZUPWDSTP-VGOFRKELSA-N 478.289 0.938 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2)CC1 1805410597 MIVJJWJARMTUGL-KRWDZBQOSA-N 483.610 0.476 50 20 JCGD Nc1nc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cs1 1807233779 ZNOGFINJNLBVOI-QAPCUYQASA-N 451.317 0.434 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C[C@@H](N)c2cccnc2)[C@H]1c1cccnc1 1807267593 RZXBKVFKGQBBMP-YOSAUDMPSA-N 467.574 0.946 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1cc(=O)n2[nH]cnc2n1 1807357389 GAMFSMQWVMBPCH-GLQYFDAESA-N 478.282 0.823 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(-n3ccnc3)ccn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361637 SGMYDJFLDOPOKU-YKSBVNFPSA-N 496.336 0.976 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccnc4c3OCO4)CC2)C1 1809971058 KZAINESNGHYWDI-UHFFFAOYSA-N 451.288 0.649 50 20 JCGD CCN1CCC(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1814242045 JSZDVYZYGUMYSF-GMAHTHKFSA-N 464.375 0.813 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1 1816119388 CEVTVCNDJHHRQE-LJQANCHMSA-N 497.342 0.508 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800769 QDZFLQXEHKXIEF-JOYOIKCWSA-N 452.924 0.621 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1819834537 OPTTWMCESRVAGA-NWDGAFQWSA-N 481.542 0.658 50 20 JCGD Cc1nn[nH]c1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551810 UVEBVQQJTMYGTN-VGSWGCGISA-N 490.948 0.779 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(OC)c1C 1830738958 WEDYFYSTBTZOQD-KKSFZXQISA-N 456.923 0.682 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)CCO2 1830834733 WRUFYRQMHRKETM-XFAGBWLFSA-N 494.539 0.898 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CC1 1831874709 USEGQXXMALLHAY-XLIONFOSSA-N 483.610 0.822 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832251648 KUTRAGRJQBZUJS-HZMBPMFUSA-N 493.248 0.972 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832251651 KUTRAGRJQBZUJS-IINYFYTJSA-N 493.248 0.972 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551656 RCTHBSHEBPLVNJ-ZJTDPSCFSA-N 490.985 0.100 50 20 JCGD O=C(CN1CCc2sccc2C1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832586899 XOCVBNKMZMTKBY-OXQOHEQNSA-N 457.980 0.162 50 20 JCGD O=C(CCS(=O)(=O)c1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1835146737 ZZADHGLHQHFCBF-MJGOQNOKSA-N 462.927 0.841 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCCO4)CC2)CC1 1835569238 JXLHBJRHNJHCOD-UHFFFAOYSA-N 496.572 0.163 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc12 1835937400 UDUKOAYTTALSDJ-VWLOTQADSA-N 477.326 0.540 50 20 JCGD O=C(c1ccc(-c2cc[nH]n2)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939127 GFVRSCHQMNRJST-RUZDIDTESA-N 490.325 0.140 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835940922 DROYGBPHXMRQSR-MHECFPHRSA-N 452.316 0.240 50 20 JCGD CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCN(C(C)=O)CC3)CC2)CC1 1836397412 ZWJQTIZXCXRVID-HXUWFJFHSA-N 456.031 0.740 50 20 JCGD COc1cc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n(C)n1 1837277881 IDSIHQFZOVHLPB-UHFFFAOYSA-N 464.567 0.414 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837348816 VSIMIVDHHKGOAB-CEQIKUNHSA-N 453.923 0.306 50 20 JCGD O=C1Cc2cc(C(=O)N3CCC(OC4CCN(C(=O)c5cccc(B(O)O)c5)CC4)CC3)ccc2N1 1837920386 RKHGOEUZBSPXCJ-UHFFFAOYSA-N 491.353 0.787 50 20 JCGD Cc1nccn1CC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921619 SCAQXRXCQWRJQP-UHFFFAOYSA-N 454.336 0.184 50 20 JCGD CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1838023332 VGXNBMIJMSCEJV-AWEZNQCLSA-N 451.915 0.442 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)c1cccc(Br)c1)CCO2 1839054706 JQMRFSIDRYJKBN-GJYPPUQNSA-N 491.766 0.539 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839108446 JKPIYWMYALXATF-XLIONFOSSA-N 487.439 0.396 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc[nH]n3)CCO2)C1 1839722097 UYOCREIJOFSSSZ-JOCHJYFZSA-N 487.469 0.556 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(C)C(=O)CC3)C2)C1 1839962673 NUAGVNPRIBCEPI-ACJLOTCBSA-N 459.341 0.225 50 20 JCGD Cc1ccccc1NCC(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183799 AXPRPUOBSAXGOE-QHCPKHFHSA-N 461.563 0.236 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(N(C)C)cc3)C2)C1 1840184663 AGFPMDKZNQZOSY-RUZDIDTESA-N 489.617 0.515 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C2)C1 1840187244 OWBFYIIMHZXSQM-XMMPIXPASA-N 484.557 0.520 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840187598 MLZHDNNVPJKEJK-XOBRGWDASA-N 496.388 0.882 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2n[nH]c3c2CN(C(=O)OC(C)(C)C)C3)C1 1842314819 UPSHPGXSVJFBKJ-UHFFFAOYSA-N 489.577 0.850 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)C1=NN(C)C(=O)CC1)C2 1844691884 KGAXEWHMZLDTHQ-UHFFFAOYSA-N 457.443 0.945 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)nn1C 1845039078 APLQPNZGMICQQB-UHFFFAOYSA-N 469.546 0.592 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 10733875 JINOJCCOAPNNIF-UHFFFAOYSA-N 461.496 0.634 50 20 JCGD CCOc1ccc(C(=O)NCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OCC 17193196 PSCIBKZUXCAMAX-UHFFFAOYSA-N 467.482 0.922 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 18995210 DLYBYLRWRSMLKS-UHFFFAOYSA-N 465.513 0.077 50 20 JCGD COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)c1c(C)nc2ccccn12 21200052 PFQGUDXYDXSKGK-MRXNPFEDSA-N 487.538 0.646 50 20 JCGD CCc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1 725871714 FQIOIBKOBPSONJ-UHFFFAOYSA-N 456.503 0.569 50 20 JCGD COc1c(F)cc(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1S(N)(=O)=O 728210147 VJTTUXBYTOIHDD-UHFFFAOYSA-N 472.520 0.608 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3CCN(c4ccc5nncn5n4)CC3)cc2)CC1 728215413 ZRGYRPYBFYPQFE-UHFFFAOYSA-N 499.601 0.420 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 729274852 FWIZBGHCXWDRSK-NOZJJQNGSA-N 451.332 0.683 50 20 JCGD CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 729276611 ISKRHHYMZKUDIJ-MFKMUULPSA-N 495.421 0.386 50 20 JCGD O=C(CCN1CCCS1(=O)=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 729298300 ALUQGPWYHXZXBL-UHFFFAOYSA-N 469.523 0.631 50 20 JCGD Cc1ncsc1C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C\c1ccccc1 729453510 DVOZRXRFBFLLFQ-QIENPNARSA-N 486.597 0.606 50 20 JCGD CN(C)c1ccc(NC(=S)NNC(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)cc1 729690710 HHCJSEYLRJBHOP-AWEZNQCLSA-N 452.562 0.236 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(N)(=O)=O)c(C)c2)cc1OC 730890481 WTPGJVJEILQHGA-UHFFFAOYSA-N 451.457 0.278 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NCCS(=O)(=O)NC(C)C)c2ccccc2c1=O 746972633 LRAFHVHDKPBRMX-UHFFFAOYSA-N 452.537 0.468 50 20 JCGD CN1CCC(N2CCC(NC(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cn3)CC2)CC1 747990698 VSFCNHKUTXMJHU-UHFFFAOYSA-N 494.666 0.202 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1 748246457 LEESXNBBYMFBCB-HUUCEWRRSA-N 466.560 0.745 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1OC 914992220 HWWCAQBYIFZTDG-UHFFFAOYSA-N 481.483 0.699 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 915884171 UWSOJDYXSSMZCP-UHFFFAOYSA-N 472.527 0.812 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1noc2c1CCCC2 917933171 AWYDEMUBVMYPGS-UHFFFAOYSA-N 462.528 0.968 50 20 JCGD O=C(NNC(=O)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1)N[C@H]1CCS(=O)(=O)C1 920292333 FLDAFQNKQVYZMM-HNNXBMFYSA-N 456.484 0.946 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2c1 1778509558 MIBAFLRVVDHRIQ-HSZRJFAPSA-N 457.531 0.993 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCN(C(C)=O)CC2)C1 1778911094 ZEYUHTQMQJFIDL-WAOWUJCRSA-N 487.439 0.838 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029680 WTAONKLJNXAWDB-GAJHUEQPSA-N 488.545 0.138 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032762 UJAXOVOBVSSIBK-DEOSSOPVSA-N 489.573 0.887 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779035463 HWFNSCOGOBIKEN-UZUQRXQVSA-N 490.561 0.432 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccnc(Br)c3)C2)C1 1779400522 VHWGXPKGKLTTMW-HXUWFJFHSA-N 474.120 0.281 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1781229998 MDLJTXOPSSRIPO-FASAQXTFSA-N 458.346 0.661 50 20 JCGD CN1CCCn2nc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)cc2C1 1781335327 XOOQQCLLHZHLSQ-YJBOKZPZSA-N 458.332 0.853 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2 1782170880 DOOOURHMVZLCAM-XAUMDUMWSA-N 473.979 0.866 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1782842708 CEACQFSTTRDEFJ-MNRXQERYSA-N 450.845 0.573 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)[C@H]2C1 1783506592 XQFDAPBFKMFMPV-XBJPRQPRSA-N 487.981 0.298 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783932859 HPLQFGSMXMJKEK-OPAMFIHVSA-N 469.583 0.350 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1 1784250837 NAQPIHGSDGRYLI-CTNGQTDRSA-N 452.939 0.576 50 20 JCGD CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C[C@@H]21 1784617328 FBLRPZIJZHWATI-FDPKGLCPSA-N 451.955 0.982 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3csnn3)[C@H]2C1)NC(=O)NCc1ccccc1 1784673973 GAAJIYONJBYHAQ-LNLFQRSKSA-N 487.586 0.478 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1785446006 TZKSBAVEQXXYTI-UYVYXKLWSA-N 460.535 0.255 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1785701080 KJEZMKJODBJXPH-WNMGUVTHSA-N 460.339 0.932 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786984646 XWBGSOQGKKMAIC-NYVOZVTQSA-N 452.316 0.211 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nccnc4c3)[C@H]2C1 1788031042 UNASLHNCNLTHSC-ZWOKBUDYSA-N 454.531 0.596 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc(O)n1 1788610361 NOEWZWBZUAVEDB-KKXDTOCCSA-N 454.487 0.001 50 20 JCGD CCSc1cccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789422388 MARUSLBGWYEFHY-WDSOQIARSA-N 469.372 0.781 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cccc([N+](=O)[O-])c3=O)[C@H]2C1 1790652574 RWBJOIPZYZYVOQ-YXWQFLTLSA-N 485.335 0.767 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1792887006 MRBDXKATQQBXFA-NZEXEKPDSA-N 468.320 0.152 50 20 JCGD N#Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc(C(F)(F)F)c1 1795736300 XDUGAAGBUHAMBC-XEMDLRDOSA-N 487.243 0.774 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)C1 1796189094 VSOAYYXHVHXVJP-REPLKXPHSA-N 471.363 0.875 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)N(C)C(C)=O 1796454724 SGHRTRLWCMNSHP-NZNSQFJMSA-N 476.486 0.590 50 20 JCGD COC1(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)CCC1 1799099499 YVJROYIIGUMMHU-JHDGKUDLSA-N 487.601 0.881 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn3nc(N4CCOCC4)ccc13)C2 1799270321 XJZKXJPMZDUKCI-RCJHGTSTSA-N 476.965 0.787 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2C=CS[C@H]21)NC(=O)NCc1ccccc1 1800253352 UQYWNTZZWIKFJY-RSBIIAMVSA-N 485.610 0.797 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1O 1800827408 XRXFAOIDHVMPPD-REPLKXPHSA-N 451.288 0.596 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1802003843 PJILVEMLBZXYSM-VQCDVEGESA-N 471.982 0.983 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C2 1802087054 GZSHERNROAWSIR-XFIYOXNOSA-N 491.969 0.286 50 20 JCGD CC(=O)NCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1803716625 GZLMRPWJOJMRLM-FPOVZHCZSA-N 466.347 0.243 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cc2cncnc2)[C@@H]1c1cccnc1 1804647827 SXHJFHGUAFARQE-UTKZUKDTSA-N 460.498 0.432 50 20 JCGD Cn1cc(F)cc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807364967 UXTHXDUDWAWWSV-LAUBAEHRSA-N 450.279 0.872 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995495 ZLDFMSMIWNRKMM-HRAATJIYSA-N 462.271 0.201 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1 1808323592 NMPOFVIYTZDJDG-CAOCKLPOSA-N 484.365 0.796 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)nc1 1809974963 KREZSRSWARCQMN-UHFFFAOYSA-N 485.371 0.324 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809975201 XHWCEMWTRYGGHL-UHFFFAOYSA-N 455.280 0.016 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810305679 OVTKWVWGIIGNOH-UWJYYQICSA-N 480.525 0.909 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1812863484 HPIOMPRZUXHUPU-JVLSTEMRSA-N 475.307 0.311 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813073476 JAZZIQGQCHAXJE-DXIQSLLYSA-N 460.579 0.765 50 20 JCGD COc1ncccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815355604 WZVWOTJXXHFZNM-CQSZACIVSA-N 452.301 0.766 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)N1 1817133444 GKXKTOPNNDQVOJ-JMLLCIOISA-N 489.982 0.770 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n1 1817471374 XDQCZVPJRHCSRS-IBGZPJMESA-N 450.308 0.909 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)n1 1817856944 MIXSWUYKWXOAIV-CYBMUJFWSA-N 497.298 0.674 50 20 JCGD Cc1cc(C(=O)NCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)no1 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Cc1nn(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1F 1830535362 NDHOKTOFTYJMLV-KPZWWZAWSA-N 461.332 0.969 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)C1 1830716106 UDVPNAUHYPJOBR-FVJLSDCUSA-N 456.612 0.884 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726005 NELWJJOGEQDZAJ-IPJJNNNSSA-N 452.935 0.747 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)cc1 1830727060 ZXBJXYUCMBSTFP-VWNVYAMZSA-N 452.935 0.855 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)COc2ccc(O)nn2)CC1 1831874224 DPPNXKCUHIQHCG-QGZVFWFLSA-N 462.551 0.554 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549389 KRMBTPAAAZXIFV-PNLZDCPESA-N 487.981 0.613 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncnc3)C2)C1 1832549414 NGNCYFUYWZHUID-HRAATJIYSA-N 483.953 0.679 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nccc4[nH]ccc34)CC2)CC1)c1ccc(B(O)O)cc1 1834797949 OHTOPPDPDPAGMS-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1834798412 SESKIVAZUMERPY-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD O=C(NCC(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)c1cccnc1 1834819481 OZMRVMVELONVRH-IBGZPJMESA-N 469.336 0.053 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3Cl)CCO2)C1 1835012315 LAIHMXWEYUOSOL-QHCPKHFHSA-N 487.944 0.651 50 20 JCGD Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c2c1CCC2 1835395755 FOXJDPXPFHOEFZ-UHFFFAOYSA-N 479.390 0.088 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](N)c1ccccn1)CCO2 1835695563 MRSBBEJZARKCLE-ALKREAHSSA-N 455.353 0.569 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnnc(Cl)c3)CC2)CC1 1835736934 BBMXKQWCRIRGDX-UHFFFAOYSA-N 486.964 0.628 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)N3CCOCC3)CC2)CC1 1835765791 AAQKQBZPHNVYQS-ICSRJNTNSA-N 465.422 0.445 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CN)c1ccccc1)CCO2 1835822687 JNJZSYREOBUDNW-VPWXQRGCSA-N 454.365 0.969 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CC3)C2)C1 1835934416 ZFHFGPVLAXRULV-XMMPIXPASA-N 464.327 0.168 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)N3CCN(C)CC3)CC2)CC1 1836372909 LWYCSZVNUXAZST-IAGOWNOFSA-N 472.472 0.977 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CS[C@@H]3CCCCO3)C2)C1 1837458752 AGESPRSKUWQKPW-KNQAVFIVSA-N 493.586 0.015 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922133 PODAWDYFWOLJLB-GOSISDBHSA-N 468.363 0.511 50 20 JCGD O=C(c1ccnc2c1OCO2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1838478693 XDKBXXHLMPRFQX-SUMWQHHRSA-N 460.256 0.571 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)c(F)c3)CCO2)C1 1839009786 QVXLPJPEJNYIJC-QFIPXVFZSA-N 475.452 0.347 50 20 JCGD N#Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1F 1839187102 KDSMVCWFCWMBPH-XMMPIXPASA-N 496.499 0.009 50 20 JCGD CN1CCCn2nc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cc2C1 1839202588 KLUSZAOOTIVIQU-VQIMIIECSA-N 488.358 0.479 50 20 JCGD COc1cc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(F)c1 1839333224 WHEHZDSWNXBTOZ-QHCPKHFHSA-N 490.268 0.037 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccc(C)c34)CCO2)C1 1839612827 VLMGNYBTHQXHJY-DYESRHJHSA-N 450.923 0.967 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839649612 ZIGMKUMGIPLYJC-AUUYWEPGSA-N 471.352 0.602 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1840152857 WXNCMUROVQSRQO-BTYIYWSLSA-N 466.922 0.379 50 20 JCGD Cc1ccc(C(=O)C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840184738 CPYVGFOXIOFWPJ-QHCPKHFHSA-N 460.531 0.007 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1 1844265627 YAGCPSJUPHGYDK-UHFFFAOYSA-N 450.499 0.518 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1)C1CC1 1847619796 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QSUJDTYCJLOOAB-UHFFFAOYSA-N 453.496 0.495 50 20 JCGD O=C(COc1ccccc1-c1ccccc1)NNC(=O)NCCS(=O)(=O)N1CCOCC1 748111182 HWUQKPPVJDRODH-UHFFFAOYSA-N 462.528 0.725 50 20 JCGD COc1cc(C)c(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1OC 914564460 HBAQGYAHRPGBRY-UHFFFAOYSA-N 471.557 0.951 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1 915802994 ZQNNFIILQMPPND-UHFFFAOYSA-N 474.543 0.175 50 20 JCGD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1 916048632 JZSYBAYVTCGREJ-UHFFFAOYSA-N 450.864 0.803 50 20 JCGD Cc1ccc([C@@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)N2CCOCC2)o1 916229488 QJEZYKFKTVOWHG-QGZVFWFLSA-N 454.487 0.852 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2ccc(Cl)nc2)c1 917251125 RSWMRJJWNVGWOQ-UHFFFAOYSA-N 467.935 0.957 50 20 JCGD O=C(NNS(=O)(=O)c1ccc2[nH]c(=O)c(=O)[nH]c2c1)c1ccc(F)cc1Br 917754585 AWGMTGVTZBVTOL-UHFFFAOYSA-N 457.237 0.741 50 20 JCGD CN(C)S(=O)(=O)c1ccc(NCCO)c(C(=O)OCC(=O)NNC(=O)c2cccs2)c1 918058820 WKVDGXLQBYIYJN-UHFFFAOYSA-N 470.529 0.021 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc(F)cc3Br)cc2)CCN1 918342002 ODFHBWJJOIGBQV-UHFFFAOYSA-N 499.318 0.784 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2cccs2)c1)N[C@H]1CCS(=O)(=O)C1 919886330 VOSKRMWNTXKZSC-ZDUSSCGKSA-N 472.570 0.358 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1 1779032537 RUTODLJLUXMCSQ-QFIPXVFZSA-N 467.461 0.229 50 20 JCGD CSc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032689 RSGZSCGDNVAGCX-OAQYLSRUSA-N 456.528 0.559 50 20 JCGD CO[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559652 ZEXREAWZQHQJIC-MFSJNOQSSA-N 475.590 0.881 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1 1781016188 ZBKZKJHNEBQMNF-OPAMFIHVSA-N 467.567 0.199 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1c(F)ccc(O)c1F 1781090871 FNLXMEVCYXHXBT-WZONZLPQSA-N 474.269 0.792 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1781382967 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CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792980137 MIEWZQDAFKRMSC-OJXGSEEGSA-N 480.370 0.514 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccn1 1794640916 YQEKCLNUGZQNOD-FQLMCAECSA-N 453.927 0.812 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cn1)C2)c1cccc(B(O)O)c1 1795740359 XCLQYAUPGHXMOJ-ZSBFGKGUSA-N 474.120 0.041 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 1795895175 QDXRSFBHGAJHTK-NEXGVSGLSA-N 475.970 0.200 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)C2 1797753614 AVMZKODPNMPJOV-VTEUUUEMSA-N 486.460 0.178 50 20 JCGD CNC(=S)NCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1797759778 JGSXDEHKXFTKLK-AOWDBCOTSA-N 477.537 0.945 50 20 JCGD CSCC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798523091 RKWLDWNDZPOHDZ-QOIYZWAUSA-N 481.527 0.837 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)n(C(F)F)n1 1798675863 DQGLYZYOCNTHRI-SUGIQXKYSA-N 477.472 0.924 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1)n1cccn1 1799098176 AAEQAQXEHDBDMI-RPUPUWCGSA-N 483.573 0.380 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c[nH]c2ccccc12 1799123408 FSUYCYVORWRHSM-MFKICJERSA-N 462.510 0.612 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCS1(=O)=O 1800392606 GWPWYQFCGGZMMM-GTYSZEQSSA-N 495.510 0.301 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1 1801049814 GORCELYLMYKGEE-RHUWPCCZSA-N 490.395 0.731 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(F)c(F)c(Cl)c1 1801829558 HRPBFHMJAGJVAI-HBCWATKFSA-N 464.661 0.815 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCCn2ccnc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368514 UKSRNWGPAYNVLY-REWPJTCUSA-N 461.331 0.758 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2ccc(F)cn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370362 BWKHNTJKPKDFDO-JPYJTQIMSA-N 462.290 0.858 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2[nH]nnc2C)[C@H]1c1cccnc1 1808417550 LUNPTNGMCLGKTM-TYNUBOESSA-N 463.502 0.962 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810249658 NQLHYSUOXOIUHF-FFZOFVMBSA-N 466.542 0.973 50 20 JCGD N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303791 VSMNVKGRGOIOLR-RDTXWAMCSA-N 470.559 0.416 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810571033 CYAKGWYZJCUZIA-KPDCDPCYSA-N 473.342 0.977 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1811065760 BAXVBVKXDYRAJY-AUSIDOKSSA-N 473.342 0.856 50 20 JCGD COCCn1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815354754 RIQJOYORBYUHOK-OAHLLOKOSA-N 469.332 0.205 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)cco2)n[nH]1 1816649691 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(=O)oc3)C2)C1 1832549533 TYMRSSACSJNAPW-KSFYIVLOSA-N 499.948 0.842 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833025605 DQOBRKQMGBEVSI-RNODOKPDSA-N 499.362 0.234 50 20 JCGD O=C(CSc1ccccc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835089168 XHZLTXWVIICQEQ-HSZRJFAPSA-N 470.356 0.229 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737492 XQALRLKOVHEVLQ-MRXNPFEDSA-N 482.589 0.636 50 20 JCGD COc1nc(C)ccc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738213 ZVOJBUHOGZPMTR-UHFFFAOYSA-N 495.584 0.896 50 20 JCGD O=C(c1ccc2scnc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930785 ZMRSXXFAGHDDDD-QHCPKHFHSA-N 481.339 0.360 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938183 OXJJDLBQTSCOQF-DEOSSOPVSA-N 486.450 0.488 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3c(F)ccc(Cl)c3F)C2)C1 1835941161 JFKAZQFAHIRBMB-QFIPXVFZSA-N 494.687 0.682 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cccnc34)C2)C1 1837459221 MWBJKGDPNOUGBY-VWLOTQADSA-N 490.520 0.617 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1 1838077205 QOVFWSODSFNVTL-MZJWZYIUSA-N 499.528 0.634 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1 1839351788 QLBZCMRPRUJFEY-ORAYPTAESA-N 454.321 0.639 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1839444947 QLVDHESYFCPDCS-DEOSSOPVSA-N 490.557 0.306 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ccncc13)CCO2 1839508070 LJFSTDIDSWTFRT-VWLOTQADSA-N 490.520 0.617 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)no1 1840032543 BWEYXJRDDYHOLK-ACJLOTCBSA-N 473.324 0.551 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1 1840035703 AWWVVMWLWXXUPS-IIBYNOLFSA-N 482.375 0.965 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncn(-c4ccccc4)n3)C2)C1 1840152927 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748107758 MRYJTSIEOAQQKU-UHFFFAOYSA-N 460.456 0.268 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)[C@@H](C)O)cc1C 777289186 CGOGOSACUKTXIF-AUUYWEPGSA-N 497.957 0.989 50 20 JCGD CNS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1 787974442 CDDVXCCDVILFAP-UHFFFAOYSA-N 469.447 0.369 50 20 JCGD CC(C)(C)C(=O)NCCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 874436275 YIPWGWRXUKLORI-UHFFFAOYSA-N 468.576 0.340 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 915880605 MWTJCKJYUQYKPN-CQSZACIVSA-N 482.540 0.627 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)NCC(C)C)c(=O)n2Cc1ccccc1 915883787 LNIRELIIWOXAJV-UHFFFAOYSA-N 471.518 0.041 50 20 JCGD COc1cc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc(OC)c1OC 915931040 DHUPVBPAFMANJI-UHFFFAOYSA-N 494.574 0.870 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(C)oc(C)c2S(N)(=O)=O)c1 916096598 YIEIVCVJYCCYOQ-UHFFFAOYSA-N 472.545 0.649 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC3CCN(C(=O)c4ccoc4)CC3)nc2)CC1 916259684 DRNYJZJIWDUKOM-UHFFFAOYSA-N 491.574 0.542 50 20 JCGD COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC(=O)N[C@H]2CCS(=O)(=O)C2)c1C 916418696 JXTQKIPBZFLFOT-NDCSFFLDSA-N 466.516 0.214 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cccc(OC)c2O)o1 919755815 IUPRKSMOZSJKIB-ZDUSSCGKSA-N 481.483 0.785 50 20 JCGD Cc1cc(C)nc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2N2CCOCC2)n1 920441083 FETOJOJZNPRHNE-UHFFFAOYSA-N 476.559 0.708 50 20 JCGD Cc1ccc2cc(C(=O)N3CC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)ccc2n1 1777907055 WNFCCEDEVRLWQT-VWLOTQADSA-N 459.311 0.980 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CS(=O)(=O)N2CCCC2)C1 1778088331 MBANJBFRHUUQIZ-FRQCXROJSA-N 494.452 0.957 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1778407560 FUKAUZFQIGCHEY-QHCPKHFHSA-N 451.263 0.744 50 20 JCGD Cc1nc2ccccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1778483789 UWCCFBIUPHUEKG-CJFMBICVSA-N 476.342 0.764 50 20 JCGD Cc1ccn2c(=O)c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C4)cnc2c1 1778690603 SYOFKVBRNCVQOS-KBMIEXCESA-N 498.584 0.503 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1778780269 IWTQFGJNWCMLFC-LRDNONRASA-N 492.957 0.013 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnccn1)C2 1779375746 SNFDVROSXLWGCA-ROQWUKPNSA-N 465.514 0.316 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1779954183 RYLCHADZIRYWCV-MLGOLLRUSA-N 459.297 0.890 50 20 JCGD O=C1Nc2ccccc2Cn2nc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc21 1779985510 MHOBWLJVBYFBFP-PGRDOPGGSA-N 473.917 0.540 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CNC(=O)O1)C2 1780054680 ZSPZMCJDVFPHNE-NJNPRVFISA-N 490.469 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)C1 1780608468 APFKBKHXPHTHTN-WVWCEFAQSA-N 498.584 0.214 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)no1 1780968575 BSNVSORCSWIEED-QHCPKHFHSA-N 470.530 0.773 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc[nH]1)CCO2)NC(=O)NCc1ccccc1 1780969825 KFNAGPGYIAFHDS-JOCHJYFZSA-N 455.519 0.199 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1F 1781413473 WUQKGVWZQAURTK-JWQCQUIFSA-N 497.332 0.001 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(N3CCN(C)CC3)CC1)C2 1782179337 QAONCSCFAGBFRS-WAOWUJCRSA-N 457.015 0.534 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4ccnn34)C2)C1 1782224431 CRBQPOHUNXSVMF-LRULAXNGSA-N 463.498 0.912 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C(=O)OC(C)(C)C)C3CC3)[C@H]2C1 1783688992 HBRWLCHACIEUTF-WDSOQIARSA-N 495.621 0.739 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)CCO2 1783934881 JIGSHUBQKROZOR-NRFANRHFSA-N 477.474 0.140 50 20 JCGD CCOC(=O)/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1786374621 LWHMEAWXOCLNOD-HGOORQKGSA-N 459.503 0.219 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21 1787508458 JVTKYSTXGBSNLE-VYOPWZLOSA-N 463.611 0.952 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C(C)(C)C)nn3)C[C@@H]21 1787508685 NZOFMEWYZOWFSL-GDJYOZILSA-N 484.561 0.760 50 20 JCGD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(C)n1 1789108477 NIOWSQWBJJSHAY-YSSFQJQWSA-N 452.515 0.604 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789923527 SAQNWYNIZKGVCJ-RGHULWKBSA-N 496.374 0.932 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H](O)CN3)C[C@@H]21)[C@H](Br)Cc1ccccc1 1790779081 CGJDNQOCYIMHDZ-OROIIQQLSA-N 480.403 0.695 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)C1 1791240960 HUTDXGGVTXPZDT-MHZKCTCGSA-N 487.557 0.258 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(=O)Nc2ccccc2)CC1 1793403918 GZQPYHJCGWXTRM-UPHUGPLXSA-N 471.558 0.368 50 20 JCGD CN(C)C(=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1795465088 PGYCMXMUQNRTSC-YYIAUSFCSA-N 452.349 0.670 50 20 JCGD Cc1nc(-c2ccccn2)sc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1796500384 DFAANDPIJRFBCZ-XEMDLRDOSA-N 492.366 0.710 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)cn1C 1796640828 IVBLIAMZQMGJIQ-IUTQVRIDSA-N 482.585 0.883 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1)c1ccc(B(O)O)cc1 1796931771 KIAFXQTYKAMBBV-FNLKRUPLSA-N 460.299 0.411 50 20 JCGD CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(S(C)(=O)=O)CC1 1797137167 WAVGEBKQFUARQM-MUJYYYPQSA-N 450.001 0.513 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc(C(F)(F)F)n1 1798513868 NYAGRUXRIHPUBA-CCWDJLKJSA-N 493.247 0.306 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)N(C)C(C)=O)C2 1798522370 RLISHBJBQMKGEK-NZNSQFJMSA-N 476.486 0.590 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-c2cnccn2)c1 1798588947 QWWMHCNNMJMRFA-OPMZPASUSA-N 487.520 0.659 50 20 JCGD CCN(CC)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1 1800302377 YUKNNFWBKMJXIB-CBJLPSGESA-N 479.386 0.653 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc([N+](=O)[O-])cc1F 1800402945 LAKRSWILQYWIHA-USGNIVHTSA-N 465.482 0.239 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)NC(=O)OC(C)(C)C 1800595834 YIJFQSPKAXFMLV-RZVIYGBDSA-N 476.534 0.602 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801014020 ANEOWOUSZAHWIR-CLWJZODNSA-N 483.610 0.642 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[C@@H]1c1cccnc1)[C@H](O)CCl 1803139224 VKNPDTHDEFSWSE-XGWLTEMNSA-N 467.935 0.152 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cn2cccc([N+](=O)[O-])c2=O)[C@H]1c1cccnc1)[C@H](O)CCl 1803148556 TUGBWFKJJYISBY-LESCRADOSA-N 463.878 0.457 50 20 JCGD COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1F 1804959690 ITHHBWCNUXEPKW-UWJYYQICSA-N 478.289 0.938 50 20 JCGD Cc1[nH]nc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1F 1805119710 WFKMSMMRIZTEDG-OXJNMPFZSA-N 451.267 0.565 50 20 JCGD CN(C)c1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1 1805343728 LVYYNUKPWLHGTG-PXNSSMCTSA-N 463.303 0.449 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807155308 LQDSIRFFYKNTBW-NYDSKATKSA-N 473.342 0.977 50 20 JCGD CCc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1C 1807360239 IKDUXWWFFBHDMK-PGRDOPGGSA-N 461.331 0.691 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(C)(C)C 1807364058 HKHDFMILXMUATK-KSEOMHKRSA-N 480.374 0.632 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807368792 ZJVXCULYABWSBB-RXVVDRJESA-N 482.346 0.606 50 20 JCGD CN(C)c1cncc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1 1807369317 FZGLMWDIQUGLCY-XXBNENTESA-N 473.342 0.856 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807374550 HSWGOURDCIBXNP-NYDSKATKSA-N 473.342 0.977 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)COCCO)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807454607 VDCOMPCLBLVNGI-XUZZJYLKSA-N 498.584 0.443 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)no1 1810304290 BYCUMXPJTKHOIW-IERDGZPVSA-N 463.498 0.939 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccnc(Cl)n1 1810765937 IORCJNIRXDNIPH-VQIMIIECSA-N 465.706 0.838 50 20 JCGD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1 1811208718 COZKHXJEPRWVFF-IIBYNOLFSA-N 455.519 0.573 50 20 JCGD O=C1Cc2cccc(C(=O)NC[C@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)c2N1 1812208726 MCYHEEVBKXWKGI-NTKDMRAZSA-N 484.321 0.889 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1813093918 KTPZVYQMHJJWBX-AYOQOUSVSA-N 472.571 0.514 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1 1813188504 XBJCPFTZVJUEBI-FLTJSSMESA-N 466.542 0.951 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2 1819798027 QLFWPMRPFNOZNX-MRVPVSSYSA-N 471.459 0.313 50 20 JCGD C[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2 1825626331 NPEXBAMQMHQZTD-DZGCQCFKSA-N 460.560 0.782 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C#CC(=O)O)C2)C1 1829339742 ASEDRMJYPHZDKW-JPYJTQIMSA-N 491.928 0.780 50 20 JCGD O=C(COc1cccc(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830278580 GNXXVTKWUUPALG-QHCPKHFHSA-N 488.733 0.169 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1830540870 UWWHBHJTBAGUBN-KUHUBIRLSA-N 469.336 0.508 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)C1 1830713584 DSTVHMSINIUAGB-MOROJQBDSA-N 465.316 0.723 50 20 JCGD O=C(c1cccc(N2CCOCC2)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732944 COGAHVCPPOQYQJ-SIKLNZKXSA-N 467.950 0.193 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737051 CRFPTDLCKCVPGY-YVHKJVDXSA-N 489.997 0.832 50 20 JCGD COC(OC)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1831039279 GOXPOQRTBOJUFP-KYIYGJGQSA-N 465.453 0.947 50 20 JCGD O=C(CCc1nc(-c2ccc(F)cc2)no1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832899200 QBOMZMRBMGLSML-VGSWGCGISA-N 496.923 0.864 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C)cn3)CCO2)C1 1834447391 JIIMTCBYVHOKLS-JOCHJYFZSA-N 487.469 0.637 50 20 JCGD CCn1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834797881 HGPWDPGYVWWVQM-UHFFFAOYSA-N 453.352 0.082 50 20 JCGD CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n[nH]1 1834797916 LSOXNUFOGBDNMW-UHFFFAOYSA-N 453.352 0.151 50 20 JCGD C=CCOCCCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798084 RVXIGBUVCBNDSC-UHFFFAOYSA-N 457.380 0.534 50 20 JCGD Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cs1 1834800015 PEQZGJXMNWNBQN-UHFFFAOYSA-N 470.404 0.559 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2 1834825242 URRRZBNJZIZALG-GOSISDBHSA-N 457.325 0.356 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)CCO2 1835351194 OTTRHHXQJXXIQF-QFIPXVFZSA-N 498.674 0.941 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C#Cc3ccccc3)CC2)CC1 1835736790 HSIDEFAJZKSAKV-UHFFFAOYSA-N 474.565 0.922 50 20 JCGD Cc1ccc2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)sc2c1 1835935361 PIWZNGCLFACOTO-XMMPIXPASA-N 495.366 0.668 50 20 JCGD O=C(COC(=O)C(F)(F)F)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921172 IXUBCHZMGBEZQB-UHFFFAOYSA-N 486.252 0.084 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCc3cncnc3)CC2)CC1 1837947254 BHZFUTAYEIGVIE-UHFFFAOYSA-N 460.579 0.781 50 20 JCGD COc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838295014 VTUFJTMXFLGLQE-OAQYLSRUSA-N 475.527 0.139 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1 1838357723 JWWOXZRFJJTMRI-IUODEOHRSA-N 464.357 0.833 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838427975 IVAQAXGRQFBFDZ-INIZCTEOSA-N 451.568 0.049 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2)C1 1839141943 YOVKIAVPTGOLHH-QYWGDWMGSA-N 477.986 0.736 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1 1839145540 LEPMLYLSTVOKMY-IIBYNOLFSA-N 454.955 0.761 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1840031203 ISEHXCTXOBCCBH-SCLBCKFNSA-N 474.377 0.718 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](NC(C)=O)c3ccc(F)cc3)C2)C1 1840154278 RHCKMJDFMSMLAN-NNMXDRDESA-N 485.940 0.713 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)OC(=O)NC(C)C)C2)C1 1840154319 SHSRGITYZFMNTC-QRWLVFNGSA-N 463.959 0.610 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H](NC(=O)OC(C)(C)C)C3)C2)C1 1840155894 FZYGOUOIYDRASM-WBYLCXCBSA-N 489.997 1.000 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COCc3ccc(OC)cc3)C2)C1 1840156216 OVMRUZKGDCURMN-SIKLNZKXSA-N 470.950 0.922 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(Cl)s3)C2)C1 1840184861 BMZBDIUCZMWNPQ-SFHVURJKSA-N 459.956 0.240 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1 1840185751 WRVUUFBIHUEBSM-NRFANRHFSA-N 481.481 0.177 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cc(F)ccc1[N+](=O)[O-])CCO2 1840887700 AEDMUIMCAWRWIS-JOCHJYFZSA-N 495.508 0.106 50 20 JCGD NC[C@H](N)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCCCCCCBr)CCO2)C1 1840937041 RRJBTFMOTWYSOB-FXAWDEMLSA-N 477.444 0.854 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)O2)C1 1841080053 QQGDZEJJZCWKMT-IBGZPJMESA-N 499.373 0.352 50 20 JCGD CCc1nn(C)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1Br 1843149097 QYCHAGSNVRLCCT-UHFFFAOYSA-N 490.362 0.874 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265325 RGMKYMOBZJSSEF-INIZCTEOSA-N 486.529 0.428 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846189024 AKILFLCNNPNENQ-MZNJEOGPSA-N 469.347 0.583 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)CC2)cn1C 109593869 VDWUWNKVFBJXBV-CYBMUJFWSA-N 467.523 0.883 50 20 JCGD COc1nc(C)cc(C)c1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 727605857 ZAEUVTWASPQOSK-UHFFFAOYSA-N 477.543 0.872 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1 728177923 NPYZQFKPBQWRER-KRWDZBQOSA-N 459.590 0.782 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)c1 728528832 OUVQXCDBJNDTSP-UHFFFAOYSA-N 455.290 0.716 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 748697078 IVBAJPHOLLOVEQ-UHFFFAOYSA-N 463.472 0.392 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccccc1 821979184 OENZFVDWSKXBNI-WTQUMQLASA-N 465.553 0.841 50 20 JCGD Cc1nnnn1/C(=C\c1ccccc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 849196533 PFQISGANDMJXHQ-JVCXIRSZSA-N 464.438 0.510 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c2ccccc2c1=O 891625032 KCNKKWKABBPRDA-IRXDYDNUSA-N 469.498 0.677 50 20 JCGD C=CCNC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1 913435792 UCYVWTGQOHTBNW-UHFFFAOYSA-N 454.574 0.930 50 20 JCGD COc1ccc(C(=O)NCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1OC 915789201 XXRDGMSMHWOPMA-UHFFFAOYSA-N 470.891 0.196 50 20 JCGD O=C(NCCNC(=O)c1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916260096 VTBGGZZZRPRNFM-UHFFFAOYSA-N 475.527 0.082 50 20 JCGD CN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 917718310 RMWNCKKIZITXNY-UHFFFAOYSA-N 480.568 0.796 50 20 JCGD CCN(CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(CC)CC)c1)S(C)(=O)=O 918119540 XPIMJBKQAOSTRU-UHFFFAOYSA-N 477.609 0.333 50 20 JCGD O=C(NNC(=O)c1nc2ncc(Br)cn2n1)c1csc(N2CCOCC2)n1 919810031 RBKUHSYMNQQFAE-UHFFFAOYSA-N 453.282 0.255 50 20 JCGD CCCCn1c(CCC(=O)NNC(=O)NC)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 919877923 MMWIVVAVFJAAFI-UHFFFAOYSA-N 466.564 0.750 50 20 JCGD CN(C)c1cccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779029391 WTSJNZHGADGQFT-XMMPIXPASA-N 482.541 0.274 50 20 JCGD C[C@H]1Oc2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cc2NC1=O 1779032687 RQYTYXJKAOULAR-SHACYNPGSA-N 494.508 0.162 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1C 1779037369 YACLKPZLRLCSGK-XMMPIXPASA-N 480.525 0.709 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CCc3nc(N)n[nH]3)CCO2)C1 1780097852 OSSSXNOCTSBFTK-NRFANRHFSA-N 487.473 0.297 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780098038 ZBHWJZMLVGYNPO-PEBXRYMYSA-N 474.470 0.654 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1780939064 RPLILWIMNAJIBO-CXAGYDPISA-N 475.340 0.412 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncc[nH]1)CCO2)NC(=O)NCc1ccccc1 1780969930 OCYURZYYVRPDBM-JOCHJYFZSA-N 455.519 0.199 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)CC(F)(F)C(=O)O)CCO2)NC(=O)NCc1ccccc1 1780970414 VQTADHXIJXWNST-NRFANRHFSA-N 497.499 0.273 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781325443 DHUGYGYQNJNPRE-WMLDXEAASA-N 478.340 0.760 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781335514 UEZYESRMFXSVHO-RISCZKNCSA-N 454.343 0.367 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c1OCCO3)C2 1782214686 MBEGFVMEOVBHOF-NTKDMRAZSA-N 474.558 0.958 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@]2(CN(C(=O)Cn3cnnn3)CCO2)C1 1782869497 CFDINMOYUCYYHU-ZYEUVFMNSA-N 486.330 0.873 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1783533118 QXEOLFCGQMWFGP-MGPLVRAMSA-N 461.338 0.065 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1 1783678518 RFMWLZMZNKLHQC-HSZRJFAPSA-N 456.547 0.698 50 20 JCGD C#CCO[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1784484761 ALHGJMGTMBOSON-QESAQDPVSA-N 485.585 0.351 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)C1CCN(Cc2ccccn2)CC1 1785385011 VURRLXWMBLORLN-WJMWBRGCSA-N 464.994 0.873 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785583426 JBDBCNFOJOSHKJ-YADARESESA-N 489.378 0.503 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccc(Cl)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978709 MUIGYWMGFZCOQF-NDXORKPFSA-N 472.734 0.692 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ncsc34)C[C@@H]21)c1cccc(B(O)O)c1 1786983988 JENYSUFPHGGRAQ-QSFXBCCZSA-N 465.340 0.883 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(F)c3F)C[C@@H]21 1788610052 YXRACUCJGKFATA-FNHZYXHNSA-N 473.480 0.799 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC(c4ccccc4)=NN3)[C@H]2C1 1790547678 VCSWAEJIORZIPK-MMKMLUHNSA-N 470.574 0.105 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792983805 OTIVJDPUNLSMDV-NPJQDHAYSA-N 457.955 0.433 50 20 JCGD COc1nccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1794370497 CSNNHNQLGBNUCY-XGUBFFRZSA-N 483.953 0.821 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccccc3F)CC1)C2)c1ccc(B(O)O)cc1 1795736788 GSAXSICJNJVYID-UPHUGPLXSA-N 452.291 0.441 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736974 QMMKRQVSIBTUSL-DFYYWFRZSA-N 455.345 0.145 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccs3)on1)C2)c1cccc(B(O)O)c1 1795740294 OUGWSGUZFBZUOO-YVWYUNDQSA-N 467.312 0.600 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCCO1)C2)NC(=O)NCc1ccccc1 1799094894 HZYKCIUHNWMCFQ-XAPVIXHLSA-N 473.574 0.491 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1)N1C[C@H]2C[C@H]2C1 1799097240 KZXNBVWLHMUWCE-QYPFPGBOSA-N 498.628 0.262 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncnn1C)C2)NC(=O)NCc1ccccc1 1799864767 NGRGIUQQVVXEKJ-BCDXTJNWSA-N 454.535 0.413 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccc3)CC1)C2 1801009305 ZXSFIJXRXIDSPB-IRJINJETSA-N 471.602 0.866 50 20 JCGD C[C@H]1[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C 1802245211 SQLVXQJHWDOQHQ-NYXISSTPSA-N 459.971 0.821 50 20 JCGD Cc1nnc(CCC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1 1807362872 MKFWSDNGZTZUSX-XMSQKQJNSA-N 479.371 0.874 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc3snnc3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373579 BXNXXEHXJWQVFH-OXJNMPFZSA-N 488.338 0.795 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)N1CCN(C)CC1 1807878277 OSPXCKWAHOYRCY-KKLQWCBXSA-N 473.622 0.096 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC2(CCCN(C(=O)[C@@H](N)CCC(N)=O)C2)CC1 1809680807 SXNZBZSQJWBLBS-HOTGVXAUSA-N 488.029 0.943 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810302019 DPSLKDBJBAMRNG-FFZOFVMBSA-N 466.542 0.973 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1 1810306369 XREOWUGGFWMKFN-FLTJSSMESA-N 466.542 0.951 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812949951 JLNAWFDSCXEWIS-PBEJRMEISA-N 496.373 0.994 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1 1813069508 YQMYPAIAMBRSJW-CJNGLKHVSA-N 491.442 0.816 50 20 JCGD COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1 1815343718 LGAYJLGWSIIOBE-CYBMUJFWSA-N 453.289 0.161 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)[C@H]1SC(=N)NC1=O 1817471957 ZNIJYSRGTMZIGR-XNJJOIOASA-N 484.347 0.198 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817475428 OASGBGCFYKNVPT-LPADLIQXSA-N 451.292 0.254 50 20 JCGD Cn1nc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c2c1CCC2 1818471394 KAYMLEDGZDWCRV-CQSZACIVSA-N 465.344 0.585 50 20 JCGD CC(=O)O[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)C(C)C 1819481226 YIMPQLNMWPFGPR-QAPCUYQASA-N 459.333 0.636 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(C)C(=O)C(=O)O)n[nH]1 1821715545 ZRDIGFFQRVZMOR-ZIFAQYRBSA-N 486.489 0.079 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3cnccn3)sc2C1 1826909915 UMHTVIQVVLWLHN-GFCCVEGCSA-N 466.527 0.790 50 20 JCGD NC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc1ccccc1 1829360332 BMLMNPSEMDHNGN-HXUWFJFHSA-N 486.356 0.911 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2)C(=O)C1 1830730844 FEMIDDSOFUGWNI-GCJKJVERSA-N 478.933 0.469 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733377 KMLVVLOUFHCFDM-YLJYHZDGSA-N 470.910 0.331 50 20 JCGD CC[C@H](NC)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1834790187 LCTAGOYDJZYHDA-FQNOVECQSA-N 459.595 0.690 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)cn3)CC2)CC1)c1ccc(B(O)O)cc1 1834798465 YYALKIHKJZUJOI-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cc3cncnc3)CC2)CC1 1835118184 DXOYLZGOTHJHQM-STBIYBPSSA-N 480.573 0.725 50 20 JCGD O=C(c1cnc2c(Cl)cccn12)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836370332 OKBFGTFXNICVPT-HNAYVOBHSA-N 457.314 0.657 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2 1836629637 LSEWZGPZCFMNRJ-PMACEKPBSA-N 478.512 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1837459234 NAKGJFRWSZPFMU-DEOSSOPVSA-N 496.499 0.689 50 20 JCGD Cc1ccc(O)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459892 OBTWSLSKNLCVOV-QHCPKHFHSA-N 469.498 0.083 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)n1ccccc1=O 1837686964 OEYXKNBTZQUMCE-LAUBAEHRSA-N 451.596 0.717 50 20 JCGD O=C([C@@H](F)Br)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1838404001 JXAWKGPTJURWJW-CRAIPNDOSA-N 466.348 0.326 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)cn2[nH]cnc(=O)c12 1838471369 MUSCVBHLINQBRG-PMACEKPBSA-N 486.356 0.637 50 20 JCGD CN(CC(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1)C(=O)C(=O)O 1838639161 XPSHWRPNUDLEOG-IBGZPJMESA-N 466.362 0.764 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)[nH]n3)CCO2)C1 1838661773 SEQIPGTYUMHFMU-JOCHJYFZSA-N 487.469 0.935 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1F 1838914792 XIXWLUVPLRFLBK-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2 1839000144 UUCAKKZGWDPEDI-OAQYLSRUSA-N 454.474 0.408 50 20 JCGD O=C(c1cnc2[nH]ncc2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200195 DFXWYOVRHFQKER-GUYCJALGSA-N 456.272 0.718 50 20 JCGD O=C(c1cn2cccnc2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201058 QICDFEUPUDJUGN-DYVFJYSZSA-N 456.272 0.490 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)CCO2)C1 1840017986 PBKSAHOIWLYCQD-AFXFGAOOSA-N 477.945 0.607 50 20 JCGD CC[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)CC1 1840057027 FVNJCUHIOUUOIP-KHCICDEESA-N 458.364 0.653 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(F)(F)F)nc3)C2)C1 1840183536 KTJCDIMCUFTZSU-FQEVSTJZSA-N 487.479 0.543 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccs3)C2)C1 1840183939 IZNHBHHBEYKRBD-XYASWCNUSA-N 450.561 0.591 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2 1840859103 YYRSVWOYNXPBCG-DEOSSOPVSA-N 482.317 0.307 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccc(F)cc1 1843011955 NOMTYVBVDIIGPY-FQEVSTJZSA-N 453.279 0.200 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846189076 BZQDKLQJYZMRFT-MZNJEOGPSA-N 469.347 0.583 50 20 JCGD O=C(CN1C[C@@H](C(=O)N2CCOCC2)Oc2ccccc21)NNC(=O)c1cccc([N+](=O)[O-])c1 15048836 DXOHHUGMGCESMX-IBGZPJMESA-N 469.454 0.482 50 20 JCGD CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1 726073279 FKNBMGWPAJCQPD-AEFFLSMTSA-N 466.947 0.991 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)c1 728959755 PBFAQJWGKMFQMM-UHFFFAOYSA-N 497.556 0.909 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NN=Cc2cn(C)c(=O)n(C)c2=O)c1 807184715 WOYQRBKJWVHJPF-UHFFFAOYSA-N 471.495 0.657 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1 825625064 XQLUYXNMBFQNOC-UHFFFAOYSA-N 478.527 0.598 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCCNC(=O)C(C)C)N(S(C)(=O)=O)CC2 915906986 WKSOJDZMVWYUEW-INIZCTEOSA-N 499.590 0.055 50 20 JCGD COCCOc1ncccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 916510230 FHJDFEDPULZIML-UHFFFAOYSA-N 451.505 0.501 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)CC(F)(F)F 918365220 WVRBPJPSCHOBOM-UTSBKAFOSA-N 471.479 0.480 50 20 JCGD O=C(NNC(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3O2)c1)N[C@@H]1CCS(=O)(=O)C1 919884043 DLRCXMDQQLRRTG-AEFFLSMTSA-N 458.496 0.760 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2nc(S(C)(=O)=O)n3ccccc23)cc1OC 920641492 CXWXGGDJXUDUGJ-UHFFFAOYSA-N 476.467 0.373 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)[C@H](O)C1 1778360510 GFPHVYWTMUNUBE-KFVVBQDRSA-N 489.997 0.424 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1778716143 PQQMLALAHIHZMV-OAQYLSRUSA-N 454.317 0.141 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1[C@H]3SC=C[C@H]31)C2 1779374755 ZNJUMZACRPVAGT-YKHZQOCDSA-N 457.556 0.688 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1781232483 VDAOSRXOYANCIQ-RBUKOAKNSA-N 454.314 0.769 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1781561688 LWPDZZPXUICUJB-QIIPPGSGSA-N 489.298 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)C2)C1 1782053444 LENQVYPAVRHZJD-JOCHJYFZSA-N 476.534 0.477 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2 1783877389 XZRCNERYHQNVMF-MDOVXXIYSA-N 462.975 0.312 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)CN(C(=O)OC(C)(C)C)C1CC1)CCO2 1783932742 BWBFRDSEEFPCCZ-QHCPKHFHSA-N 481.594 0.589 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1cc3ccccc3n1C)CCO2 1783932753 DIFWNWBLJGOPLL-DEOSSOPVSA-N 455.559 0.924 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@H]1SC(=N)NC1=O 1787495344 LJKPTGBOSYJUGM-CUOUOBHDSA-N 461.382 0.554 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)N3CCCC3)C[C@@H]21 1787507102 XKMUQLKIYOJKII-KEMROHCCSA-N 486.573 0.503 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3F)C[C@@H]21 1787508819 KHUQKISHDSWZNC-VOSSUDFCSA-N 456.478 0.948 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1789694296 CZSNXOWWIIJVHF-DFJGONKVSA-N 455.914 0.523 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791291030 HSYKPOINBVZXBG-WDSOQIARSA-N 473.574 0.369 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)CCOC1 1796188596 YLKNGRGNHLRQRX-NRAIQUKZSA-N 487.362 0.302 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)C1 1796192135 MBRBLFNQLCVTBQ-YRPNKDGESA-N 483.374 0.875 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnn1-c1ccccc1 1796740615 FPHSADZLXUSTAQ-VPTLXERWSA-N 475.509 0.388 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1 1797222783 TXWGLMWSFGTNDG-LJCCNALRSA-N 481.594 0.206 50 20 JCGD CC(C)(C)OC(=O)N1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)C1 1797714323 XBSQRXBDKIUMHF-REPLKXPHSA-N 457.336 0.485 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)C2 1797748551 HGOQZULDBBHSTN-VAKZPMALSA-N 478.509 0.082 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(C(F)(F)F)cc1 1798955358 GCKCLIMPRILXEX-HGKCTWBKSA-N 462.233 0.902 50 20 JCGD CCOC(=O)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)ccn1 1799411543 YZYVNXVJUZTCOD-REPLKXPHSA-N 451.288 0.504 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCSC(=N)N)C2)NC(=O)NCc1ccccc1 1799864963 VMJQYJIUUTZBNQ-BCDXTJNWSA-N 475.619 0.988 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799871526 MBOBVDQHIHGZOC-FFGOWVMKSA-N 487.605 0.678 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2 1800763370 YODCEXDGYRRUKM-LBZHBENTSA-N 490.395 0.731 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)n(-c2cccc(=O)n2C)n1 1801016294 WGRUWKKXIIYRSK-FVCICTRLSA-N 468.341 0.886 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@H](O)CCl)C3)C2 1802154358 GHAAEWVFLICSIJ-ZEHZNMFBSA-N 471.982 0.964 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C2CC(O)C2)[C@@H]1c1cccnc1 1803044571 YWHRDSUBXIVCEY-NRKKJRMYSA-N 452.515 0.992 50 20 JCGD C[C@H](Cn1cccn1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804714832 DWAYQDRBAKNOKR-ZNLUXHQJSA-N 461.331 0.614 50 20 JCGD CN(C)c1cncc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1 1804850468 PCISJOGCZRLEJL-WMZHIEFXSA-N 473.342 0.856 50 20 JCGD COc1ncc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1F 1804960339 NDVOGALGPUYIBU-DYESRHJHSA-N 478.289 0.938 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1806342782 LHUZCNFHZRUHMS-JQHSSLGASA-N 455.353 0.523 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363734 NQWKLTAPCADDKQ-UWJYYQICSA-N 467.722 0.631 50 20 JCGD Cn1cccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1=O 1807363870 FZJUVIYLQPQJBT-NQIIRXRSSA-N 460.299 0.094 50 20 JCGD C[C@](O)(C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(F)(F)F 1807367539 ZVKUVPUNZLADQR-MDYRTPRTSA-N 465.237 0.394 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc3snnc3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373582 BXNXXEHXJWQVFH-OXQOHEQNSA-N 488.338 0.795 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C#CC2(O)CCCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374328 GYVDBGKPNJQDCP-ZJSXRUAMSA-N 475.354 0.780 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374763 JAGLJKGYYKTYKU-CVDCTZTESA-N 473.342 0.928 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1 1808416526 BBZSQIKQRIHBRL-IVIIRQTASA-N 476.497 0.619 50 20 JCGD COCCn1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)n1 1809977723 DJRKHJGIPURWCB-UHFFFAOYSA-N 454.336 0.368 50 20 JCGD CC(=O)O[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(C)C 1810302086 GCBGTMHGJYMBNN-QMMLZNLJSA-N 482.541 0.987 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc(O)ccc1O 1811896486 WGZIBMNEUZFVTO-VGSWGCGISA-N 461.283 0.806 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@H]1c1cccnc1 1813072668 IOTUDFPBDPKLAP-DYVFJYSZSA-N 482.467 0.911 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2cn3c(nc2=O)SCC3)[nH]n1)[C@@H](O)CCl 1814873784 ZSORCKRDGZHOCM-KGLIPLIRSA-N 466.951 0.907 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)N1 1814875399 YILUOVJUVFPZHM-MHEUCROKSA-N 498.993 0.182 50 20 JCGD O=C(CSc1ncccn1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1815627958 SXVGSNZGDZLFBO-CQSZACIVSA-N 469.357 0.631 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nc3ccccn3n2)[nH]n1)c1cccc(B(O)O)c1 1817474448 FUAHXOBWPPUDOM-QGZVFWFLSA-N 459.275 0.752 50 20 JCGD COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)nn1C 1819798043 RVFIIBTUERIRGS-JTQLQIEISA-N 470.515 0.423 50 20 JCGD O=C(COc1cccnn1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822752751 OIRQDGUDAQQJTI-QGZVFWFLSA-N 450.264 0.264 50 20 JCGD CCOc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1829554794 XFCHVSQVXTVIGL-OAQYLSRUSA-N 468.576 0.590 50 20 JCGD CC[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1830525275 KWMXZTJMOHUCIX-UTKZUKDTSA-N 465.459 0.361 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnccn3)C2)C1 1830546988 YWYUFBRYEFTVLX-DNVCBOLYSA-N 455.353 0.897 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830730451 ALQMMRIBAVJLPH-RXVVDRJESA-N 453.923 0.244 50 20 JCGD O=C(CCc1cnc2[nH]ccc2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737024 CKPUDPXUKKCJAQ-UWJYYQICSA-N 450.923 0.552 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2)CC1 1830739203 ZZEMRJWAVJYLHM-ZJSXRUAMSA-N 495.020 0.498 50 20 JCGD COCC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)CC1 1831373769 LGKGOIUTNVAVLL-ZHNJOBQTSA-N 461.519 0.003 50 20 JCGD C=CCOCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831407348 VMEJOFDULHHUPO-UPQSEYGOSA-N 475.546 0.560 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2 1832231455 GXMVPHVFYYMHER-IRLDBZIGSA-N 450.511 0.527 50 20 JCGD Cc1nnc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)s1 1833021221 YQOJJXQMBYQKGM-ZBFHGGJFSA-N 465.345 0.926 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1833483978 BOLHBFCBYIUGTD-SWLSCSKDSA-N 470.405 0.929 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1833497077 WUVJAOIQLWDXNB-PIGZYNQJSA-N 457.281 0.028 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ncn(C)n3)CCO2)C1 1833881929 FTXOAMKSABZNAB-OAQYLSRUSA-N 488.457 0.032 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3(c4ccc(O)cc4)CC3)CC2)CC1)c1cccc(B(O)O)c1 1834800626 TZDNJVMCODDMCC-UHFFFAOYSA-N 491.397 0.989 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cccc1C=O 1834806004 FZMHMYFWSWXVOP-SFHVURJKSA-N 480.374 0.427 50 20 JCGD CC1(C)Cc2cccc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2O1 1835928446 QRMORKBDEZDOGD-SANMLTNESA-N 494.353 0.464 50 20 JCGD CSc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835934482 VLYPVPKXSJOGSM-DEOSSOPVSA-N 484.383 0.401 50 20 JCGD O=C(Cn1cncn1)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1836139498 MNPPNKLXKUYYCG-WIYYLYMNSA-N 492.374 0.741 50 20 JCGD O=C(c1cnc2[nH]ncc2c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1836814927 OPMIHPQRUXAEOJ-CXAGYDPISA-N 456.272 0.718 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCc3ccccc3F)C2)C1 1837455611 AEAARQZNVAFNCG-RUZDIDTESA-N 499.543 0.917 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c2ccccc21 1837713065 FINIGOOYBVNJGK-QHCPKHFHSA-N 490.633 0.648 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920048 HFFNBLAKLOEGNN-UHFFFAOYSA-N 479.342 0.391 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1839152440 ZEDUJHYUGJPRRU-ROUUACIJSA-N 486.418 0.105 50 20 JCGD CN(C)c1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1 1839197952 NVGJLZTVJFFQEV-CRAIPNDOSA-N 459.316 0.908 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)CCO2 1839203911 ADNXKKXFPYPDPD-MRUHUIDDSA-N 477.986 0.736 50 20 JCGD COc1c(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1C 1839392684 LXKPHSYYECDZNH-RUZDIDTESA-N 482.342 0.376 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3sccc3c1O)CCO2 1839567063 GIPMLFBEKAKVDU-XMMPIXPASA-N 496.350 0.671 50 20 JCGD O=C(Cn1nccn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802478 XXKQKANIRPWHNM-GHTZIAJQSA-N 492.374 0.741 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839964318 NNTJHXMKWMEMRG-GCVGFEQUSA-N 498.378 0.750 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)C2)C1 1839965498 ZWNHMJIGEOAODT-GHHWKCCRSA-N 458.397 0.957 50 20 JCGD C[C@@H](Cc1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185172 LYQWLXIDECEPAB-JTSKRJEESA-N 450.536 0.288 50 20 JCGD Cc1cccn2ncc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c12 1840185412 QKJWAVYPPQIDIK-QHCPKHFHSA-N 472.546 0.086 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1 1840186350 KCXSDHIAXZVYPN-QGZVFWFLSA-N 466.343 0.359 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840188814 DOSXODIQHRAXGK-HXUWFJFHSA-N 475.325 0.709 50 20 JCGD O=C([C@H]1CCc2nc[nH]c2C1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840364909 SRWJNXAWCZGZRD-XLWVJDPXSA-N 459.316 0.662 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1840892210 NATBRUQTXGQHAI-OSPHWJPCSA-N 467.526 0.559 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CNC(=O)c1ccco1)C2)NC(=O)NCc1ccccc1 1845038838 ZSYZPRDOCUGYMC-UHFFFAOYSA-N 482.541 0.559 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C)C2 1846384764 GFDHLYCAJOWRMU-INIZCTEOSA-N 467.567 0.199 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)c[nH]c1C 1847664629 WIWBCSQKHCIILT-OALUTQOASA-N 482.541 0.947 50 20 JCGD CNS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1 11106720 XNDXRHMUJRRQFV-UHFFFAOYSA-N 485.902 0.883 50 20 JCGD O=C(COC(=O)c1cccc(N2C(=O)CCC2=O)c1)NNC(=O)[C@@H]1COc2ccccc2O1 104489135 HJXUYLZRRKAHRI-KRWDZBQOSA-N 453.407 0.484 50 20 JCGD COc1cc(C(=O)NNC(=S)NCc2ccc(S(N)(=O)=O)cc2)cc(OC)c1OC 726437401 DHAWKUWQRPGDCZ-UHFFFAOYSA-N 454.530 0.669 50 20 JCGD CN1CCN(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3c(Cl)cccc3Cl)CC2)CC1 727847026 OSEMKRGJZQQIBO-UHFFFAOYSA-N 479.390 0.458 50 20 JCGD CCCCN1C(=O)C[C@H](C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)[C@H]1c1ccc(OC)cc1 728385114 KLFHWQBERLZDOC-VDZJLULYSA-N 451.545 0.967 50 20 JCGD O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 731003802 NHAKFMAVCLHEML-LBPRGKRZSA-N 482.378 0.521 50 20 JCGD O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 745838354 LQLSRGWXIDMORU-OXQOHEQNSA-N 484.534 0.082 50 20 JCGD CCNS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 787930131 DBPWHUWIQNUYAB-KRWDZBQOSA-N 463.468 0.129 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1OC 913068031 AXPPKCWGJRNKGM-UHFFFAOYSA-N 479.511 0.995 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1c(C)nn(C)c1C)c(=O)n2Cc1ccccc1 916332988 ADEGHSITOLIOLD-UHFFFAOYSA-N 492.540 0.555 50 20 JCGD CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)CC1 916519025 ZXHSBFKMCWCJEH-UHFFFAOYSA-N 496.634 0.652 50 20 JCGD COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1O 916642182 RFGJLYYFTIPAPT-UHFFFAOYSA-N 464.500 0.566 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cnsn1)c(=O)n2Cc1ccccc1 918300841 UTJMLCOTAGPFKR-UHFFFAOYSA-N 482.526 0.377 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)[C@@H]1COc2ccccc2O1 920423700 XPOCVBXZTBRCKB-INIZCTEOSA-N 450.429 0.251 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c2n1 1777775933 DEIGNOWRYFQDSQ-HSZRJFAPSA-N 478.513 0.102 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCC(=O)N1C)C2 1778092710 MDMLQEAJUZJYMX-RJMNOMDGSA-N 472.546 0.255 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)n1cccc1 1779376101 XQPMUVRCNRDWJV-XKDCRVNJSA-N 454.531 0.875 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(OC)c1 1780533023 FZFLSJCYBBIMPH-HSZRJFAPSA-N 469.498 0.460 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(N)=O)C1 1783284609 GJXVGKKTLFXGJA-LRDNONRASA-N 475.974 0.301 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCO[C@]3(CCN(C(=O)[C@H](Cl)COC)C3)C1)C2 1783882731 QQNFQURBMVAUKK-DMPWYTOCSA-N 482.965 0.706 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c(O)cc3O)C[C@@H]21)c1ccc(B(O)O)cc1 1786981685 GITWYDRRGVAMEU-RISOHXOYSA-N 474.706 0.338 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)nc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984688 YQHDCNHDMJZGCB-SZMVWBNQSA-N 477.248 0.687 50 20 JCGD O=C(CCN1Cc2ccccc2C1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788148303 SRSDVLXHPZBKKT-VJBMBRPKSA-N 491.353 0.006 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc4ccccc34)C[C@@H]21 1788610440 RTRSBHNCLHWBEP-JBYOLUDKSA-N 490.520 0.846 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(OCCCO)cc1 1789235805 ONGZORHQTHSLQZ-VJBMBRPKSA-N 482.342 0.035 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccn(-c2ccccc2)n1 1789348228 KJOSQKPZTVZOEP-HARLFGEKSA-N 474.326 0.459 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3NC(=O)C4)[C@H]2C1 1790449306 SYMDMPOLNNSFFJ-JVPBZIDWSA-N 478.509 0.087 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)C1 1791293227 PDDRTIDMJPYDQF-GFEQUFNTSA-N 466.579 0.319 50 20 JCGD C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)Oc1ccccc1 1795741281 RTWDRSISSLQFIY-YQYRJILISA-N 452.316 0.427 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1nc(C)cc1C)C2 1796439624 SIDHNNJVACFXKF-ODRBZYGGSA-N 455.519 0.224 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CO)o1)NC(=O)NCc1ccccc1 1798119042 QCKUYROFXRYVDH-OPMZPASUSA-N 485.541 0.321 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(Cl)cc(Cl)n1 1798297655 HDWARWINAUPMKD-IVWMJMPLSA-N 464.114 0.585 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@H]3SC=C[C@H]31)C2)NC(=O)NCc1ccccc1 1799098046 ZEDJNAOKTWVFEU-ISYHVGNFSA-N 485.610 0.797 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2 1799382668 DWUWAOMTUOIGDT-BMFAXAFESA-N 495.411 0.446 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccc(F)cn2n1 1800133803 KKOAIYZRYAFBKB-GHJDPZQESA-N 482.476 0.206 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)[S@@](=O)c1ccccc1 1800213260 UERUCACFTZEKLT-MESSWVOZSA-N 499.593 0.906 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O)C2 1800974473 VJEGLGGNDRHPRR-UCIFAOBLSA-N 489.997 0.448 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1 1803979868 HVZMBLQKRHQILN-BJWYYQGGSA-N 490.774 0.989 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807360213 PFRKCNIFGVEFFO-LRQRDZAKSA-N 496.373 0.994 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc2cn[nH]c2cn1 1810084900 LTOJSERQLFBXSB-HTAPYJJXSA-N 470.298 0.666 50 20 JCGD COc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1 1810807765 CIFNUIJYKIUTDX-GCJKJVERSA-N 460.299 0.798 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)n1cccc1C=O 1815382442 ZEPVDTVMCOYJOL-BBRMVZONSA-N 466.328 0.924 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)Cc2cscn2)n[nH]1 1817978526 QDMDTEZDEBZLLV-DOTOQJQBSA-N 483.558 0.741 50 20 JCGD COCCn1nccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1818251257 HLCXYKJFOQZFBJ-MRXNPFEDSA-N 460.539 0.932 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C=C\C(=O)NC2CC2)[nH]n1 1819403292 CMCZTIMWTNFGGQ-JTGQJZMRSA-N 466.502 0.549 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426553 ZWPVVBMUAFRKLK-IBGZPJMESA-N 453.304 0.720 50 20 JCGD O=C([C@H](O)CCl)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H]3C=CCN3)C2)C1 1828551145 KLUPYIJOLGJKDH-YCRNBWNJSA-N 476.961 0.566 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN)CCN2C(=O)OCc2ccccc2)C1 1828961291 NEOGPQBKETTYRT-UWJYYQICSA-N 452.939 0.651 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(O)C(F)(F)F)CCO2 1832148663 CAUNFYHXLPNQGT-BYCMXARLSA-N 461.275 0.787 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832877874 KXNYTPRISWYGBQ-PMACEKPBSA-N 475.373 0.827 50 20 JCGD CN[C@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)C(=O)O 1834742504 PESPRFJJEPUCKS-HIFRSBDPSA-N 451.337 0.311 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cn[nH]c3)CC2)CC1 1835169783 OGKBUAAJAYNSHF-JFLMPSFJSA-N 454.535 0.729 50 20 JCGD CNc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1835607028 VSYMCILYGOSYNH-QHCPKHFHSA-N 468.514 0.111 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C(=O)Nc3cccnc3)CC2)CC1 1835804657 JEJPAQLAYWOBBA-GOSISDBHSA-N 451.955 0.846 50 20 JCGD O=C(c1ccc(F)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931268 KMBCZSLBBAAMRG-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1F 1835933942 HPHXUMVUFFFYIX-VWLOTQADSA-N 484.333 0.517 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CO[Si](C)(C)C)CCO3)no1 1837715214 CFZYUCSDLMTPNM-HXUWFJFHSA-N 468.583 0.021 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1837918474 SRMSXJKWHUUOFZ-OAHLLOKOSA-N 466.926 0.284 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3[nH]nc4ncccc34)CC2)CC1 1838050357 XUPWTMJDOUZMRE-UHFFFAOYSA-N 492.540 0.882 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1 1838767895 XACPXSSGMZFOGB-XPTSAGLGSA-N 470.246 0.677 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)N1CCN(C)CC1 1839105719 LUDGOGOVHBDGKQ-VDGAXYAQSA-N 465.422 0.315 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1ccccn1)CCO2 1839668094 ZZUANFIQKQJREH-QYWGDWMGSA-N 452.939 0.674 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1839966277 ZSHCZWHLDCOODH-BEFAXECRSA-N 466.336 0.973 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3C(F)(F)F)C2)C1 1840184208 CXZSVECVEPFGNZ-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840187344 UFYFNAFDTFXKGF-QHCPKHFHSA-N 475.546 0.088 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2 1840858580 FKNDNBZAZYJTIX-XMMPIXPASA-N 482.317 0.307 50 20 JCGD CC(=O)NCCCC[C@@H](NC(=O)c1ccccc1)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841353819 RHWHEBAMIKAPRL-WOJBJXKFSA-N 493.004 0.895 50 20 JCGD COc1cc(N2CCC(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)CC2)ncn1 1841459962 ZSEBBLBBSACAIN-UHFFFAOYSA-N 494.556 0.217 50 20 JCGD COc1cc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc([N+](=O)[O-])c1OC 1845552448 RHSKPYJADDKABW-UHFFFAOYSA-N 463.491 0.802 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)Cn2ccncc2=O)C1 1845766647 ZWEQAKAYJLZMIY-AWEZNQCLSA-N 453.927 0.579 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)NNC(=O)C(=O)NC1CC1 9889203 SBBRITWQJLSWMS-ZDUSSCGKSA-N 483.399 0.819 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)cc1C 17238814 HGLGNNZFPRQSAZ-IBGZPJMESA-N 497.595 0.611 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)N3CCOCC3)c2c1 745988303 XHLLKIFMVMUJNV-UHFFFAOYSA-N 451.505 0.658 50 20 JCGD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)CNC(=O)c3cccs3)C2=O)cc1 751208607 GOCHMKYNRCXQSU-HXUWFJFHSA-N 459.484 0.101 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)n1 760983717 PFTMWJCPGAGHLQ-AWEZNQCLSA-N 499.571 0.390 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)cc1 771197333 OJAMVRCXSSSXOH-FUHWJXTLSA-N 495.941 0.777 50 20 JCGD O=C(Cn1cccn1)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 842471255 OOCNOAOWHVSXHT-UHFFFAOYSA-N 482.566 0.851 50 20 JCGD O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)Cn1cncn1 849203283 UREFXVPXIXCTJX-UHFFFAOYSA-N 462.919 0.970 50 20 JCGD CCOC(=O)NCCC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 915259758 VMUXUXMDTPPUGA-HNNXBMFYSA-N 486.547 0.236 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cc2S1(=O)=O 916752472 GEXCHKTTYINOEY-UHFFFAOYSA-N 485.478 0.444 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2COCCO2)c1 918108468 JQUDPLPVWCYDSW-OAHLLOKOSA-N 464.500 0.855 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3cccc(N4CCOC4=O)c3)nc2)CC1 919657865 WIPFEKVFOHJKKN-UHFFFAOYSA-N 489.558 0.801 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)CCNS(=O)(=O)c1ccc2c(c1)OCCCO2 919820203 NAOYPFYACIHCOR-UHFFFAOYSA-N 463.512 0.915 50 20 JCGD Cc1cc(/C=C(/C#N)C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1C[C@@H]1CCCO1 920290090 FFJGZSIQMVHGQX-QQGCKCOSSA-N 462.572 0.953 50 20 JCGD CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1 920385486 ZFVWUQCNRXEYOH-MRXNPFEDSA-N 486.572 0.382 50 20 JCGD O=C1CCCc2cc(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)ccc21 1777925600 QEJOWBNLUFLPEX-RUZDIDTESA-N 462.311 0.643 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1778918109 POFRVYHLQPYPDQ-MWTRTKDXSA-N 452.515 0.629 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncccc1Br)CCO2 1779032663 QGYQTRVXRSTPPV-HXUWFJFHSA-N 489.330 0.600 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1 1779032701 SJFRGCXOIQQMSX-QHCPKHFHSA-N 476.497 0.228 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2ncncc2c1 1779070961 OULXYQATFVKJGN-RCZVLFRGSA-N 474.326 0.751 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1779321470 VCODFOFPRIBGAX-QUEFLWHZSA-N 489.577 0.342 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1779954182 RYLCHADZIRYWCV-LRDDRELGSA-N 459.297 0.890 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780062554 HCJLYTGFMZEJTN-YJYMSZOUSA-N 464.320 0.707 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1780199889 ACUAHIJVFVYEOQ-QRWLVFNGSA-N 465.894 0.376 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1780712956 GQBLKWJZHIEDGR-LSTHTHJFSA-N 457.163 0.730 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3ccnn3c2)C1 1781350248 BNRXQXFTGOYHGH-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ccsc4[nH]3)C2)C1 1782286267 UWWLLDHKCMQILX-NRFANRHFSA-N 454.512 0.985 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1783534249 GYVICLHGFJBHMC-XJKSGUPXSA-N 452.371 0.025 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784096652 JIKKAGXCCDUPLB-XCZFOBESSA-N 469.941 0.452 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1[N+](=O)[O-] 1785183271 UPTPDJMEWFQEFA-NRFANRHFSA-N 463.491 0.420 50 20 JCGD Cc1cccnc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785202163 CAQARXIIGDLDBQ-VCOUNFBDSA-N 451.332 0.296 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccsc4[nH]3)C[C@@H]21)c1cccc(B(O)O)c1 1786985145 NSSIYUVVZGRMSF-IEZWGBDMSA-N 453.329 0.816 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1788176751 KWNCFQXDQZNHHD-XAJHFOFHSA-N 459.971 0.823 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@H]1CN(Cc2ccccc2)CCO1 1788199275 AYXNCBBXQLOSLI-JRSUCEMESA-N 465.978 0.467 50 20 JCGD N=C(N)NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)Cc3ccccc3)[C@H]2C1 1790780881 YMFTUGUFGWVCNK-QAETUUGQSA-N 466.380 0.455 50 20 JCGD O=C(COc1ccc(Cl)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793293551 DIDHDIOXDAFHLR-USGNIVHTSA-N 476.697 0.441 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)C(=O)c1ccccc1 1793431301 BBPJSBQMLIDHHP-BCDXTJNWSA-N 464.526 0.709 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c(=O)cn1)C2 1793880366 WQSIFKAXYRJDIE-ZWUHOBOKSA-N 469.926 0.105 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797954925 UGYWGFRGXWRMFT-IVSAIRAKSA-N 459.616 0.313 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798385501 ODUIGHMQKDWSRJ-FFGOWVMKSA-N 487.605 0.678 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC(=O)N1C)NC(=O)NCc1ccccc1 1800194835 BETCDGOTRKWVNL-YRPNKDGESA-N 470.574 0.592 50 20 JCGD CN(C)C(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800436591 YTKQUEBKYYNKAN-YYIAUSFCSA-N 452.349 0.670 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)NC(=O)OC(C)(C)C 1800595837 YIJFQSPKAXFMLV-SGSBBIFLSA-N 476.534 0.602 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cn1)C2 1800757657 HXQFLFPBGZJVNP-AFIMGQEJSA-N 467.364 0.905 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)C1 1800964973 QONSSSPXQRCYCO-PUCRAGRTSA-N 487.557 0.689 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)C2 1801014285 KHLRHIPMPYYEHZ-UZTRCFKKSA-N 481.594 0.252 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375007 MAQIKBCMFZNGMW-HLAWJBBLSA-N 451.332 0.654 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375846 VRQBXUNAIGCEKS-LKUPVBHCSA-N 496.373 0.994 50 20 JCGD CC(=O)O[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(C)C 1807376578 TZQXSGYDXNFZMV-FCEUIQTBSA-N 467.331 0.669 50 20 JCGD O=C(Cn1cc(Cl)cn1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807410683 SIHSBMOADMTSRP-UTKZUKDTSA-N 467.722 0.631 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nn(C)c3c2CCC3)[C@H]1c1cccnc1 1809368522 XZPOHOYMVWKNKB-UZUQRXQVSA-N 467.574 0.996 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccnnc2O)[C@@H]1c1cccnc1 1810302775 NACYNEGVCVVIBB-KBXCAEBGSA-N 462.470 0.209 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1 1810303260 RLSQYSRRWFYQCB-IERDGZPVSA-N 490.524 0.902 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1810442156 XGRGJUUPJOJODR-ZJBJCVSYSA-N 496.572 0.069 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1nc2ccc(F)cn2n1 1812289112 DRQCMAQJSMHOLM-LAUBAEHRSA-N 488.288 0.577 50 20 JCGD CCOC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1812464500 AIUYPCLBPRPVCP-UYAOXDASSA-N 465.315 0.424 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1 1813074630 URWMTWZMDMYJGF-WMZHIEFXSA-N 497.600 0.761 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(C(N)=O)cc2)[C@@H]1c1cccnc1 1813075137 ZKWRXWUKXRARIP-SIKLNZKXSA-N 466.542 0.873 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CNC(=O)C(F)(F)F)[C@@H]1c1cccnc1 1813099441 SVYTYUJDEMDADE-GUYCJALGSA-N 493.446 0.078 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3n[nH]c4c3CCCC4)sc2C1)c1cccc(B(O)O)c1 1816784019 WHNVRCGESMDJPF-AWEZNQCLSA-N 465.344 0.964 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1C[C@H](O)CN1)CC2 1821304895 USCXDBKUKAXBJZ-RBOXIYTFSA-N 489.510 0.925 50 20 JCGD COCCOCCOCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053182 GKACXFGECXBZBQ-QHCPKHFHSA-N 490.406 0.669 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nc1Br 1830731187 HQIQPUMCQOLDNB-FZKQIMNGSA-N 492.754 0.522 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2N1 1830735049 CLOPQMFBAHHDDX-UTKZUKDTSA-N 451.907 0.241 50 20 JCGD COC(=O)CSCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831870879 IHRAKNKGMLVHAC-KRWDZBQOSA-N 456.609 0.885 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873625 QPOJSOMMTIHAIE-UXHICEINSA-N 482.578 0.474 50 20 JCGD C[C@](O)(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)C(F)(F)F 1832163034 VPCXWYJAVJYGLJ-TVYUQYBPSA-N 451.211 0.447 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1 1832420003 XZYJLJCWJFMCGN-OXJNMPFZSA-N 474.396 0.876 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1 1833617446 IDIVLVSJLYFEOW-PGRDOPGGSA-N 482.965 0.242 50 20 JCGD COc1nccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1F 1834797998 URNXNAJXGPSNSA-UHFFFAOYSA-N 484.337 0.408 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n(C(F)F)n1 1834798339 JKVYHODRDHPILJ-UHFFFAOYSA-N 489.332 0.765 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC2)CC1)c1ccc(B(O)O)cc1 1834798961 JBLOJFSYJCDFQQ-LBZQVFOQSA-N 457.380 0.103 50 20 JCGD O=C(/C=N/N1CCCCC1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835732210 HODZAQWGMFSDTL-NLRVBDNBSA-N 469.395 0.023 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CN3CCCCC3)CC2)CC1 1835736933 KYUDCCUOQXGLOD-UHFFFAOYSA-N 471.606 0.356 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3scnc3C(F)(F)F)C2)C1 1835935269 LPNLNIAQQONOJD-IBGZPJMESA-N 499.276 0.226 50 20 JCGD CC(C)(C)Oc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939161 HFNXBWWAAQJQBJ-SANMLTNESA-N 496.369 0.928 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccn(C(F)F)n1 1835951608 IXFBTHIGMNKWJK-UHFFFAOYSA-N 475.305 0.457 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](N)Cc3cccnc3)CCO2)C1 1836506188 SDTZXMIXBJJVHL-UWVAXJGDSA-N 469.380 0.581 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3c(s1)CCCC3)CCO2 1836877869 AWYCKZRCILXGEK-DEOSSOPVSA-N 484.383 0.691 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CNc3ccc(F)cc3)C2)C1 1837457990 ZWHMQJKDGZXCMJ-HSZRJFAPSA-N 486.504 0.006 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccc(O)cc1 1837460130 WCPIJMPLHIODCQ-VOIUYBSRSA-N 483.525 0.264 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1837710306 ULXDDAGQQKNAKJ-OAQYLSRUSA-N 464.595 0.119 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1837715629 BEXNKTOMZKXZIW-FQEVSTJZSA-N 452.584 0.587 50 20 JCGD C/C=C/C=C\C(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054434 YYZLFWHNRPOPKX-IVZGGDASSA-N 485.585 0.921 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C3CC3)cc1)CCO2 1839438943 IQIJMRZAMOXJFL-RUZDIDTESA-N 464.327 0.628 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCCC(=O)OC(C)(C)C)C2)C1 1840182538 NITWIMMXANNCNY-HSZRJFAPSA-N 484.594 0.328 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3OCC3CC3)C2)C1 1840183701 UYNLCGCJVLYUMD-XMMPIXPASA-N 489.573 0.313 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)c(F)c3)C2)C1 1840184109 SLODIWWWRALPCY-JOCHJYFZSA-N 468.501 0.337 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840298608 ZCIISTSIKQZLTA-DFBJGRDBSA-N 466.343 0.315 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CC3(O)CCC3)CCO2)C1 1840594798 SNPIJRVEKGOPHV-HSZRJFAPSA-N 491.497 0.895 50 20 JCGD Cc1cc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1F 1840706550 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PXAYXANBNZSMCK-UHFFFAOYSA-N 467.548 0.556 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(C#N)cc1 747175239 FKZILQHRJCJTNC-QGZVFWFLSA-N 464.525 0.101 50 20 JCGD C[C@H]1CN(C[C@H](C)C(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)C[C@@H](C)O1 747725084 FJWUAOFYOYLXBO-SOUVJXGZSA-N 457.622 1.000 50 20 JCGD COc1cccc(/C=C(\C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n2nnnc2C)c1 817819866 PHDYPKKLJXFBBZ-KDMTZKAISA-N 494.464 0.519 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1csc(N2CCOCC2)n1 818515352 UINZGZLGIHDFQG-UHFFFAOYSA-N 487.585 0.137 50 20 JCGD COC(=O)c1c(C)oc(C)c1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 915044940 IIEZIKKDUDNRES-UHFFFAOYSA-N 458.518 0.908 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)CNS(=O)(=O)c1cccc(C(C)=O)c1 915775936 ZVKPBFLZSJOBFB-UHFFFAOYSA-N 457.512 0.927 50 20 JCGD CCN1CCN(CCCCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1 916506014 SJYGVNIEKUWLEN-UHFFFAOYSA-N 480.635 0.833 50 20 JCGD COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1 917727334 GBPQHDXOLHDDHW-UHFFFAOYSA-N 481.288 0.835 50 20 JCGD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)C1 919887113 ZKOAYPUCSKNUGY-FMKPAKJESA-N 472.589 0.484 50 20 JCGD CN1C(=C(C#N)C(=O)COC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)N(C)c2ccccc21 920605588 JCRHZIDQUJXUOF-UHFFFAOYSA-N 462.466 0.623 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)c1ccc[nH]1 1115817324 UEFSFJHTSFFHPI-CQSZACIVSA-N 471.333 0.772 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1778052280 BKBXIIGAYGUQHY-YJPQMCDFSA-N 477.986 0.640 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)N3CSCSC3)C2)C1 1779143878 KNBJCRXIIJTNSB-IAXJDVGUSA-N 494.643 0.993 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(OCF)cn1)C2 1779370990 CRIMAUXIJQMBTM-VGOFRKELSA-N 487.492 0.222 50 20 JCGD CN1CCN(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)CC1 1779543622 MSRKNKAOKLBXKZ-DENIHFKCSA-N 454.688 0.989 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2)C(=O)C1 1780797365 YTYDSPVYPXPIGZ-DEOSSOPVSA-N 484.557 0.616 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccc(F)cc1 1780909875 AWSZRUPOCALXGI-JTHBVZDNSA-N 477.537 0.206 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1ccnc1 1780968137 AXBOWGIRYNEWHF-DVECYGJZSA-N 483.573 0.620 50 20 JCGD Cc1ncc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)cn1 1780969753 JKDCRTVERILQJS-DEOSSOPVSA-N 481.557 0.575 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCCOC1)CCO2)NC(=O)NCc1ccccc1 1780969975 QHKKVMLYWTYWRE-GBXCKJPGSA-N 473.574 0.589 50 20 JCGD CCOC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)CC1 1781621278 MQJDNMGGNRENLK-VGOFRKELSA-N 473.530 0.156 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C)CCO2 1783874344 DBHPLLUDLLALTE-CKJXQJPGSA-N 475.970 0.706 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ncn4nc(N5CCOCC5)ccc34)CCO2)C1 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460.242 0.170 50 20 JCGD Cc1cc(C)cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1 1795737156 YASJLQXETYFGIK-RUMRUAAYSA-N 450.344 0.819 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796369983 GKCVFTHZFALNAD-XVIXHAIJSA-N 465.906 0.567 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cccc(N2CCOCC2)n1 1796617306 MWMVQUROAWQERL-CCWDJLKJSA-N 467.364 0.906 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1)C1(O)CCC1 1799094846 CGWYJNYIEPKNSO-RPUPUWCGSA-N 487.601 0.473 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)C1 1799352129 KCGPZVYHFLGNLK-IMDDZUEWSA-N 494.358 0.638 50 20 JCGD COc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1OC 1799660006 DLOSZULPYQGXJQ-YVWYUNDQSA-N 472.278 0.040 50 20 JCGD CC(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800435306 BLJRGFYSKXZQNY-SFNKJDCFSA-N 452.349 0.718 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3=O)C2 1800759085 HBQDRGFQUAGKFF-DYNIEEOBSA-N 450.289 0.808 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 1800808043 QDXRSFBHGAJHTK-IZKTWJBDSA-N 475.970 0.200 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCCCC1=O 1800893739 YVGRHWPTXHODQB-MFKICJERSA-N 488.497 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)cc1C(F)(F)F)C2 1801011148 ILCQUULVUGDPLL-IVWMJMPLSA-N 459.469 0.620 50 20 JCGD CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1806293134 LJKLIOULCOVQJO-FIGAYLOZSA-N 451.288 0.200 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCc2cncnc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362368 GOEYRVADZDCZMM-OFNKIYASSA-N 459.315 0.504 50 20 JCGD Cc1nnsc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303630 UFKIYDPAFCFQCT-PBHICJAKSA-N 466.527 0.873 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1 1810822502 FQSBVYBAYINGET-WBILBPDKSA-N 459.551 0.799 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnn2c1OCCC2 1812117835 QOUMIEZPHJZZIN-NQIIRXRSSA-N 475.314 0.374 50 20 JCGD CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1C 1815344379 WKVUWWUYBKQOMJ-CQSZACIVSA-N 453.333 0.658 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362008 YHCMHKDHBGJQNO-LRDDRELGSA-N 453.333 0.815 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3[nH]nc4ncccc34)sc2C1)c1cccc(B(O)O)c1 1816870800 IHTFOPLTPHERIL-ZDUSSCGKSA-N 462.300 0.634 50 20 JCGD COC(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1 1818113745 VUCSEHBKEQDLKM-ZWGXDWAISA-N 458.479 0.892 50 20 JCGD CC[S@@](=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1819515335 YUIIBODTFHMZQV-VMTQLHELSA-N 464.573 0.526 50 20 JCGD CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n[nH]1 1819796964 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CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831646215 IGAPERXHQWPGSK-GOMWODOQSA-N 467.954 0.984 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832043654 BJLLUEBPJWNWTC-SIFCLUCFSA-N 461.943 0.052 50 20 JCGD CC(C)c1csc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1833286568 SPUGTVKHEVBXKA-JOCHJYFZSA-N 488.570 0.649 50 20 JCGD O=C(CCc1ccco1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833841158 PFRGEIGKTTZTFA-UHFFFAOYSA-N 453.348 0.777 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1834823957 OKHLEURETGZMFT-SFHVURJKSA-N 456.293 0.665 50 20 JCGD CS(=O)(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1835258817 WVWCCCKQLTULOO-ZXSWEOGUSA-N 483.493 0.373 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)c1ccccc1)CCO2 1835288002 CXDNCLUTRLYAGJ-HYQBQJDPSA-N 483.525 0.310 50 20 JCGD CC(C)n1nccc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737942 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Cn1ncc(Br)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201415 XEQVDKRMEZVCEQ-IUODEOHRSA-N 498.147 0.943 50 20 JCGD O=C([C@@H]1CC(c2ccccc2)=NN1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839636713 PGJQQNSERFEAPY-ZWOKBUDYSA-N 483.338 0.900 50 20 JCGD CCOC(=O)C1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC1 1839761788 BMIABNDSFZUIBN-BLLLJJGKSA-N 451.289 0.477 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccccc3)C2)C1 1840149274 KHOKLEFPEZTWFD-WMEGFXLRSA-N 479.961 0.569 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(OC)cc3)C2)C1 1840149564 SQYSKLXXYIPYAM-NQIIRXRSSA-N 456.923 0.784 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC=CC[C@H]3C(=O)OC)C2)C1 1840156105 NNSSUQGKDZNLPF-DLRJPAPCSA-N 458.939 0.452 50 20 JCGD C[C@@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC=CCC1 1840554741 HXLSGRLKEDOUOM-PKTZIBPZSA-N 457.531 0.502 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)C2CCN(Cc3ccccn3)CC2)C1 1842094065 NMTDCMLNRASXDU-UHFFFAOYSA-N 462.359 0.491 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc(=O)c(OCc3ccccc3)c[nH]2)C1 1842131481 GIHNYOMUAFFZCY-UHFFFAOYSA-N 487.321 0.765 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1843819196 RMIOMSLTGYBSAX-MSOLQXFVSA-N 475.326 0.531 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cnc3ncccn13)C2)NC(=O)NCc1ccccc1 1845039005 SYSHEGOQKQQLTP-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)/C=C/c2ccc(O)c(O)c2O)C1 1847038272 IAVBJINJAXTWTL-HWKANZROSA-N 453.455 0.332 50 20 JCGD Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2)c1 9931175 QRNANGKMZJAAME-HNNXBMFYSA-N 451.526 0.992 50 20 JCGD Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)CC2)c(C)c1 16786076 RTNWHGWRJHQJHK-QGZVFWFLSA-N 471.601 0.595 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(OC)c1OC 17193210 HUTYWNDXIOPRPX-UHFFFAOYSA-N 469.454 0.150 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cn2cnc3c(C)cccc3c2=O)cc1 17407085 POLAVNMJRIVEKR-UHFFFAOYSA-N 457.512 0.481 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1 23914541 KKAJEAJEAZUCFJ-UHFFFAOYSA-N 472.321 0.817 50 20 JCGD CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CNC(=O)c1cccs1 725740076 AVICWOJYEMQXHT-AWEZNQCLSA-N 477.568 0.779 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(C(=O)COc2ccc(F)cc2)CC1 725873818 QVGPYHUZGPVXJH-UHFFFAOYSA-N 463.491 0.581 50 20 JCGD O=C(NNC(=O)c1cc(F)ccc1Br)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 728550978 RXCFBTSXSHVTTB-JTQLQIEISA-N 475.296 0.515 50 20 JCGD Cn1cc(-c2cncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)c2)cn1 731162426 PMERIBFTHLUBLR-UHFFFAOYSA-N 470.511 0.578 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)NCc2cccnc2)c(Cl)cc1Cl)C(=O)NC1CC1 747150535 JOTDKRIBTHBFSM-UHFFFAOYSA-N 486.337 0.907 50 20 JCGD O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)c1cncc(C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c1 748358971 YGTYNIDWDNSHFS-OYRHEFFESA-N 487.472 0.611 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(F)c(NS(C)(=O)=O)c1 751295351 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C[C@H]1CCCCN1[C@@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916448090 MILDGVOCNGBVFP-IRXDYDNUSA-N 467.592 0.914 50 20 JCGD CCOC(=O)N[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)CC(C)C 916631168 LDJQYQDHSXVVOA-KRWDZBQOSA-N 499.590 0.812 50 20 JCGD CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1 916638838 CKWRRSFTCWWKCC-UHFFFAOYSA-N 477.518 0.919 50 20 JCGD Cc1c(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)c3ccc(C(N)=O)o3)CC2)cc(C#N)n1C 918567843 APEMCXXMPGGDOA-DHDCSXOGSA-N 456.484 0.337 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)NCCC(=O)N[C@H]2CCS(=O)(=O)C2)N(C)c2ccccc21 919715484 YHTVSFWJQRHSCI-HNNXBMFYSA-N 473.555 0.467 50 20 JCGD CCCN1CC[C@@H](CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 919795905 BUCHHMWJKHORKU-IBGZPJMESA-N 481.619 0.702 50 20 JCGD C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)ccc2Cl)C1 919886834 WLXSLPZQADTNHD-JSGCOSHPSA-N 493.007 0.892 50 20 JCGD CC(=O)N1C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)Oc2ccccc21 920058602 QGQMPLHEOCSEND-OALUTQOASA-N 455.423 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O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccnc(Cl)n1 1810767274 RDPTZLXGBIVZKS-LPHOPBHVSA-N 465.706 0.838 50 20 JCGD Cn1ccc(=O)cc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1811362878 AEAQIUBXIHSFMV-AVRDEDQJSA-N 460.299 0.094 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3Cc4ccccc4CN3)sc2C1)c1cccc(B(O)O)c1 1817030491 LANMELVEYZPMEP-QUCCMNQESA-N 476.367 0.763 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2CCCCC2=O)[nH]n1)c1cccc(B(O)O)c1 1817478821 CABUGVMGGVQSAZ-GOSISDBHSA-N 453.308 0.408 50 20 JCGD Cc1cc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)no1 1819929079 OWUXEQFXXBDORP-NSHDSACASA-N 498.525 0.094 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccnc2c1OCO2 1820122404 GCTYRAALOSDZAO-QGZVFWFLSA-N 463.259 0.833 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)C#Cc3ccc(Cl)cc3)CCO2)C1 1830468800 ZXBXXMNIGAZSIT-XMMPIXPASA-N 497.939 0.460 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2n1 1830731508 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WGROSJAILRKHMK-SFHVURJKSA-N 452.309 0.813 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1 1837011429 BMXCEKSLSALTDN-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1837498990 BZECCUOMKWZRHD-IPELMVKDSA-N 483.345 0.174 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c[nH]c4ccc(OC)nc34)CCO2)C1 1838488900 ALOVWPJAVZRIID-YCRPNKLZSA-N 466.922 0.895 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838498672 APBWSKGKJYYTSN-NRFANRHFSA-N 463.922 0.425 50 20 JCGD O=C(NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1cccs1 1839198137 VFFMYHLVQGSVLB-RHSMWYFYSA-N 478.340 0.625 50 20 JCGD O=C(c1cnn2ncccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198874 DSOZKYAMJDMLAQ-PBHICJAKSA-N 456.272 0.490 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1)n1ccccc1=O 1839200671 OYWJGSRIXWVULK-QIIPPGSGSA-N 460.300 0.556 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202728 NUORXRZFSMAFCW-WMZOPIPTSA-N 485.347 0.203 50 20 JCGD Cc1cc(F)c(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1839457227 VBLFBSVVRBFWAJ-HSZRJFAPSA-N 474.269 0.337 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839685105 GHCHBNSWMBVFSN-HSMVNMDESA-N 455.277 0.695 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839765613 YMNKJSVHBXRUAS-AVRWGWEMSA-N 484.333 0.454 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1840184655 ZZCWOHPAHVRJBP-HSZRJFAPSA-N 475.521 0.750 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cnc3Cl)C2)C1 1840185643 RJYZEVBXZJTKRD-FQEVSTJZSA-N 471.917 0.317 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3Cl)C2)C1 1840185948 XGEWIUBBSDKFCB-FQEVSTJZSA-N 488.372 0.831 50 20 JCGD CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841353705 KXCXRPVMEFGJGB-OAGGEKHMSA-N 487.981 0.836 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c(F)c(OC)c1F 1843012255 UDHPSTZFZKFKEB-UHFFFAOYSA-N 460.242 0.793 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014069 TZZWUXRQLJWSHV-HKUYNNGSSA-N 489.353 0.779 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cc(CO)on2)C1)NC(=O)NCc1ccccc1 1844820933 JSEOMVWBDANGLJ-UHFFFAOYSA-N 456.503 0.330 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)C2 1846365304 MTPWLHVUHYDSNA-GOSISDBHSA-N 485.990 0.778 50 20 JCGD Cc1nn(C)c(Cl)c1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 22236426 RBDFZGUUDWKOLW-UHFFFAOYSA-N 469.951 0.797 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)NCc1cccc(S(=O)(=O)N2CCCCC2)c1 726272823 SMASAHVRUUPWTF-UHFFFAOYSA-N 463.516 0.715 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 728844728 BUKFADNOBHKILI-UHFFFAOYSA-N 492.533 0.314 50 20 JCGD CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccc21 728845948 PWNYSPWTYMZOMG-UHFFFAOYSA-N 458.544 0.866 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cnc2c(c1)c(O)nc(=O)n2C1CC1 728889482 KRFIWYVFNDNRBI-UHFFFAOYSA-N 450.459 0.300 50 20 JCGD O=C(COC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)c1ccc(Cl)cc1 729946374 CRMVUOFQCWYMSU-UHFFFAOYSA-N 462.802 0.978 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1 731854264 SGSMRIBCHJWRDB-UHFFFAOYSA-N 474.503 0.129 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)C(=O)NC3CC3)ccc2Cl)C[C@@H](C)O1 744463563 LHYPGVFATGLZFJ-PHIMTYICSA-N 458.924 0.178 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCS(=O)(=O)N1CCOCC1 748095245 PHLVOECLDPYZAL-LBPRGKRZSA-N 479.353 0.209 50 20 JCGD O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)c1cccc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)n1 748359042 ZQYSPUNVNLMHTA-SFTDATJTSA-N 487.472 0.611 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccccc1NC(=O)Cn1cnnn1 749277074 CXRMQDFFOVEXPF-UHFFFAOYSA-N 487.860 0.592 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)c1cc([N+](=O)[O-])ccc1I 751203032 ZDFACSGAKDNOHE-UHFFFAOYSA-N 458.168 0.983 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cc(C)no1)N(S(C)(=O)=O)CC2 753136144 NNULNFBZFGIRCV-CQSZACIVSA-N 452.489 0.710 50 20 JCGD NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1 789904097 JTVBZYCWBXKQEW-UHFFFAOYSA-N 471.495 0.900 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1ccc2c(c1)OCCO2 791012578 VTZHPQPEYCLQFL-UHFFFAOYSA-N 453.498 0.615 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)c1 825776596 JMYIMLLRGOTEAJ-UHFFFAOYSA-N 471.333 0.996 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc2c1=O 915190977 XGGSHKUEOYLRCL-UHFFFAOYSA-N 471.495 0.029 50 20 JCGD COc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 915884030 VGFBGXMOIPMQOB-UHFFFAOYSA-N 462.528 0.903 50 20 JCGD CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1 916238008 SSYHZJNMRGOQNT-UHFFFAOYSA-N 487.604 0.229 50 20 JCGD CCN(CCCNC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12)S(C)(=O)=O 918119239 QVROQGSBELWPEG-UHFFFAOYSA-N 452.537 0.593 50 20 JCGD CCO[C@@H](C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 920092940 HVRZJUUGOWXTRJ-INIZCTEOSA-N 470.530 0.636 50 20 JCGD C[C@@H]1CCCN(C(=O)CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 1351923012 ADKSVGRESGFPME-MRXNPFEDSA-N 481.575 0.300 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cccc4ncsc34)C2)C1 1778648323 JHZTYOLOPJUXRK-JOCHJYFZSA-N 451.313 0.733 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779421401 KROSVABHUTWNIK-LBZXFTABSA-N 473.335 0.023 50 20 JCGD O=C(/C=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)NCc1ccco1 1779491188 CWVUJAGVMMVEOR-OHFJIMOUSA-N 453.923 0.566 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(F)cnc1Cl 1779639033 CEHGJNQHRZPUAY-XMSQKQJNSA-N 475.713 0.995 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(OC(F)F)cc3F)C2)C1 1780140312 NJXYJIXOZPDXHJ-QFIPXVFZSA-N 478.232 0.864 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCN(C)C2)C1 1780572083 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COc1ccc(COCC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1784098752 UFBFPQFACUUBFS-HSZRJFAPSA-N 462.547 0.415 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1784555440 VOJNNBLYXFEPHO-ZXDAYAIVSA-N 489.617 0.719 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCCNC(=O)OC(C)(C)C)C2)C1 1785570698 UVQNGNNIFAJQTK-JOCHJYFZSA-N 469.583 0.494 50 20 JCGD CCn1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)n1 1786172181 GFSHQBKHDZWJMP-LVWMUPNFSA-N 455.519 0.630 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1 1786338090 YXMRXBYBWHZXEW-CQSZACIVSA-N 488.570 0.761 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786407719 NQFFNGMBNSIPLB-BZSNNMDCSA-N 495.411 0.447 50 20 JCGD Cc1nc2ccccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786979647 HLAIBLDXCZSHPB-IHPCNDPISA-N 462.315 0.230 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)C[C@@H]21 1787508855 WWAXFEUXZDSIDW-LWRXTNCFSA-N 470.574 0.440 50 20 JCGD COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1C 1788610908 DMHYCRQKRHKXMW-ZRCAFCQKSA-N 467.526 0.909 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccncc3)C[C@@H]21 1788611732 WMMKNVUUJPDIRM-JVPBZIDWSA-N 470.555 0.466 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cn4c(nc3=O)SCC4)[C@H]2C1 1789709765 OXCMKNKVZBHDKZ-XIRDDKMYSA-N 480.663 0.723 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1792618909 KOGHDSFNTVFMHC-PLACYPQZSA-N 472.590 0.886 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)ncn1 1793486707 AWULJIHUXDMWJK-LMWOUKEDSA-N 469.926 0.518 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1794328323 RFIZXXFBRJISGC-OPMZPASUSA-N 490.325 0.083 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1nnc(C)s1 1795821924 KYNYOXOFNQEPFF-FKBANKNKSA-N 459.532 0.113 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc2c(Cl)cccn12 1796062374 FMQHLGFEMPMOMR-CCWDJLKJSA-N 468.706 0.185 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)cnc2c1 1797067282 QODKRHSEIKNYNJ-ZSBFGKGUSA-N 463.332 0.991 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccc(C#N)cc12 1799882562 XBKNJIJVCDHFMD-UIZNVDRRSA-N 488.508 0.772 50 20 JCGD O=C1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)Cc2ccccc2)N1 1800436096 QRFLUKVZKCVXDI-OYNZLANYSA-N 464.360 0.861 50 20 JCGD COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1801072606 WWMRDDQIBSRPPC-OVZJUGGFSA-N 475.546 0.834 50 20 JCGD COc1ccc([C@H](O)C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1 1802799942 ZHJCFWCGCBWJNE-HUVFLSCGSA-N 489.337 0.823 50 20 JCGD 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)CN)n[nH]1 1818011651 ISHSUJCORSWJIY-FPMFFAJLSA-N 457.963 0.820 50 20 JCGD O=C1COc2ccc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3ccc(B(O)O)cc3)CC4)cc2N1 1819146290 IBKDHTPAGWQLFV-OAHLLOKOSA-N 492.322 0.693 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401510 FKNXEJSUNGABAB-QGZVFWFLSA-N 470.534 0.876 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793648 QWPUFKXCGJOJGS-WDEREUQCSA-N 480.572 0.048 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ccccc3n(C)c1=O)CC2 1826085906 FUXDJZMOHHRQNZ-CYBMUJFWSA-N 497.581 0.989 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=N)N)CCN2C(=O)OCc2ccccc2)C1 1828974954 QXKXYBXBIVWUAC-VGOFRKELSA-N 494.980 0.175 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nsnc3NC)CCO2)C1 1829758654 MJYASAJZTWKSNM-BZNIZROVSA-N 462.370 0.823 50 20 JCGD O=C(c1cccc(-c2cnccn2)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731541 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1 1835117657 ITKHIXAYZHHUPN-BJRSOBTISA-N 455.563 0.220 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccc2c1OCC2 1835286267 LDLOJULNNLBXGO-UHFFFAOYSA-N 477.370 0.800 50 20 JCGD CC(=O)O[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)C 1835648876 MYYBNNMZRJKHJL-QFIPXVFZSA-N 473.379 0.139 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)COC(=O)C(F)(F)F)CC2)CC1 1835688014 XGVHFXNNAFMLEA-CQSZACIVSA-N 457.877 0.917 50 20 JCGD O=C(CCc1ccsc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836004788 RNOSCKUQEUCADK-JOCHJYFZSA-N 458.345 0.131 50 20 JCGD COc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1OC 1836207377 BSEWENPXGFJIHF-MRXNPFEDSA-N 454.955 0.884 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@@H]1SC(=N)NC1=O 1836718079 RQOPMYYADRUGMR-CQDKDKBSSA-N 460.984 0.387 50 20 JCGD O=C(c1cnn2cccnc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1836848506 QMIFDGMCCAPQJX-DYVFJYSZSA-N 456.272 0.490 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3sccc3[nH]1)CCO2 1837132497 BUDKEWVTTAYZAL-OAQYLSRUSA-N 463.560 0.672 50 20 JCGD Cc1ccn2ncc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c2c1 1837457424 AKTRRFWSXDYHNJ-DEOSSOPVSA-N 493.524 0.025 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1 1837493700 RSUOISUIQQZZMI-OXJNMPFZSA-N 457.365 0.925 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200841 QOGWKXYYNRRKFC-SUMWQHHRSA-N 489.323 0.517 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1839202173 WJHIOPIEVWNZFU-ZLHSVIROSA-N 476.343 0.534 50 20 JCGD COc1ccc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1839358648 JQQZYZPISZNOGC-XMMPIXPASA-N 468.315 0.067 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccccc4o3)CCO2)C1 1839502216 ISAVJUBLDJQHHH-QHCPKHFHSA-N 480.481 0.210 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCSC(=N)N)C2)C1 1839963345 IICQPEWBXAEAJN-BLLLJJGKSA-N 451.387 0.633 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCSC)C2)C1 1839967087 ZNPBUJORGKUMRJ-VBQJREDUSA-N 453.399 0.730 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1840032578 CMNFWSOURFUETI-ZUOKHONESA-N 481.347 0.909 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(OC)c(O)c3)C2)C1 1840149477 QNTWNLZYFUKSIK-IIBYNOLFSA-N 456.923 0.654 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1840154799 GZLCRUCNMGZLLD-DYESRHJHSA-N 469.970 0.042 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)NC(=O)c3ccccc3)C2)C1 1840156779 TUCYSLLBGGDDJZ-TVTNDZMWSA-N 467.950 0.515 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4sc(N)nc4c3)C2)C1 1840184062 PPCGYIWNXFSEFU-JOCHJYFZSA-N 490.586 0.322 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4c(Cl)cccc4n3)C2)C1 1840184463 ONNHZZOYVBTXRE-JOCHJYFZSA-N 492.964 0.431 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)C1 1840219071 APPSHFVLWNCFON-PMACEKPBSA-N 496.388 0.618 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CC3(O)CCC3)CCO2)C1 1840593771 MRQSAMILLWBXMQ-AOMKIAJQSA-N 489.997 0.880 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@H]2CC(=O)N(C3CCCC3)C2)C1 1841858677 RNXLROPTNBFGEI-HNNXBMFYSA-N 454.531 0.293 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccnc(Br)c1)C2 1844264680 WOPVIEQOHAIHFH-UHFFFAOYSA-N 459.304 0.973 50 20 JCGD O=C([C@@H](O)N1CCOCC1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1 1845941599 HKDRLDLTPVLTMS-IEBWSBKVSA-N 466.376 0.847 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)CO2)C1 1846120277 LGKZYJVTZWXSHU-GOSISDBHSA-N 499.373 0.209 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2=NOC3(C2)CN(C(=O)OC(C)(C)C)C3)C1 1846123588 IDVWNYAXVYKRIB-UHFFFAOYSA-N 492.577 0.329 50 20 JCGD Cn1c(=O)n(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2ccccc21 14236652 ILZMCIJFDBXFJX-UHFFFAOYSA-N 457.512 0.586 50 20 JCGD NC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 16726281 LDYZJSNWUGNGMS-UHFFFAOYSA-N 452.514 0.193 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)[C@H]1COc2ccccc2O1 21191515 RPZNZZGLVZFZPC-CRAIPNDOSA-N 495.941 0.861 50 20 JCGD COCCCNC(=S)N(C)NC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2 726076848 GUQBDQKNKIAISG-UHFFFAOYSA-N 474.605 0.780 50 20 JCGD CCCn1c(CCC(=O)NNC(=O)C(=O)NC(C)C)nc2cc(S(=O)(=O)N3CCCC3)ccc21 726614087 QQRDSYSZTGSWOV-UHFFFAOYSA-N 492.602 0.835 50 20 JCGD CN(C)N(C(=O)CS(=O)(=O)Cc1cccc(Br)c1)[C@H]1CCS(=O)(=O)C1 728162289 VGSUTKPKZLQWBQ-AWEZNQCLSA-N 453.380 0.856 50 20 JCGD C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)C2=O 728213196 UTGADKASAZYVCH-KSFYIVLOSA-N 492.602 0.567 50 20 JCGD COC(=O)NCCCC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 730830321 RCGVRSKOUYLOLG-OAHLLOKOSA-N 486.547 0.236 50 20 JCGD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)C1 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O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc([N+](=O)[O-])[nH]1 1780233115 OPNIRCJIFPEHEE-DYESRHJHSA-N 456.264 0.044 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccn1 1780323918 SVSHHSLIAYOUEM-QFIPXVFZSA-N 461.519 0.075 50 20 JCGD Cc1ccn(CC(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n1 1780968382 FLDSRLVTYKCOHS-XMMPIXPASA-N 483.573 0.368 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1781178495 DDZCQFIKIMSIFA-VWLOTQADSA-N 477.301 0.740 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CCOC1 1781308307 LZSSKOUFXWFKPX-VHKYSDTDSA-N 461.943 0.100 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2 1782072112 CNELIPBWIRAQQI-IMFGXOCKSA-N 468.950 0.731 50 20 JCGD O=C1CC(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)=NN1 1783023406 VHXFZPNNRWEQJF-YWZLYKJASA-N 463.332 0.698 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1783880388 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COc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834801017 HSSGXDMZZUBOFX-UHFFFAOYSA-N 479.386 0.803 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1 1835024240 XXYROIDSTSGXOF-HSZRJFAPSA-N 471.489 0.137 50 20 JCGD CC(=O)O[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)C 1835648875 MYYBNNMZRJKHJL-JOCHJYFZSA-N 473.379 0.139 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CC34CCCN3CCC4)CC2)CC1 1835738177 KSRQIINUZJJBDU-UHFFFAOYSA-N 497.644 0.889 50 20 JCGD Cc1ncncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738198 XOHOQVLNCOOBJL-UHFFFAOYSA-N 466.546 0.283 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1835763165 DWJPQNFXLLTXCC-OAQYLSRUSA-N 456.660 0.060 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CCCC3)C2)C1 1835926173 HYZKMBDBXCTNTM-AREMUKBSSA-N 492.381 0.948 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)C3(c4ccc(F)cc4)CC3)C2)C1 1835934284 STRDNNWNMGZWFF-XMMPIXPASA-N 482.317 0.307 50 20 JCGD CCOc1ccsc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837455867 GKAIYNHMRNTWIG-JOCHJYFZSA-N 489.554 0.529 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1 1837459450 PLCBKOHWADGXJQ-VWLOTQADSA-N 490.520 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccncn3)CC2)CC1 1838116050 GVQLNDBIVMBXSQ-UHFFFAOYSA-N 453.503 0.401 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ncon3)CCO2)C1 1838319744 KBMAXIZXSTVBNO-HXUWFJFHSA-N 475.414 0.287 50 20 JCGD COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1838928581 IGGPYYZZEPFASA-QHCPKHFHSA-N 469.498 0.078 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1839148122 NESYGEBJQJLXCQ-MRUHUIDDSA-N 452.939 0.674 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)[S@](=O)c1ccccc1 1839670824 CJWPKPFPVTVHCX-XUAWYVHWSA-N 458.964 0.239 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4[C@@H]3O)C2)C1 1840149954 CMKOGJJOWCATGH-NVJIOZQYSA-N 466.962 0.993 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C2)C1 1840184358 HXKAZMJLZPAPRD-YKSBVNFPSA-N 487.557 0.333 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1840550853 UMPVEBHAFOUGQA-IHSQGBLNSA-N 497.520 0.763 50 20 JCGD CN1CCN(CCC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1 1841924345 AOMWDKAGKLHYFB-KRWDZBQOSA-N 472.030 0.959 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1844692856 RZKLIYRCOXZPSF-KRWDZBQOSA-N 462.459 0.488 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039020 UXHOSXAAJXZKNE-QGZVFWFLSA-N 473.578 0.244 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846483842 HXGWBALQLFYLRL-QGZVFWFLSA-N 471.319 0.110 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CNC(=O)CCC(C)C)N(S(C)(=O)=O)CC2 727484585 NXBGHZWMHXVZIH-QGZVFWFLSA-N 498.602 0.653 50 20 JCGD C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)C(=O)NC3CC3)ccc2Cl)C[C@@H](C)O1 744463556 LHYPGVFATGLZFJ-GHMZBOCLSA-N 458.924 0.178 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCN3Cc4ccccc4C3)nc2)CC1 744886260 ZJHAUIBRANZKTG-UHFFFAOYSA-N 459.576 0.660 50 20 JCGD COCCCCC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 746863770 ARERWNJJDLMNNP-INIZCTEOSA-N 457.549 0.917 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)CCOc2ccccc2)cc1[C@]1(C)NC(=O)NC1=O 747076354 CCDUBZTZUJVSJK-FQEVSTJZSA-N 462.484 0.528 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)CN1C(=O)c2ccc(Br)cc2C1=O 751210187 ZNJUVDGGRPXUOO-UHFFFAOYSA-N 465.285 0.684 50 20 JCGD COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)CN1CCCC1=O 789857480 URPHKMBKCWIWCT-UHFFFAOYSA-N 450.451 0.875 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1)c1nn(-c2ccccc2)cc1O 818515829 COYRNAGTGHTTOB-UHFFFAOYSA-N 477.524 0.735 50 20 JCGD CCc1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1S(=O)(=O)N1CCOCC1 914437932 RHSNUYKFOHOYQK-QGZVFWFLSA-N 459.590 0.376 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1)c1cccc(S(=O)(=O)N2CCCC2)c1 914709884 BJVWQLITWDOBBA-ZDUSSCGKSA-N 462.450 0.643 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccc(F)cc2)o1 915189681 XBNCGRYKCRXUQR-OAHLLOKOSA-N 483.474 0.975 50 20 JCGD COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C 916418695 JXTQKIPBZFLFOT-JDZKTDJGSA-N 466.516 0.214 50 20 JCGD CN(CCCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)S(C)(=O)=O 916580032 BCTMIYDMIIVNOV-UHFFFAOYSA-N 486.558 0.614 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCS(=O)(=O)Cc2ccccc2)cc1 916635967 IVTJZFGVVPDLJD-UHFFFAOYSA-N 482.584 0.561 50 20 JCGD O=C(NNC(=O)N1CCN(CC(=O)N2CCc3ccccc32)CC1)c1csc(N2CCOCC2)n1 918001523 AOLMZUIBUINFNI-UHFFFAOYSA-N 499.597 0.541 50 20 JCGD O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O 918552035 JVMHFPBFBFDXNM-KBXCAEBGSA-N 487.490 0.611 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1 920432127 KVFUDUGRKRRRSB-UHFFFAOYSA-N 459.484 0.559 50 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C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)CCO2)C1 1783540602 ZNSTWKXZYJOMLP-GXNBUGAJSA-N 490.395 0.970 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1783767165 XQAVWOPREOGCJU-DVECYGJZSA-N 487.362 0.279 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(-n2nccn2)c1 1783935379 ONZBZJKUWOUMMG-HSZRJFAPSA-N 469.546 0.392 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(OCC(F)(F)F)n1)CCO2 1783935754 CVWSSYZDDUEVQO-HXUWFJFHSA-N 487.479 0.839 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1 1785229136 QORNZUJUJAITQJ-IFXJQAMLSA-N 462.927 0.927 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785510649 VOOKJFBHFPYLPK-ZMTJCJBESA-N 462.503 0.020 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccoc4C3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978761 RBCCAGBHQXPTEO-RQIDZSJNSA-N 452.316 0.358 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)nc1 1786984586 QHDRODRLURLHDE-NYVOZVTQSA-N 451.332 0.296 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c(=O)cn3)[C@H]2C1 1789296250 ZMBFEHWRUYZASH-AXHNFQJDSA-N 485.453 0.511 50 20 JCGD O=C(Cc1ccc(Br)nc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1789677085 GVZIXLGMRASUTA-AJNGGQMLSA-N 460.756 0.966 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789923504 QVRMJAOIDWQABQ-RMEBNNNOSA-N 496.374 0.932 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H](O)CN3)C[C@@H]21 1790694305 PXPLNLXVKAWXLR-FYIKIXLWSA-N 460.481 0.574 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790726732 NTWRXNHVPCUJQT-CQOCVSQPSA-N 468.334 0.978 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C[C@@H]21 1791288043 PKIMUWZXFBDXIW-IHPCNDPISA-N 475.546 0.880 50 20 JCGD O=C(CCc1cccc(O)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791398860 YSBLCGPMGPCHHY-NYVOZVTQSA-N 452.316 0.298 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)CS(C)(=O)=O 1793596568 UUBOZKLVZUWHJC-OTLZKRIBSA-N 451.549 0.439 50 20 JCGD Cc1ccc(C)c(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1793813159 KAJFMOUYQGQERI-FAQVEIGNSA-N 467.526 0.584 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCOC1=O)C2 1793878360 XACAOZBJBSBZKR-FQLMCAECSA-N 474.942 0.160 50 20 JCGD COCCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1795783961 MSKBTJVRZGZKKV-ACDBMABISA-N 461.563 0.634 50 20 JCGD CCn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cc1C 1796441757 YUFQYHQYAMUUAG-ZPHZMXASSA-N 455.519 0.549 50 20 JCGD Cc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)c1 1796532317 ZVKVGOYUIMMLLJ-JHDGKUDLSA-N 480.569 0.939 50 20 JCGD CC(=O)Nc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)ccn1 1796745718 NFWANVBGKHSBRY-NSAWHWOWSA-N 481.513 0.377 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)n1 1797910956 IDHNSESPIZTABU-JJAZEVLHSA-N 469.380 0.907 50 20 JCGD CC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)c1ccc(F)cc1 1798441673 CKNGWEDNLOYRCS-NYUBLWNDSA-N 482.516 0.953 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799347579 QMCLWAWQSPBRBW-AIEDFZFUSA-N 494.358 0.902 50 20 JCGD CN(C)c1c(F)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1F 1799833352 WMMZUXBFRDIVHZ-CWPLJXCYSA-N 473.285 0.228 50 20 JCGD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1)N1CCN(C)CC1 1799869844 QNAQYNSMZHPQQC-XBYSBRQOSA-N 499.660 0.607 50 20 JCGD Cc1cc2[nH]c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)cc2s1 1799947918 YIJAIQUQULDEIR-YVWYUNDQSA-N 453.329 0.735 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)N1 1800161528 IWIMDAABWRCMBC-WCSPYGGUSA-N 491.383 0.495 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)N1CCOCC1)C2 1800333458 VYIGBLLUTLGAPX-JZUMQHEFSA-N 476.480 0.112 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373113 NATCRLVJAWGYEY-NQIIRXRSSA-N 482.346 0.606 50 20 JCGD Cc1cnn(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1 1810303615 SYHMQWPVARZYAX-UTKZUKDTSA-N 462.514 0.605 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1 1813075216 XXAOYJJQDQRBNA-UZUQRXQVSA-N 469.546 0.589 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3)sc2C1)NC(=O)NCc1ccccc1 1814055675 AREGTOYATLQGRB-RDJZCZTQSA-N 499.597 0.680 50 20 JCGD Cc1nc(N)sc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1815142169 YTQOMQNZRVDFJF-LBPRGKRZSA-N 457.346 0.710 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1815233441 XGIBMGFYCUZRPC-ZFWWWQNUSA-N 456.569 0.456 50 20 JCGD O=C1Cc2cccc(C(=O)N[C@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)c2N1 1815360092 LYIJUTUJVACUNJ-HNNXBMFYSA-N 476.323 0.857 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCN(C)CC2)n[nH]1 1818912613 VQPSNLIIXAFZJF-JHKMYFMNSA-N 483.577 0.783 50 20 JCGD CC(C)CNC(=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819402664 FZDQGSRZNYQAKW-MRXNPFEDSA-N 456.507 0.486 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819798115 WKFPEVPWWUIXCT-NEPJUHHUSA-N 481.542 0.658 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnc2c(c1)CCNCC2 1821700774 KJFFDHIRBFSNQH-QFIPXVFZSA-N 488.357 0.792 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)sc2C1)c1cccc(B(O)O)c1 1822621934 GBNWTOYHDWKZFR-UAGQMJEPSA-N 482.371 0.450 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)CC2 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COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1831299713 DUXZRHJAOAOWJI-FXSPECFOSA-N 494.353 0.249 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1831446711 MYQKTWSCGRCJKD-DLBZAZTESA-N 457.376 0.585 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1831687130 JYJFPVKOENCMIG-IFXJQAMLSA-N 462.385 0.636 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2 1831705250 VGUADJWROPNPDG-MHJFOBGBSA-N 476.496 0.548 50 20 JCGD Cc1cccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1832238601 JEPXXLVJCDQLFH-VWLOTQADSA-N 466.343 0.378 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1 1833032219 YQHZTUKZNLLKKX-FQEVSTJZSA-N 469.636 0.786 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1 1833615193 PICSCJMHWSIFAC-IERDGZPVSA-N 497.390 0.772 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)no1 1834252225 SHOKHOCYFDVVJP-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD O=C(CCBr)NC1CCN(C2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1834421179 NZMKPUURSJCLRF-UHFFFAOYSA-N 469.317 0.068 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834720182 YYUWZZSPYBPEIL-GOSISDBHSA-N 479.390 0.447 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(C4CC4)on3)CC2)CC1)c1cccc(B(O)O)c1 1834800462 HRRIOKHLDUFMQA-UHFFFAOYSA-N 466.347 0.731 50 20 JCGD CC(C)c1nc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)no1 1834819205 IJFKJLXNFJEOJE-SFHVURJKSA-N 459.341 0.977 50 20 JCGD COc1cc(C#N)cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1836124151 LPVMPFHJGLKFCT-UHFFFAOYSA-N 490.369 0.746 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836129879 CGCTVWRXJSEZJS-LIRRHRJNSA-N 472.336 0.639 50 20 JCGD CN1CCCn2nc(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)cc2C1 1836718725 BFTVPPLHNPNMPD-FQEVSTJZSA-N 467.998 0.931 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)NCc1ccco1 1837636846 OWACMJMUTDQWDW-GNAXCBTBSA-N 460.314 0.712 50 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(n2)NC(=O)CC3)C1 1843232361 VTQHCEIZTOWERH-MZJWZYIUSA-N 463.498 0.917 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cn3[nH]cnc(=O)c3c1C)C2 1843416560 XVNOCCWOEKKDAP-VULFUBBASA-N 464.486 0.282 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(N3CCOCC3)cc2)C1 1843447975 UQZBEUSJLBWJTN-UHFFFAOYSA-N 464.526 0.653 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1846559988 MHLSIQRPZISQQQ-SJORKVTESA-N 496.996 0.792 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCC(=O)NN(C)C)cc1 1847583337 ZTIPCAUGGYXKFD-WDSOQIARSA-N 479.603 0.237 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)CNC(N)=O)ccc1Cl 725906907 IHWNNKSPRDFDFL-UHFFFAOYSA-N 455.880 0.579 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(CS(C)(=O)=O)cc3)cc2)CC1 728213329 YDQGRAFSHQGOMG-UHFFFAOYSA-N 466.585 0.924 50 20 JCGD CCc1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1-c1ccccn1 728325159 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NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)ccc3c1OCO3)C2 1797750823 RHSYODZKPMROEI-KSPBDQMDSA-N 487.900 0.584 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(OC)c1 1798822610 CBRFGKSBBYWOSW-VTEUUUEMSA-N 469.498 0.219 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1799277227 VWGVYWQTBFGBQL-FCIKYMEBSA-N 475.398 0.717 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1800281363 AWAOREIBAKRFKZ-DRXBFXEBSA-N 457.281 0.131 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1-n1nccn1 1800580713 SKGARGAPYHVHBG-MUJYYYPQSA-N 460.498 0.831 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2 1800637725 HDMZYYIGAGCBET-JITAAIDCSA-N 496.402 0.929 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1800769103 QBBMKWJDIYPWHW-UHDSXZAQSA-N 459.971 0.823 50 20 JCGD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)[S@@](=O)c1ccccc1 1801276530 UCIQYGRUWFQRLK-ILDDHWCASA-N 454.357 0.815 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1 1804199428 XKWUQIFDCAWPQC-BHYGNILZSA-N 491.383 0.508 50 20 JCGD C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)CC1 1806699281 DYIMSMZZLZWOQC-MRXNPFEDSA-N 478.453 0.979 50 20 JCGD COCCOCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1806755842 MPAXFKCIWGMPKU-OXJNMPFZSA-N 456.503 0.063 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1807022886 BLESGBPFCCJFJG-IVMMDQJWSA-N 477.296 0.843 50 20 JCGD CC(C)(C)NCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1807098776 TUANUDKELCXGPS-JXFKEZNVSA-N 453.547 0.788 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnc(N)s2)[C@H]1c1cccnc1 1807275438 YVXKTSKYRKTRME-SUMWQHHRSA-N 466.527 0.752 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361826 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COc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1OC 1811645212 QJKJLUHXGFRQCN-XMSQKQJNSA-N 490.325 0.807 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813069695 AAHIYEOOAAAUSB-SFGWALBWSA-N 455.563 0.993 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1 1813072150 ASZWIPUAEIDSMA-JXFKEZNVSA-N 468.514 0.898 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813407271 MKEKGCZURLTIPT-XTQVGHSUSA-N 474.326 0.944 50 20 JCGD COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815336951 IALVJIVPRSXOPN-HNNXBMFYSA-N 452.301 0.766 50 20 JCGD CCOC(=O)c1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)ccn1 1815360890 QGZUEGHKZDUXGT-MRXNPFEDSA-N 494.338 0.934 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361768 RGOUBZUPDNUXHC-WMZOPIPTSA-N 456.377 0.922 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)c2cccnc2)[nH]n1 1819401981 ZMZXKKURUJYOOQ-GOSISDBHSA-N 491.512 0.539 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1nnc3ccccc31)CC2 1819792877 DEVCQSPHHRMBCF-LBPRGKRZSA-N 491.537 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=N/N1CCCCC1)CC2 1819798029 QTAOXHXGOYYQGY-LFWZTCNZSA-N 470.559 0.839 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)C(F)(F)F)CC2 1819799662 FFHPPQJGHGHUJY-QMMMGPOBSA-N 485.448 0.046 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cccn(C(F)F)c3=O)sc2C1)c1cccc(B(O)O)c1 1820254065 NKLWKRKRPWIMNZ-ZDUSSCGKSA-N 488.281 0.919 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2 1824542688 IAVRUPCODKKBCF-WDMOLILDSA-N 451.936 0.868 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)C3CCC4(CC3)OCCO4)sc2C1)c1ccc(B(O)O)cc1 1824899308 FKEIELJVARMWRA-QGZVFWFLSA-N 485.371 0.982 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)[C@@H]1SC(=N)NC1=O 1827667525 HMNFOOWFNIHDSX-JVPBZIDWSA-N 486.403 0.402 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CNC(=N)N)C2)C1 1829341008 VEAUGECEYYFANY-VGSWGCGISA-N 494.980 0.175 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cccnn3n2)CC1 1829565578 LINYLANXZDQRNV-QFIPXVFZSA-N 461.331 0.956 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2 1829840117 ZBDWBSVBILXDHV-DEOSSOPVSA-N 464.327 0.168 50 20 JCGD O=C(c1cc(Br)ncc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728090 OXMBBMDWGRFSNV-CXAGYDPISA-N 480.718 0.653 50 20 JCGD O=C(c1ccc(CCN2CCCC2)nc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728959 ZITHGLFQRJJYQF-OFNKIYASSA-N 480.993 0.390 50 20 JCGD O=C(c1ncccc1Br)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731299 ISISUVUNCBNGJJ-SUMWQHHRSA-N 462.728 0.514 50 20 JCGD C[C@@H](Sc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1831164129 IAWQMTZEKVGMEK-JPYJTQIMSA-N 478.615 0.997 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1ccc(B(O)O)cc1 1834798397 PJXAQRNTNHMKNZ-KRWDZBQOSA-N 470.148 0.242 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1835083144 QPMNTOSTHCSUBV-XMMPIXPASA-N 467.526 0.306 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C3=COCC3)CC2)CC1 1835117962 BQOOQOLTUQJCRB-WGOQTCKBSA-N 456.547 0.996 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CC3(F)F)CC2)CC1 1835449899 DYGOCMXSCDWZQD-QGZVFWFLSA-N 450.490 0.526 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(F)c1 1835939433 QLQNXRDLNZWHTD-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n(C)n1 1835957755 FFHPFEXILHKRDD-UHFFFAOYSA-N 461.611 0.541 50 20 JCGD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c(O)n1 1836150733 ZDNCCTDMHJHEHY-UHFFFAOYSA-N 466.347 0.274 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)n(-c2cccc(=O)n2C)n1 1836259534 FKDWPRZSXZNAKQ-NQIIRXRSSA-N 481.912 0.484 50 20 JCGD COC(=O)C12CCC(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)(CC1)CC2 1836705987 FTKHTQRIYOLDEN-QGFHRSQPSA-N 472.966 0.556 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837429372 VNNPLNJTPVYXSP-DEOSSOPVSA-N 486.450 0.488 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1837483025 HXTBWKUIWNIEQF-JVPBZIDWSA-N 460.362 0.970 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838527142 JNOSFFRTLIPFJX-HJPURHCSSA-N 489.481 0.628 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F 1838916453 UQBFAZGZUKMSFN-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3C3CC3)C2)C1)NC(=O)NCc1ccccc1 1839054273 QTALIBOWQDAZQG-TVZXLZGTSA-N 499.612 0.835 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1839144990 PXSMARSUTMDZBP-OPAMFIHVSA-N 464.950 0.964 50 20 JCGD O=C(Cn1cc(Cl)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199102 JDGSGUNEEHTAPR-UKRRQHHQSA-N 453.696 0.683 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccn1 1839200963 PPWAANHBIHOOMI-CRAIPNDOSA-N 473.299 0.801 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(NC(C)=O)c1ccccc1F)CCO2 1839233737 LJHXDPOLTRNIOU-SXSPYAJSSA-N 499.967 0.887 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ccoc4cn3)CCO2)C1 1839485793 XMBFRPNTXNOQCX-QHCPKHFHSA-N 480.481 0.210 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1 1840153751 AODFPQWHOOHFIL-LAUBAEHRSA-N 463.922 0.591 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4cc(C)ccn34)C2)C1 1840155041 NSXVWBDACKAWDN-IIBYNOLFSA-N 450.923 0.967 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1 1840185538 SZRREXOCZTUQKD-DEOSSOPVSA-N 476.574 0.755 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840190043 AMBMHBHZGQZCLX-BUXKBTBVSA-N 497.376 0.015 50 20 JCGD C[C@H]1Oc2ccc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)cc2NC1=O 1844264695 XZXFEYQQBFWSDP-CYBMUJFWSA-N 464.482 0.535 50 20 JCGD O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)[C@@H]1COc2ccccc2O1 725906171 WUYCJYKQVIAGGH-XUWXXGDYSA-N 481.914 0.451 50 20 JCGD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])c1 727608220 NWFCYNXSAACYMD-GFCCVEGCSA-N 451.461 0.973 50 20 JCGD COC(=O)[C@@H]1CN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CCO1 728539351 HOWDVFHDDDDKBW-SKTWIKFTSA-N 467.482 0.741 50 20 JCGD NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)COc3ccccc3O)c2)C1 731118780 VPVCLRUYYJSTOB-SFHVURJKSA-N 455.515 0.999 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1cccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1 745992651 GNTLJNBFXQZNBE-UHFFFAOYSA-N 487.582 0.880 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)n1 760768912 GKPGCWJWQSCUEL-UHFFFAOYSA-N 495.564 0.610 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C)c1 879296994 FNZSHMOKPWEVIX-UHFFFAOYSA-N 474.499 0.139 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(=O)n(Cc2ccccc2)n1 912848859 INKVHPBAXHGFQW-UHFFFAOYSA-N 454.512 0.968 50 20 JCGD CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc(C3CC3)nc21 914340046 ZPOLMECJIMRADG-UHFFFAOYSA-N 485.526 0.762 50 20 JCGD Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c(C)c12 914846584 QCQDKPMEIHWZFD-UHFFFAOYSA-N 474.543 0.523 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccc(C)cc2)c2ccccc2c1=O 916278592 WGVSBDXRIDWPGH-UHFFFAOYSA-N 472.527 0.647 50 20 JCGD COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1 918779207 GPMPKEVTHQJTTN-UHFFFAOYSA-N 450.459 0.483 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1 1778022072 COMBPPPZKDDYKW-FGBSKUFISA-N 451.923 0.920 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c(Br)cnn2C)C1 1778409369 WKDZHIKWSVGLCU-FOIQADDNSA-N 499.410 0.683 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cn3ccc4sccc4c3=O)CCO2)C1 1779029554 ZCHFTCHOXMUICQ-QHCPKHFHSA-N 496.549 0.205 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2 1779198929 YXPZGBAKSCDKCD-YRWGSWDYSA-N 464.357 0.596 50 20 JCGD CCc1noc(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372212 BSKYXNRAKKGNDJ-WZONZLPQSA-N 470.530 0.985 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779564322 MWCRQVOYCAQESZ-WPSZSDGUSA-N 466.347 0.390 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc(C)c(O)nc1=O)C2 1781904235 LOFIECWSHUWPEW-STXHMFSFSA-N 485.379 0.945 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2 1782166244 CBDQPTTVIAJRTE-DNNXHKROSA-N 496.004 0.934 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)n1cnnn1 1782866568 CVBYTFJVCCBZLK-MYXQPPCBSA-N 457.441 0.949 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2cc(C)c(O)nc2=O)C1 1783118104 IUYVFYGEYCDCHS-STXHMFSFSA-N 485.379 0.945 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1783255121 SZLRBIDAPUTJGX-VXCZRNDOSA-N 451.951 0.919 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)cc2)CC1 1784084025 KGMOWXWXCILTHY-WJMWBRGCSA-N 464.994 0.631 50 20 JCGD Cc1ccncc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786980080 GXHBMLYCMLTBQL-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508128 HNFSOOUBSVUYRZ-XPWOUSNISA-N 499.568 0.856 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nccnc4c3)[C@H]2C1 1788027737 KIJOLFBHMZBKBF-XERREHJYSA-N 475.509 0.535 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCC2)cc1)c1cccc(B(O)O)c1 1788143919 VTEGKQCUKTWOJD-UHFFFAOYSA-N 494.338 0.579 50 20 JCGD CCOC(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)OCC 1788610809 ATAGBFUHIRCAOS-WBAXXEDZSA-N 463.535 0.068 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cccn4)nc3)[C@H]2C1 1788983381 YTQITKDDEBDWMG-VDGAXYAQSA-N 490.524 0.173 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccco3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724994 WBRWRBBKMDIKBP-YDWJEQILSA-N 499.568 0.639 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21)n1ccnn1 1790642418 JXQDLGRFUKFRKD-HZEGPAAWSA-N 498.588 0.165 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)C(=O)C1 1792308398 ITWKAFCSANGFLF-YRBFXIGRSA-N 490.960 0.580 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)CO2)C1 1792984351 YLWPHMCDAIQHKL-SIRPWMCASA-N 487.981 0.202 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C 1793248805 DQYSJSBIZIDUAQ-YYIAUSFCSA-N 469.583 0.273 50 20 JCGD COc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1794729723 LXMMZKWZUYREGS-HATOLVCRSA-N 496.568 0.640 50 20 JCGD Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)cn1 1794747095 IPCXTGSFCDLHJM-FZKCQIBNSA-N 455.943 0.755 50 20 JCGD Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1F 1795732848 MZUQJEQPVNBCIL-BBIADKPPSA-N 454.307 0.650 50 20 JCGD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[S@](=O)c1ccccc1 1796190398 UNAKCSVDMTXTLL-PTHBEVMPSA-N 454.357 0.815 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)C1 1797680550 HBZZRRLBWKLWCN-NEMWNAMBSA-N 459.971 0.842 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(S(C)(=O)=O)CC1 1797705954 VCLXZQSKXHHGGT-XMYAHUOOSA-N 492.602 0.430 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cn2[nH]cnc(=O)c2c1C 1799149952 PUWYASBVWZANKC-CWNKPHDYSA-N 478.513 0.717 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn3c(O)nnc13)C2 1800639935 QSFOTVQTPPMLOK-XCCSTKFXSA-N 452.309 0.812 50 20 JCGD C#CCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1800994064 GDOZQJZHTSXGIN-JHDGKUDLSA-N 455.559 0.726 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801013052 SMGKRTFDXHWVBC-NSAZKJPHSA-N 489.573 0.264 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCn1ccnc1)NC(=O)NCc1ccccc1 1801306573 UTBZHGBFLMUULT-RUMRUAAYSA-N 497.600 0.599 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCBr)C3)N1 1801445691 CEFCPHHCLNSPLR-AIEDFZFUSA-N 487.420 0.590 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803141935 WCTLQTSIFOUTRP-VXNCWWDNSA-N 484.981 0.963 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807363790 QJYJACRALFQDLE-AUSIDOKSSA-N 487.325 0.748 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCCn2ccnc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374060 HVEDYKDWTFTEAG-OFNKIYASSA-N 461.331 0.758 50 20 JCGD Cc1nnsc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1808645942 DLWXHSUESNRGIY-AEFFLSMTSA-N 451.317 0.555 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cncc(O)c2)[C@@H]1c1cccnc1 1812909254 DGGAGXPOQHOBJN-QRWLVFNGSA-N 461.482 0.814 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1 1813071382 PBYXJIXPMGPXAL-WZONZLPQSA-N 454.531 0.322 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCNC(=O)C2)[C@@H]1c1cccnc1 1813134112 MCBLNHKPWDVMSN-WVSGUTMBSA-N 479.541 0.748 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2[C@H]3COC[C@H]32)[C@@H]1c1cccnc1 1813658011 GKHJELMVNJIUGW-NSYSGPAISA-N 450.499 0.292 50 20 JCGD CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n(C)n1 1815360597 JWIOIKQENWRQFT-HNNXBMFYSA-N 453.333 0.658 50 20 JCGD O=C(CNC(=O)c1cccs1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815923977 VDGJGPHZVKWQIL-KRWDZBQOSA-N 481.343 0.887 50 20 JCGD CN1CCN(CCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)CC1 1817153807 RJPAFYFASYGSJI-FQEVSTJZSA-N 468.367 0.033 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1 1817471162 BSYNBOQUUVRKNO-IBGZPJMESA-N 477.286 0.891 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)no1 1817471901 VLMQKFWKCZXFPZ-QGZVFWFLSA-N 480.290 0.721 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(C)C 1817472069 FXMMJMRKIUXCIT-UYAOXDASSA-N 456.308 0.983 50 20 JCGD COCCn1nccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1817587287 WVMLJDUOSWHHIG-HNNXBMFYSA-N 469.332 0.205 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nc[nH]c2[N+](=O)[O-])n[nH]1 1818076520 GPAYSXYTUVEBGD-ZDUSSCGKSA-N 468.434 0.659 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)N1C[C@@H]2C[C@H]2C1 1819290627 YPDANBCUYREUTJ-FKKBTLCVSA-N 451.336 0.736 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819417499 BYSBGHBVPKPIPV-KDOFPFPSSA-N 463.307 0.686 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824395713 GJPFPSSRHWZREQ-DNVCBOLYSA-N 458.563 0.833 50 20 JCGD O=C(CCN1CCOC1=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051711 AETCTNKZSRNIJM-HXUWFJFHSA-N 457.336 0.442 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1830573680 BYZLQFHUCJIOJU-LXIYXOSZSA-N 498.346 0.019 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1830731671 NKALJXQKRCCCBU-IWMITWMQSA-N 493.960 0.392 50 20 JCGD C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732775 AIZUUCSEMHAYHO-PNLZDCPESA-N 489.997 0.902 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCN(Cc3ccccc3)C1)CCO2 1832302468 YWUISDILSQAUKS-YZUZCNPQSA-N 480.005 0.955 50 20 JCGD C[C@H](S)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551423 NSMUZZUXPKJFCU-CKFHNAJUSA-N 466.000 0.893 50 20 JCGD Cc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1833804618 MUPBSRYVNXCXHQ-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD Cc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834801173 SDLXEZQTWNGAGA-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)n1cccc1C=O 1834806090 IGJQTFZCDDXVRJ-GOSISDBHSA-N 480.374 0.427 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)[C@@](C)(Cl)CCl)CC3)CC2)CC1 1835511326 VKPIIWMQZCMOCO-QFIPXVFZSA-N 490.476 0.958 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835822099 XDWVIFMAJYIYFS-KRWDZBQOSA-N 466.627 0.236 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2n1 1835939702 YEXPVPJZQGJIOF-VWLOTQADSA-N 492.341 0.015 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3Cc4ccccc4C3=O)CCO2)C1 1836593677 BXKOSNYANJIOIU-XXBNENTESA-N 479.961 0.743 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837461428 VWIATLOMHOWOJA-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1837841360 BUACDXJCTTUJCH-HOTGVXAUSA-N 461.401 0.751 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922188 VLADNOUTZUVELO-GOSISDBHSA-N 481.358 0.841 50 20 JCGD O=C(c1cc2cccnn2n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1838427126 WTJDONSSMNMZKQ-YOEHRIQHSA-N 456.272 0.490 50 20 JCGD O=C(c1cccc(N2CCOCC2)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839343399 COPRYBKZTLCSMY-DENIHFKCSA-N 467.950 0.193 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)CCO2)C1 1839727177 DQJOUADHYRZEAO-MDAIXWLXSA-N 496.004 0.332 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C(C)(C)C)n3)C2)C1 1840183702 VBADLGVEWGZAFL-JOCHJYFZSA-N 464.567 0.081 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C[C@H]2C[C@H]21 1847079249 USQLVYLKGQZTKB-QRQLOZEOSA-N 469.347 0.581 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)[C@@H](O)C1 1847559886 UZMALJLVCAWYLK-FKAQHNMISA-N 459.971 0.796 50 20 JCGD COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)CC2=O)cc1 726523176 DPJWFDXOMPKBFB-KRWDZBQOSA-N 474.539 0.755 50 20 JCGD COc1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1[N+](=O)[O-] 727659811 UYQGEGMFUUAINV-UHFFFAOYSA-N 478.483 0.628 50 20 JCGD CN(C)N(C(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)[C@@H]1CCS(=O)(=O)C1 728178913 MHYNSJGEKOHTEF-LLVKDONJSA-N 459.468 0.356 50 20 JCGD O=C(CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)[C@@H]1CCS(=O)(=O)C1 728386663 HEDTVKOBYQLTIX-MRXNPFEDSA-N 457.574 0.206 50 20 JCGD CCOC(=O)[C@@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1 728944421 BZWAIGFEDKCFHN-CQSZACIVSA-N 482.563 0.068 50 20 JCGD CS(=O)(=O)CCNC(=S)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 729157903 KWQSEMBDEXWTDL-UHFFFAOYSA-N 459.553 0.598 50 20 JCGD COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1 748696119 BYMDDXMJEHTGDR-UHFFFAOYSA-N 484.575 0.036 50 20 JCGD O=C(COC(=O)CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)[C@H]1COc2ccccc2O1 760426820 OILXZIDXMHUJLB-QGZVFWFLSA-N 497.913 0.539 50 20 JCGD COc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1S(=O)(=O)N1CCCCCC1 789857413 SBGNDQPIXHLLHV-UHFFFAOYSA-N 452.533 0.643 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1C(=O)[C@H]2CCCC[C@H]2C1=O 807726221 CBYFIZPZLOKMOY-BETUJISGSA-N 451.863 0.828 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 846756320 WWOKILPKHKXLMY-GOSISDBHSA-N 491.522 0.502 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1ccc(Br)s1 914831418 LNYBYWXFOSFDLZ-BDAKNGLRSA-N 450.336 0.307 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1 916104617 OLXYSHLLLNNRCT-UHFFFAOYSA-N 470.485 0.239 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(C(C)C)[nH]n1)c(=O)n2Cc1ccccc1 918016841 KREGSKSNKXEYBB-UHFFFAOYSA-N 478.513 0.736 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(OCC(=O)NC3CC3)cc2)c1 918107409 NNAWDFYJPGOOEH-UHFFFAOYSA-N 474.539 0.934 50 20 JCGD C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)CN1CCCC1 918221549 XECIGOFWILVDRN-INIZCTEOSA-N 453.565 0.383 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1cnn(C)c1)N(S(C)(=O)=O)CC2 919792870 OLNUHACTSVIZQM-MRXNPFEDSA-N 480.547 0.217 50 20 JCGD CS(=O)(=O)c1nc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccn12 920275256 RBZITPLNPLHJNX-UHFFFAOYSA-N 450.502 0.106 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1csc(N)n1)C2 1778091605 YGYQGVVGHBGYJX-BYAFEARCSA-N 473.559 0.987 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)ncc1[N+](=O)[O-] 1778247467 GTHZOKYUMNDQMB-NFBKMPQASA-N 482.302 0.419 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1 1779545988 YOUZOTJJOWFUNT-WOIUINJBSA-N 479.654 0.822 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2)NC(=O)NCc1ccccc1 1780968335 ANHJZZYBKUKLOP-XMMPIXPASA-N 468.558 0.856 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)Cc3cncnc3)CCO2)C1)NC(=O)NCc1ccccc1 1780968717 JHUMESDGZVKZHL-DEOSSOPVSA-N 481.557 0.195 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc(O)n3c1CCCC3)C2 1782214119 DNRHGXYRRVSCSE-UZUQRXQVSA-N 476.578 0.426 50 20 JCGD Cc1nccn1CCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214817 ZYRMLAYKJCEUOT-AUSIDOKSSA-N 462.595 0.859 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1784163372 JFYRJNIPYUXBQR-KANFNMMFSA-N 477.945 0.181 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3)[C@H]2C1 1786669776 RCGUCROIRHKUSJ-MVJPYGJCSA-N 453.499 0.012 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786982362 ZTXQSENMISRRPQ-XJABCFGWSA-N 470.306 0.350 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786984787 JUOOHRJTYSGSAN-BUKVSMQUSA-N 496.329 0.248 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ccn3)C[C@@H]21 1788611045 HGOAFYIGFAAFAU-IWEFOYFVSA-N 458.906 0.641 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncon3)[C@H]2C1 1789085087 LQKHWLDDKNZJGL-XUXIUFHCSA-N 457.915 0.795 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)cc2NC1=O 1789260608 MULJQVSICHWHFH-FZZNLJMESA-N 451.907 0.599 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCNC4=O)C[C@@H]21 1789868104 NAFAGUWHAYMNHQ-HCNDDXEMSA-N 472.373 0.846 50 20 JCGD CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1791124068 PEBOSLGEYAKULD-ZWBPQZFFSA-N 489.997 0.326 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)N1CSCSC1 1791290900 CNXMFAMHZLBLIP-QZWWFDLISA-N 473.665 0.382 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cc([N+](=O)[O-])cn1)NC(=O)NCc1ccccc1 1794277178 NQIWEMNHPHFULW-REPLKXPHSA-N 498.544 0.776 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(S(C)(=O)=O)c1 1794320868 NBYQZEOAQUJBEV-JLVBRIDZSA-N 455.609 0.540 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2cc(F)cc(F)c2)[nH]n1 1794468322 DUBUUAXFRVGGFN-YEZVWNJWSA-N 490.511 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccccc1 1795272817 LTHJXFLJMQAPJW-YVWYUNDQSA-N 455.540 0.681 50 20 JCGD Cc1nc(-c2ccccn2)sc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734674 ZGSLQYIKSNXQJY-XEMDLRDOSA-N 492.366 0.710 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc3[nH]ccc3c1)C2)c1cccc(B(O)O)c1 1795740983 UXFXJARDCGSXAB-HATOLVCRSA-N 462.315 0.079 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1 1796190388 TWAGFEHAGXYCGQ-WKCHPHFGSA-N 484.383 0.655 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc2nnc(Br)n2c1 1796191240 ORZNUAMWMKTXAP-BJWYYQGGSA-N 498.146 0.737 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1796301143 OZMMBQBGBUSCAR-PPCPHDFISA-N 468.320 0.152 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1nc(N)n[nH]1 1797628127 RCJAMNNJRDDFGE-YACYFGNPSA-N 471.468 0.794 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-c2cc[nH]n2)cc1 1799698607 RMWZJRFNFGTRCB-OPMZPASUSA-N 454.531 0.653 50 20 JCGD NC(=O)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1802164638 YOWRRWBKVMVMHQ-IVSAIRAKSA-N 453.337 0.251 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O)C2 1802329089 HJLCSILRRQNEPN-XCDZQEORSA-N 495.621 0.616 50 20 JCGD COC(=O)[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C)NC(=O)OC(C)(C)C 1802340046 ZLDQVUPGCNSLAO-YYIAUSFCSA-N 497.593 0.454 50 20 JCGD C[C@](O)(C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(F)(F)F 1803990398 NLHLIVOVBINOMI-SYNHAJSKSA-N 465.237 0.394 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1 1806342238 LINRCELFQJQHGP-SUMWQHHRSA-N 452.309 0.424 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361200 FHIVOUKRGNRRPH-GOEBONIOSA-N 453.201 0.981 50 20 JCGD CCN1CCC(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1807374788 NESXETRETWWKFH-GGAORHGYSA-N 464.375 0.813 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807615726 IJIQXEUZZOLQQT-PZJWPPBQSA-N 496.373 0.994 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1[nH]nc2ccncc12 1808099835 OLYLCGYHSTTZQG-VGOFRKELSA-N 470.298 0.666 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1808302607 HXPVLCMZULIBAQ-HGQUKEQDSA-N 479.328 0.764 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc2n(n1)CCC2 1809982537 SFQVGPGLSRLSIC-XMSQKQJNSA-N 459.315 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1 1810302442 JDIRRSBGAFWGRL-VFNWGFHPSA-N 485.508 0.985 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)n1ccccc1=O 1810514697 BEOVFCHMDGFPJE-DHJUGAMNSA-N 474.326 0.504 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)no2)[C@@H]1c1cccnc1 1810985365 PUFOFBXMVGWNHP-ACJLOTCBSA-N 451.443 0.407 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1 1812118394 JKPCCLDVKWFZNF-OXJNMPFZSA-N 490.524 0.693 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCC(=O)NC2)n[nH]1 1814523936 RVTCQRUXVAMHCL-BLLLJJGKSA-N 454.491 0.240 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1)c1ccc(B(O)O)cc1 1817470540 CUADFGUPCZNKIP-MRXNPFEDSA-N 451.248 0.108 50 20 JCGD COCCn1nccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1817595176 OEEQBGPWKSHTAM-ZDUSSCGKSA-N 463.564 0.585 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)[nH]n1 1818113218 FTFGSKXBFHGDLX-VNURZQNYSA-N 454.491 0.672 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)C#CC(=O)O)n[nH]1)NC(=O)NCc1ccccc1 1822202136 FYZTZQQUPURTQC-SFHVURJKSA-N 481.513 0.836 50 20 JCGD O=C(CN(CCO)CCO)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1 1823008579 FVKWYMOXJIZWCO-TVQRCGJNSA-N 453.334 0.032 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1 1824899742 FSBVOANTDMROBA-CMPFEXHJSA-N 485.545 0.292 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)CC2 1826000138 MMZSOGUPNJKJIE-CHWSQXEVSA-N 479.024 0.981 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)CC2 1826085088 CPZRMZBGEJMGBB-OCCSQVGLSA-N 498.606 0.314 50 20 JCGD COC(OC)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828562574 HDOSCPOWUJHEKQ-VGSWGCGISA-N 483.949 0.657 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731512 KKCNYXDTIGRFSE-MGPUTAFESA-N 465.894 0.110 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830736957 CAIKERLLFGUVNC-PNLZDCPESA-N 489.997 0.690 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)C1 1830881762 JRUSGKQLYYUIKI-MDOVXXIYSA-N 479.933 0.613 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831598895 WUDFFPNCOPKDAV-LRAJWGHMSA-N 490.985 0.086 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)nc1F)CCO2 1833268519 ZZMCFLBKHITJAY-OAQYLSRUSA-N 492.895 0.256 50 20 JCGD Cc1nn2cc(CC(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)nc2s1 1833308598 WLQHVSHHPOPEQH-KRWDZBQOSA-N 469.011 0.813 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(N4CCOCC4)n3)CC2)CC1)[C@@H](O)CCl 1833310527 MAMLNYWVJWDBMA-FQEVSTJZSA-N 480.009 0.703 50 20 JCGD COC(=O)C1(C(=O)N2CCC(N3CCC(NC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CC3)CC2)CC1 1835118073 OFDKQJSBXTWOTM-JVWAILMASA-N 486.573 0.645 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C(=O)c3ccccc3)CC2)CC1 1835737005 QUMOQERFJANJLL-UHFFFAOYSA-N 478.553 0.753 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(CO)c(F)c3)CC2)CC1 1835737465 WPXHDUCYIDOKCR-UHFFFAOYSA-N 498.559 0.816 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)CC1 1835738197 XKUUPCXQYHITFN-QHCPKHFHSA-N 492.580 0.874 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4cc(Cl)ccc34)C2)C1 1835937160 QLAWPQBQMRGDAT-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccn(C(F)F)n3)CC2)CC1 1835955118 AVXDOTFIBMTNJS-UHFFFAOYSA-N 469.537 0.836 50 20 JCGD CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)no1 1837456052 BFAUUNODRISUAT-JOCHJYFZSA-N 472.502 0.180 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CCCO4)C2)C1 1837460867 LGXYCAQJJLBAMY-VWLOTQADSA-N 495.536 0.394 50 20 JCGD O=C1NCc2cc(C(=O)N3CCC(OC4CCN(C(=O)c5cccc(B(O)O)c5)CC4)CC3)ccc21 1837921155 GQTBDJOAJBTQRZ-UHFFFAOYSA-N 491.353 0.536 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839184119 UWKUDQJLPVVSTE-GWJPWWOOSA-N 497.976 0.605 50 20 JCGD O=C1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](Br)Cc4ccccc4)CCO3)C2)N1 1839801936 IOLUXFMWDDVFPX-JBYIUTFZSA-N 494.386 0.728 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1840081800 ITYJUZRKYNEHAS-UGKGYDQZSA-N 495.013 0.547 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4[C@@H]3O)C2)C1 1840182994 YOVARUCAEGFKKM-JHMXWDHMSA-N 488.585 0.112 50 20 JCGD Cc1ccc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1840664973 GLBDNMKEGIPBJZ-DEOSSOPVSA-N 467.526 0.686 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc(C)c1O 1840675354 ZECZCZYBJZSRKS-DEOSSOPVSA-N 468.315 0.073 50 20 JCGD CCOc1c(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cnc2c1cnn2C 1843013816 QRDOMKNZDNWTFP-UHFFFAOYSA-N 463.303 0.178 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(CCN3CCCC3)nc2)C1 1843458330 RDDKZVHAERJNPE-UHFFFAOYSA-N 456.591 0.910 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)C(=O)C(=O)O 1845810504 BWBWXPUKCVQKDD-HNNXBMFYSA-N 466.332 0.739 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCCNC(=N)N)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847563217 KLPXGTVDUOBKFL-VGWMRTNUSA-N 489.017 0.335 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(CS(C)(=O)=O)c2)cc1 17406812 YUCHIOZQGWDUDF-UHFFFAOYSA-N 453.542 0.621 50 20 JCGD O=C(COC(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1)NNC(=O)[C@H]1COc2ccccc2O1 116786929 PTAKTTGWUZYTOC-MAUKXSAKSA-N 460.487 0.445 50 20 JCGD CCCn1nc(C(=O)NNC(=O)c2ccc(OCC(N)=O)c(OC)c2)c2ccccc2c1=O 727975299 WFTKKPJQAOZRMQ-UHFFFAOYSA-N 453.455 0.754 50 20 JCGD Cc1nc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cs1 728575027 KBWALQFIVZFHMN-UHFFFAOYSA-N 468.517 0.127 50 20 JCGD NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2)C1 731047331 QXOLZDHNPGJCPF-NRFANRHFSA-N 494.600 0.921 50 20 JCGD O=C(COC(=O)c1ccccc1S(=O)(=O)CC(F)F)NNC(=O)[C@@H]1COc2ccccc2O1 731269552 WCOQFADNEUJWFO-HNNXBMFYSA-N 484.433 0.870 50 20 JCGD Cc1c(NC(=O)[C@@H](C)SCC(=O)NNC(=O)C(=O)NC(C)C)c(=O)n(-c2ccccc2)n1C 744447054 UHVDUAZFNRZMCY-CQSZACIVSA-N 476.559 0.217 50 20 JCGD COc1cc(C(C)=NNC(=O)CSc2nnc(O)nc2O)ccc1S(=O)(=O)C(F)F 747047337 WTSLAXIFAPTYDZ-UHFFFAOYSA-N 463.444 0.920 50 20 JCGD O=C(NCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1csc(N2CCOCC2)n1 749220099 HUMJLALZOTWLEU-UHFFFAOYSA-N 473.559 0.273 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cn3ccccc3n1)c(=O)n2Cc1ccccc1 789855610 XQPRNGXIYVDLIS-UHFFFAOYSA-N 486.492 0.537 50 20 JCGD CC(C)(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916622380 MSYXGJVJXSJLDN-UHFFFAOYSA-N 475.593 0.133 50 20 JCGD Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1F 917717797 LJQTVKMVVRLCEX-UHFFFAOYSA-N 457.505 0.778 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCc1ccnc(C)n1)N(S(C)(=O)=O)CC2 918106814 OHRRNYJINLUDBM-KRWDZBQOSA-N 492.558 0.582 50 20 JCGD CCN(CCCNC(=O)NNc1ccc(S(=O)(=O)N(CC)CC)cn1)S(C)(=O)=O 918119219 PPWNOTSBMYXBJO-UHFFFAOYSA-N 450.587 0.410 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(Cl)cc2)c1 920297406 HMAKSNYEHOOFEN-NSHDSACASA-N 474.948 0.840 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@]3(F)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1778324297 DPBCTFAXAIGMRS-DHIUTWEWSA-N 499.584 0.538 50 20 JCGD COc1ncccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028457 LVKCXVDCEAUNAI-QHCPKHFHSA-N 468.514 0.165 50 20 JCGD COc1ncc(Cl)cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028689 IHIXHZXLIAHKEH-NRFANRHFSA-N 474.905 0.499 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2 1779029900 ZROAGIDTZJJYBC-YKSBVNFPSA-N 478.509 0.322 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1C 1779033734 CNIIJDZUYOPDPP-XMMPIXPASA-N 467.526 0.688 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1 1779116432 RBBRTPWSWALCGT-QFIPXVFZSA-N 456.503 0.553 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccn(C)c1)CCO2)NC(=O)NCc1ccccc1 1780970611 YJCFNAAAMBIKJC-XMMPIXPASA-N 468.558 0.815 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)NC(=O)c1ccccn1)C2 1782179826 NEYCXBFLZROLDM-FWTHMSADSA-N 466.966 0.968 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)CC1 1782914382 LUGSGQSCGYRUQJ-SGSZHJQISA-N 459.503 0.294 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1783687778 ZPXBLZOVIKKVMG-SFHVURJKSA-N 457.351 0.316 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnn(Cc3ccccc3)c1)CCO2 1783934225 ALGLCIYAZFKLMR-DEOSSOPVSA-N 468.558 0.748 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783939387 DOORFUYLHOISQZ-UZUQRXQVSA-N 479.578 0.106 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)C(=O)C1 1785669897 QZPBUCAAIAEECL-OXQOHEQNSA-N 476.933 0.430 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccnc(C(F)(F)F)c1 1785824002 ZUVKVXCTQOSCDD-SZMVWBNQSA-N 477.248 0.687 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4nc3O)C[C@@H]21 1788609905 RYUFHJUBQCOUSN-JVPBZIDWSA-N 491.508 0.241 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)C(=O)CC4)C[C@@H]21 1791293709 CMLUOGBLFLMBSK-CUWPLCDZSA-N 456.543 0.782 50 20 JCGD O=C(CCc1cccc(O)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791398801 UWLVKTMVZXDSGY-NYVOZVTQSA-N 452.316 0.298 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CN)c1ccccc1 1795673931 SLLMNBSFYKZMBT-QQNIIYITSA-N 466.542 0.453 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)cs1)C2)c1ccc(B(O)O)cc1 1795734551 SKAKMRRSBREMCM-FVCICTRLSA-N 479.161 0.707 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(C(F)(F)F)cc1Cl)C2)c1cccc(B(O)O)c1 1795740266 MFPQHXOTGCOUEY-FVCICTRLSA-N 497.666 0.951 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)cc2NC1=O 1796191974 XCOCQASSDXCYMF-YFYLHZKVSA-N 463.299 0.651 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1O)C2 1796443685 BJVMNPOOYQBNFB-QCIWSRGXSA-N 453.499 0.658 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(I)cnn1C 1796747171 DQTUOXILTBHLLA-NOHGZBONSA-N 496.733 0.482 50 20 JCGD Cc1nn(C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799094822 AJSSLBPPMPKISG-HATOLVCRSA-N 483.573 0.278 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1799366095 RROLHCNVGIQZIN-LOUJCGABSA-N 478.384 0.637 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2ccncc12 1799914184 ARDOHVOUQJRSOK-VPTLXERWSA-N 460.494 0.750 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@@H](C)Br)C3)C2 1800327024 YZYBIHIWLHGMNY-WVCIDPQESA-N 497.390 0.995 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C3)CC2 1800411859 WNANUFWWECLUNQ-ZLWLXJDCSA-N 478.354 0.383 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 1801052465 PVZQIGPQUTXURV-QKQGURCUSA-N 459.971 0.965 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C1=O 1807360258 IXOXOXVJAKGRSN-VGSWGCGISA-N 498.304 0.530 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364269 DNEXZAWTUVDYPW-XXBNENTESA-N 464.331 0.094 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807368606 VYEKVXBGYCDBLD-PMVMPFDFSA-N 464.375 0.954 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371019 OCJHARFESPPDHY-URXFXBBRSA-N 496.336 0.976 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2[nH]nc3ccncc23)[C@@H]1c1cccnc1 1808101834 HHTSWMSKUFBFPY-VFNWGFHPSA-N 485.508 0.985 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1810305585 LXGSWSGBZIWWCZ-QFBILLFUSA-N 480.525 0.743 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(C(N)=O)cc2)[C@@H]1c1cccnc1 1810308089 IVPSIULJAVQLEQ-GHTZIAJQSA-N 487.520 0.812 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1813028796 WEGJXSUXCYVKFJ-ZIFCJYIRSA-N 472.995 0.072 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1 1813071462 SQCDRDDKKZMURV-LAUBAEHRSA-N 464.530 0.817 50 20 JCGD O=C(CCN1CCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1814265326 OECPPBYVGAMYGC-REWPJTCUSA-N 450.348 0.567 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360664 LWGQZIKIKJZBBC-SWLSCSKDSA-N 458.349 0.354 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc2c(c1)CNC2=O 1819367725 MYGVSNGKAGGLGU-MRXNPFEDSA-N 476.323 0.606 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403619 WZJOCDYKWJZLDV-DYVFJYSZSA-N 466.506 0.642 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)no1 1827052741 CJFYQRHWSLUURO-HXUWFJFHSA-N 482.346 0.925 50 20 JCGD CN1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1828444388 AWVFLVYXWXZESE-HXUWFJFHSA-N 450.628 0.227 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1Cl)CCO2 1829498490 VBYMMWSPFIQKTK-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD COc1ccc(-c2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)n[nH]2)cc1 1830727693 BJAGPOVLERFLIZ-UGKGYDQZSA-N 478.933 0.755 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830735761 MNKBLXLOXKCBFB-OXQOHEQNSA-N 461.342 0.947 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)C3=CCCS3)CCO2)C1 1831550086 HTFLTUJLGZSQFV-CPOKCXMASA-N 461.544 0.598 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCCC(F)(F)F)CCO2 1832264850 FZNCZQKBUXYGEG-GOSISDBHSA-N 452.474 0.548 50 20 JCGD O=C([C@@H]1COc2ccccc2O1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1832500225 RMFQHYRBIGCKMJ-TXPKVOOTSA-N 473.295 0.973 50 20 JCGD CC(C)[C@@H](S)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833491014 BWRHEMYGEKCACR-LJQANCHMSA-N 462.620 0.825 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833596232 BLTNGELLWQEFNH-JXFKEZNVSA-N 473.979 0.963 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3ccon3)CC2)CC1 1834299484 ZWIUTGQTVKAMAX-MFKUBSTISA-N 455.519 0.994 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C(F)(F)C(F)F)CC2)CC1)c1ccc(B(O)O)cc1 1834797497 PKTXMJQQIOVGJT-UHFFFAOYSA-N 459.249 0.452 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)n1 1834821461 LOYVJGYXXRPSNN-GOSISDBHSA-N 487.307 0.853 50 20 JCGD C/C(=C\c1cccs1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926171 HXLABRMMVVAGIP-ILAWTMEDSA-N 470.356 0.601 50 20 JCGD Cc1ccc2[nH]c(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2c1 1835930700 VFIBNCMPHXNOQL-RUZDIDTESA-N 477.326 0.540 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1 1835972611 JFSOEUJAVRAQRS-JAMLUQCHSA-N 491.936 0.127 50 20 JCGD O=C(Cn1cncn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1836139495 MNPPNKLXKUYYCG-GHTZIAJQSA-N 492.374 0.741 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836718356 WCKQQXWUEXNYAF-MAKCPWPFSA-N 467.954 0.719 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c2cc(O)ccc2n1 1836821450 DGDGHUVMUDDAOG-DENIHFKCSA-N 463.918 0.919 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCNC(=O)c3ccc[nH]3)CC2)CC1 1837148271 NELOTSSZIDBEGW-UHFFFAOYSA-N 490.605 0.506 50 20 JCGD COc1nccnc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837290658 POQCYBPNWBFVDI-UHFFFAOYSA-N 468.319 0.091 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncoc4c3)C2)C1 1837459759 XFYFGCPRKFAOPR-HSZRJFAPSA-N 480.481 0.210 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461289 SOLYFYBWPVDJSA-XMMPIXPASA-N 496.524 0.027 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1837715307 IKYHMQXBCTYDBE-IBGZPJMESA-N 452.540 0.096 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)S)C2)C1 1838528140 HJNFGMDEEKFZMU-RBZFPXEDSA-N 467.500 0.908 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c([N+](=O)[O-])cc1O 1838601858 WSHIDOCQHMSDPE-YJBOKZPZSA-N 461.830 0.913 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1 1838795775 OZTNWTQKDUNCHX-UWJYYQICSA-N 463.922 0.591 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)C2)C1 1839143243 PTGIXTMPDAXOJH-HXOBKFHXSA-N 493.992 0.495 50 20 JCGD O=C(c1cc2n(n1)CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200482 IHLFJPWDMRSIJE-MAUKXSAKSA-N 459.316 0.980 50 20 JCGD O=C(c1c(O)cc(O)cc1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201531 AGVDEQXHKPEXLH-RHSMWYFYSA-N 463.256 0.564 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sc4nccnc4c3N)C2)C1 1840152041 VKMBAFLBHXSHJW-CWTRNNRKSA-N 469.951 0.597 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840935483 HHZRKTAZCGJQRB-QHCPKHFHSA-N 480.537 0.206 50 20 JCGD CN(C)c1cccc(OCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1 1844263610 WOMMGGQKQXBFKA-UHFFFAOYSA-N 452.515 0.647 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1 1845076576 QMOOMOKVTAIVCV-FXUDXRNXSA-N 457.955 0.814 50 20 JCGD O=C1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)CN1Cc1ccccc1 1847711370 AKKWJRBWRCRTAL-HJNYFJLDSA-N 461.327 0.231 50 20 JCGD O=C(CSCc1nc2sc3c(c2c(=O)[nH]1)CCCC3)NNC(=O)[C@H]1CCS(=O)(=O)C1 9930629 XPQZBJXXLOGCQV-JTQLQIEISA-N 470.598 0.679 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1 9930754 AZERHFNAJIMVPZ-GFCCVEGCSA-N 498.410 0.976 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ccc(N2CCOCC2)nc1 14236677 NSWZUMVTRTYUJR-UHFFFAOYSA-N 459.528 0.778 50 20 JCGD O=C(NNS(=O)(=O)c1cc(F)ccc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1 20627141 YFGZQKSKSWFSDI-UHFFFAOYSA-N 461.468 0.609 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)C(=O)NC(C)C)n2C 46773305 FGFKUHIPFHTFOP-UHFFFAOYSA-N 466.564 0.208 50 20 JCGD CC(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 746973476 UTBJRZAUPXADLQ-UHFFFAOYSA-N 486.554 0.717 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c2cccs2)[C@@H](C)O)cc1C 777290627 LXKWVJZNXUBUHN-DYVFJYSZSA-N 469.541 0.397 50 20 JCGD O=C(COC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)[C@H]1COc2ccccc2O1 784364316 DAOFFHYDGCNPGV-CKEIUWERSA-N 459.455 0.082 50 20 JCGD C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1)c1ccccc1 788024221 WGMIHPXMKWAOEC-PBHICJAKSA-N 465.553 0.922 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cnc2c(c1)c(O)nc(=O)n2C1CC1 892849056 ZUBREMSCXAJPIN-UHFFFAOYSA-N 457.472 0.200 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1 914442760 KXDSGEUBNZVBLE-UHFFFAOYSA-N 450.542 0.781 50 20 JCGD CN(CC(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1)[C@H]1CCS(=O)(=O)C1 914531850 IUULNBGYRKSSCA-SFHVURJKSA-N 468.539 0.814 50 20 JCGD COc1ccccc1NC(=S)NNC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1 915598538 ZLWGHAOAYRIPMC-UHFFFAOYSA-N 463.541 0.447 50 20 JCGD CC(C)CN1CCO[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 915922254 FDOWZINDEAPTMK-GOSISDBHSA-N 483.591 0.008 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@]1(N2CCOCC2)CCSC1 916636435 CFHLBONPUVLTDM-HSZRJFAPSA-N 476.647 0.737 50 20 JCGD C[C@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)C1 919886395 WDNKOWYLRNINLS-ZFWWWQNUSA-N 458.562 0.238 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)c1 920284808 IOTIBMHLTUYAQH-IBGZPJMESA-N 458.540 0.932 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)CN3CCCC3=O)ccc2Cl)C[C@H](C)O1 920435588 KGVZQTCUEDCPIZ-STQMWFEESA-N 472.951 0.521 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)ccc1Cl 921161467 XBABSAAJVTZKIZ-UHFFFAOYSA-N 472.932 0.503 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCn1ccnn1)C2 1778095076 RWTNYTHDJCDIBG-IINOVHIQSA-N 470.534 0.316 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)CC1 1778095336 WMJLPKKEKCAWTP-ZZLSVPGXSA-N 473.530 0.588 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Cl)C3)CC1 1778754809 NXSUICBRNJPVIM-RVKKMQEKSA-N 453.964 0.706 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1)N1CCN(C)CC1 1779546720 CTJPXYXOUGWNFH-WOIUINJBSA-N 454.688 0.988 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n(C)n1 1780968686 IZFSSMKHBKRDCJ-DEOSSOPVSA-N 499.572 0.218 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)[C@@H](O)C1 1781115740 UBPGFPJGDXCWTQ-JMERFSKESA-N 466.362 0.848 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781331381 PZHZBCDIRWCVQL-PJHJGJPPSA-N 494.358 0.877 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@H](O)Cc1ccccc1 1781894859 PMUXJUBIVZPBMB-TZBSWOFLSA-N 466.343 0.098 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2 1782171196 SNLBUYALDYQSNE-ATKYPWJNSA-N 482.965 0.760 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1783450483 OKEDCIQWYVPCMT-UQBPGWFLSA-N 499.373 0.067 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cn2[nH]cnc(=O)c12 1783536218 FKUMDNFURGGQTD-XIKOKIGWSA-N 452.309 0.558 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786981641 BBRJHVVTVGRPNP-NYVOZVTQSA-N 452.316 0.672 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)C1 1786982743 GQRCZNUTVRCWLO-AINOVGTFSA-N 486.374 0.329 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4cccc(F)c34)C[C@@H]21)c1ccc(B(O)O)cc1 1786982881 BYEGKOVNFRAFLB-QOKNQOGYSA-N 466.278 0.289 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@H]43)C[C@@H]21)c1cccc(B(O)O)c1 1786983931 GJUDVJWTLCRUGH-YIDIZNGVSA-N 478.379 0.848 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)nc1 1786984898 WNNJGPFCOHLNQN-JBACZVJFSA-N 481.358 0.521 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(-c2ccco2)no1 1787283844 YJNSNXUUSRZOQU-WJPUGNRLSA-N 465.271 0.522 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1789220729 IASHTYGFGVBUAI-PTOXDTDZSA-N 469.878 0.713 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792981288 JCKWHRJDEWYXAL-AICCOOGYSA-N 481.924 0.820 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(O)nc1O 1796347323 LRXHRVUWTIRZFW-XSDCOXNMSA-N 471.420 0.976 50 20 JCGD O=C(/C=C/C(=O)c1cccs1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1796444927 UPDPSJYDUYDOSZ-VASXEIHQSA-N 454.313 0.070 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796445615 FUONBAZTNNXWJL-SVQFQIBWSA-N 468.352 0.884 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn(-c2ccccc2)n1 1797005619 MHKDFVDHHRIXSG-ACHSLPGTSA-N 460.498 0.831 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(O)nnc2O)cc1 1798599120 UJEUXKAEHMMKBM-XRGAULLZSA-N 465.894 0.136 50 20 JCGD Cc1nnsc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097644 RZUPDFGGTZVLDR-IZZQQSIFSA-N 487.586 0.396 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)cc2NC1=O 1799287344 NJBKFFQAAGSKBB-YFYLHZKVSA-N 463.299 0.651 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799349562 YWUJJDSARJTJAV-BUONHZGMSA-N 482.347 0.542 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccnc1)C2)NC(=O)NCc1ccccc1 1799864633 ACVGARQNIPLJCZ-ACDBMABISA-N 453.547 0.868 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1802333247 PGVWEXQQPHDDCW-XQLPTFJDSA-N 460.535 0.004 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CS(=O)(=O)N2CCCC2)[C@H]1c1cccnc1)[C@@H](O)CCl 1803138799 FHMLNNGEHVWSRM-BQFCYCMXSA-N 458.968 0.113 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCc2cnccn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368012 PKWKYJLAMOSBLP-WMZHIEFXSA-N 459.315 0.504 50 20 JCGD O=C1Cc2cc(C(=O)N3CC[C@H](CNC(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)ccc2N1 1807376602 VFSNUQPYXSOWSS-DVECYGJZSA-N 484.321 0.889 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1 1808410743 WTTQOCSGEUACSY-BLCOGNGMSA-N 481.513 0.674 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cn1 1809978417 SMDPSLYGNPCYED-UHFFFAOYSA-N 465.315 0.707 50 20 JCGD COCc1oncc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810301876 DJEBUZZGLKPTBK-QRWLVFNGSA-N 479.497 0.848 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1 1812327630 GPIPLRNZBCKPDR-HXOBKFHXSA-N 469.546 0.589 50 20 JCGD C[C@@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)N1CCN(C)CC1 1813074334 XSVZYJRRGPCHDO-NOXFTYBFSA-N 473.622 0.096 50 20 JCGD CN1CCCn2nc(C(=O)N3CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)cc2C1 1813074569 SXFLVLFZUGYWPG-CYFREDJKSA-N 496.616 0.806 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccn(C(F)F)c1=O)CC2)c1ccc(B(O)O)cc1 1815344147 KQOKDYBNGYIHKT-ZDUSSCGKSA-N 488.281 0.919 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnc2ncccn12 1818695480 VUZONNZDZBTMME-QGZVFWFLSA-N 459.275 0.752 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822416276 ZMDMHXIXKMONMD-HIFRSBDPSA-N 450.544 0.482 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)[C@H]1SC(=N)NC1=O 1827674333 WMEGSUDZCATTHC-URLQWDBASA-N 480.635 0.782 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(=O)N(C)C)C2)C1 1829340239 GNHVTTHKJZNMRV-MBSDFSHPSA-N 494.976 0.781 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1830540145 PBUYXXBMSMZQIM-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1830540146 PBUYXXBMSMZQIM-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD O=C(c1cnc(C(F)(F)F)cn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830722845 HFNCRORWAWOBCV-WBMJQRKESA-N 452.817 0.165 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830730449 ALQMMRIBAVJLPH-GHTZIAJQSA-N 453.923 0.244 50 20 JCGD C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830732771 AIZUUCSEMHAYHO-GSHUGGBRSA-N 489.997 0.902 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1832544988 XKGMZQBOLUFKFU-MPWIWIEXSA-N 487.981 0.512 50 20 JCGD Cc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)cn1 1832549245 IYRUMTCEPKIIGE-KSFYIVLOSA-N 497.980 0.987 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(=O)c1ccccc1 1834380413 QTGVDRKZSWEHJY-UHFFFAOYSA-N 463.343 0.435 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1834797319 PZKOQFKSONPUMH-UHFFFAOYSA-N 475.626 0.454 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCCn3ccnc3)CC2)CC1)c1cccc(B(O)O)c1 1834801502 PYVNXCRUXVJUNV-UHFFFAOYSA-N 467.379 0.229 50 20 JCGD Cc1cc2nnc(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)c(C)n2n1 1835339130 DNUYNCIMXGJUJH-QGZVFWFLSA-N 463.970 0.526 50 20 JCGD CN1CCN(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)CC1 1835402345 BDVKZBJVDXUELP-UXHICEINSA-N 465.422 0.317 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737073 KFTIBKVNVCZWGI-UHFFFAOYSA-N 488.589 0.602 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1836634649 KSUBXGZMCYNFFH-ZOCZFRKYSA-N 475.970 0.300 50 20 JCGD C=CCO[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836868395 SEHPPNISNJMBSI-MRXNPFEDSA-N 459.547 0.888 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)c2c1 1836920967 HGEPTBVVBXXSMV-RXVVDRJESA-N 451.907 0.846 50 20 JCGD Cc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457754 POJCIXYFJXWIMG-DEOSSOPVSA-N 467.526 0.306 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cc(C)on3)CCO2)C1 1837550356 ZYNHLEGDQPUFBJ-KUHUBIRLSA-N 487.351 0.343 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H](N)c3cccnc3)C2)C1 1837711246 AFRWDJVZTKMNIC-GHTZIAJQSA-N 450.612 0.779 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1837714642 LUBZXMCLYCBUSM-OAQYLSRUSA-N 461.595 0.580 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(O)[nH]3)CCO2)C1 1838063617 RUOBOGDBZAVXCJ-RBZFPXEDSA-N 487.941 0.317 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1838542545 HXNIUWZMZONCCD-YLJYHZDGSA-N 470.910 0.331 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1839151458 RVBKEHRYLVSUBV-RBUKOAKNSA-N 459.330 0.487 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839154041 ZMSYMLFHSOAWPG-VHKYSDTDSA-N 488.372 0.288 50 20 JCGD CNc1nsnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839197229 NHTAHPQANSIKRH-YGRLFVJLSA-N 452.306 0.340 50 20 JCGD Cc1cc(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839285595 FSBDCFKJQMPATB-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839670466 JSSGFRVEYDRSDT-FZKQIMNGSA-N 473.324 0.191 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1839967509 OOOZTADRWOBYNG-BLLLJJGKSA-N 462.370 0.527 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)c4ncccc34)C2)C1 1840153784 ZJNPCSRJSWNFLR-DYESRHJHSA-N 450.923 0.897 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1 1840155901 JSKOVJKICGEJDO-CIEVZJJWSA-N 496.004 0.332 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1 1840156884 XGDLABMOZNOJQQ-UTKZUKDTSA-N 451.907 0.647 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1 1840481222 JWXYCUAIXVVMII-KUHUBIRLSA-N 456.337 0.695 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)C(C)C)CCO2)C1 1840565783 DEABCDYBXPLWLT-QHCPKHFHSA-N 492.529 0.930 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1 1840646662 MVXSCQDWNVMYDQ-IBGZPJMESA-N 454.321 0.641 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840885555 OIHKDSQVYBEUEP-SJCJKPOMSA-N 453.305 0.723 50 20 JCGD COc1ccc(-c2cc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)n[nH]2)cc1 1843451787 MHDWDTOSJUMJSD-UHFFFAOYSA-N 460.299 0.896 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c(C(=O)OC)s1 726519191 FCCLFEOXWREAHF-UHFFFAOYSA-N 490.541 0.238 50 20 JCGD CC[C@@H](C)[C@@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)NNC(=O)c1cnn[nH]1 729456578 UAVMCCNTOPLJRJ-MEBBXXQBSA-N 485.954 0.314 50 20 JCGD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 729511560 MNCMGNBFGJJWPT-SFHVURJKSA-N 486.558 0.051 50 20 JCGD COc1cc(C(=O)NNC(=O)Cn2cc(Br)c(O)nc2=O)ccc1OC(C)C 733797380 VAUMOCOQLRFREA-UHFFFAOYSA-N 455.265 0.968 50 20 JCGD O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1)C(=O)NC1CC1 743746105 JWZJPOOGEKCCJU-SNVBAGLBSA-N 479.378 0.480 50 20 JCGD COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1 811969393 YIANCOSSYZTFJS-UHFFFAOYSA-N 459.484 0.577 50 20 JCGD O=C(COC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)NNC(=O)[C@H]1COc2ccccc2O1 848978616 KIUVOSXGUNBZQD-VBKZILBWSA-N 497.460 0.341 50 20 JCGD CCCn1nc(C(=O)NNC(=O)c2cn(CCO)nc2C2CCOCC2)c2ccccc2c1=O 856583117 UJGFJRFUQNIPRG-UHFFFAOYSA-N 468.514 0.964 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)c2ccc(OCC(=O)N3CC[C@@H](B(O)O)C3)cc2)cc1 864233363 GVPFSDBLCMKZAS-MRXNPFEDSA-N 475.332 0.924 50 20 JCGD O=C(COC(=O)[C@H]1CCCN1C(=O)c1ccccc1O)NNC(=O)c1ccc([N+](=O)[O-])cc1 915427960 HRTZCNIKIYNZEZ-MRXNPFEDSA-N 456.411 0.909 50 20 JCGD CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1 920385346 YCEGSUMIHPJHFK-WBVHZDCISA-N 486.572 0.525 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1 1778027647 PZJFTMMZEOFHFR-RXIQLXCPSA-N 478.949 0.803 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1 1778635604 QTTSMHZMDWIXJD-JOCHJYFZSA-N 452.251 0.139 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1nc2c(=O)[nH]c3ccccc3n2n1 1778724839 UOKDLHYUWZMFNB-XCGNWRKASA-N 488.932 0.298 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc(Cl)s1 1779837620 DMYIANRAKZQOGC-OXQOHEQNSA-N 463.752 0.918 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)ccc1O 1780750091 OSEWDIVQXHWOBQ-XTVKVDEJSA-N 469.498 0.978 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(Br)CC2)C1 1780780447 ZVSSTUQYCXFIHU-DNVCBOLYSA-N 480.363 0.740 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H]3CSCN3C(=O)[C@@H]3CCC(=O)N3)CCO2)C1 1781220111 VINYPTIIEDZHRS-ODCFSMADSA-N 472.995 0.014 50 20 JCGD COc1cccc(N2C[C@H](C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)CC2=O)c1 1783445605 JSQGHUXPGQHPSW-DJLVLGKWSA-N 479.961 0.628 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCCn3ccnc3C)C2)C1 1784410261 SFQMIAGAJMHPIM-NWJFTTBMSA-N 469.546 0.936 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C(C)(C)CNC(=O)OC(C)(C)C)C2)C1 1785737836 UZQONHYTXRMGHK-HSZRJFAPSA-N 483.610 0.740 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C[C@@H]21)c1cccc(B(O)O)c1 1786984871 SHOXUADNGUJCKE-NDXORKPFSA-N 495.297 0.117 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1 1787451352 KCXPMOZVNMREDP-YTFOTSKYSA-N 479.933 0.957 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)[nH]n1 1788611330 UWSDJUHDXCOQCN-OWQGQXMQSA-N 469.546 0.613 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCN(C(C)=O)CC3)C[C@@H]21 1790961737 PIWYKLVYZJFSSH-XSLAGTTESA-N 473.412 0.304 50 20 JCGD CCOc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1OC 1791293300 SMEMKKQCQZIPHG-IPJJNNNSSA-N 490.601 0.989 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)c3ccccc3)[C@H]2C1 1792121452 WGIOXTITQNQFLL-UFYCRDLUSA-N 473.574 0.159 50 20 JCGD CC(C)(Cc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1792874858 HCSRBORRWDEZED-VTYHHJSWSA-N 450.344 0.839 50 20 JCGD O=C(NC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CC1)OCc1ccccc1 1792981031 CMDPNMRNPWJFTQ-MHORFTMASA-N 465.934 0.635 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793880817 HNCAWDKTCGDIPN-QKGCVVFFSA-N 475.974 0.155 50 20 JCGD COc1cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc(OC)c1OC 1793902697 XROIBRFFJJGAGF-ACDBMABISA-N 482.342 0.887 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)CC1 1795114496 PFOCFZJKKNZGST-MIFYACCESA-N 466.398 0.033 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)C2)c1ccc(B(O)O)cc1 1795734243 KYFIJXGKIGSHLP-IEOOEQHGSA-N 464.352 0.458 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796189820 FEPMIDDGHBJEFD-RDGPPVDQSA-N 457.336 0.628 50 20 JCGD Cn1ncc(I)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1797247677 IOXBWFHKTLXGPE-WYFGTUCQSA-N 466.707 0.876 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1800299119 GKWZQGJQHVUCME-CABLIKTCSA-N 484.366 0.902 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C)C2 1800975359 MTSAFRRRVNVMBL-QEOTZNIISA-N 475.970 0.466 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801010554 GFRBBKCLTMHWJR-AXVVYFOYSA-N 481.594 0.418 50 20 JCGD COc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1OC 1801012808 YXNYUKKASHDMDZ-VTEUUUEMSA-N 466.510 0.419 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc3c(=O)[nH]c4ccccc4n3n2)[C@H]1c1cccnc1)[C@@H](O)CCl 1803142731 HHHUZKYCOUVQHL-WBAXXEDZSA-N 495.927 0.885 50 20 JCGD O=C(CCC(=O)N1CCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804148684 AXXWKRJLXGNDHU-HYBUGGRVSA-N 478.358 0.484 50 20 JCGD COc1ncc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc1F 1804960343 NDVOGALGPUYIBU-UTKZUKDTSA-N 478.289 0.938 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2cnc3ccccn23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807363060 AIQCWDAMZLJSOS-CPJSRVTESA-N 483.337 0.971 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1807369483 LONSXWIGHNEOBG-GCJKJVERSA-N 475.314 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1 1807408354 KQXCDFLETCVLQG-MBSDFSHPSA-N 499.535 0.685 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1808317843 LWSGFEVAKQJPLV-KPFFTGBYSA-N 461.390 0.610 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnn2ccncc12 1809386778 QIPYRQQRTUMTNY-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302021 DPSLKDBJBAMRNG-UXPWSPDFSA-N 466.542 0.973 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1 1810303512 TZPPWUIJFGGNCE-XZLWZSMOSA-N 478.557 0.871 50 20 JCGD COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1812688261 SYHMSTFSZFUUEZ-HKUYNNGSSA-N 451.288 0.034 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813068654 PLISRZMLIMZONP-GHTZIAJQSA-N 460.579 0.623 50 20 JCGD Cc1nccn1[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813489642 IMBQCNHZLZRANB-BSLALVQMSA-N 461.331 0.847 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350437 VUPYQBWDARYHIX-CQSZACIVSA-N 459.333 0.781 50 20 JCGD COc1nccnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1816158753 RVLYHVMMEHQQMF-HNNXBMFYSA-N 465.474 0.827 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)n1ccnn1 1819404009 RYJNUDAQQGPONH-LRDDRELGSA-N 452.479 0.567 50 20 JCGD COc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cn1 1819795143 INAGYQFWVNGSGY-SNVBAGLBSA-N 468.499 0.480 50 20 JCGD CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n(C)n1 1819797752 IREHGBHPKUPQJN-GFCCVEGCSA-N 468.543 0.977 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3c1OCCC3)CC2 1819799410 BTFLVDFUCCFIOA-LLVKDONJSA-N 482.526 0.660 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1 1820691395 KKGUFRACWTUJNZ-ZIAGYGMSSA-N 466.951 0.907 50 20 JCGD Cn1cccc1C(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826995279 CODARGBFFDMKJN-CQSZACIVSA-N 452.301 0.270 50 20 JCGD COCCOCCOCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060670 WOBRGABZMNTKOM-QHCPKHFHSA-N 490.406 0.669 50 20 JCGD O=C(c1ncon1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829164859 GKVWIYZYFCAOKA-KKSFZXQISA-N 477.905 0.735 50 20 JCGD O=C(O)C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829330216 CFBVJQCKFFLVPE-VGSWGCGISA-N 477.901 0.126 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CCC(N)=O)C2)C1 1829340123 DYQGTNJTEXWGJF-JPYJTQIMSA-N 494.976 0.958 50 20 JCGD O=C(c1cc(Cl)cc2nn[nH]c12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731384 JCUOGESGEPFMGV-KDOFPFPSSA-N 458.302 0.281 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830732459 YNGPINDWYZDJQH-XGRCMKMKSA-N 489.997 0.690 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCS(=O)(=O)CC2)CC1 1831828943 VYSDFMPROYVMPV-ROUUACIJSA-N 464.028 0.590 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)n2)CCCN1 1833724201 LUFMNUYXRXIULZ-RXVVDRJESA-N 483.928 0.012 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nc1 1833998087 VOWBMFABTOSPOR-SFHVURJKSA-N 472.995 0.270 50 20 JCGD N[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccc(Cl)c1 1834797996 UOLKGGJPQTZLCH-HSZRJFAPSA-N 498.820 0.905 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c(=O)[nH]c1C 1834819359 OIRMEZVALSSIGT-GOSISDBHSA-N 457.325 0.242 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1834823021 DYIQTZAVCZZCRX-GOSISDBHSA-N 452.309 0.584 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1835117076 GQFHPWFQZVZUDD-UHFFFAOYSA-N 493.468 0.769 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)COc3ccc(O)nn3)CC2)CC1)[C@H](F)Br 1836413882 QAKDTZVSKRXZFL-KRWDZBQOSA-N 474.331 0.823 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C(=O)c3cccs3)CCO2)C1 1836520924 XVIZSKIXFUTAGY-HVPBSWBLSA-N 478.571 0.316 50 20 JCGD CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)CN3CCN(C)CC3)CC2)CC1 1836541860 KBXXXCZJDUMFBJ-IBGZPJMESA-N 472.472 0.979 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1)CCO2 1836596694 BRZKHLGWJYPSMB-RQTOMXEWSA-N 498.772 0.894 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837637078 UVBUTDNYASBYGX-UTXAPGEGSA-N 484.347 0.692 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cccc1Cl)CCO2 1838869622 IOVQHASSORETIP-QFIPXVFZSA-N 491.907 0.861 50 20 JCGD O=C1CSc2ncc(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)cc2N1 1839578478 FJCHFIMIAAMLBC-SFHVURJKSA-N 475.354 1.000 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622600 LMKXNNAFSDWYEC-UTKZUKDTSA-N 498.422 0.962 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccccc3)C2)C1 1840149272 KHOKLEFPEZTWFD-MFYJYGFBSA-N 479.961 0.569 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(CC(C)C)nn3C)C2)C1 1840151959 SIYXSTPLSWFGPL-DYESRHJHSA-N 456.971 0.942 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)ccnc3Cl)C2)C1 1840183517 JAMGMCWQOMNLRR-HXUWFJFHSA-N 471.917 0.317 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840392949 AMVIMSBIOQYSHY-VGSWGCGISA-N 479.603 0.392 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840897219 QXOKKUSKMVKIQH-YVEFUNNKSA-N 494.433 0.477 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCc1ncc[nH]1)C2)NC(=O)NCc1ccccc1 1845039387 KQTQMXWKIQPNLO-UHFFFAOYSA-N 453.547 0.892 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(S(C)(=O)=O)ccc1F)C2 1846385741 PWVIAPQIZQISJA-UHFFFAOYSA-N 454.524 0.419 50 20 JCGD C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C1 1847090034 IHAXKMQDNWPVID-STQMWFEESA-N 475.384 0.990 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN 1847955886 HBZUPCDQNHVVKH-HOTGVXAUSA-N 460.535 0.804 50 20 JCGD O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 15795473 YTNBVVQBKHAZHW-SFHVURJKSA-N 465.459 0.448 50 20 JCGD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 726382509 UDUHIOSYELLREX-AWEZNQCLSA-N 484.538 0.927 50 20 JCGD O=C(COC(=O)CSCc1cc(=O)n2ccsc2n1)NNC(=O)[C@H]1COc2ccccc2O1 728318485 JQPUOKXVCRSKKT-OAHLLOKOSA-N 490.519 0.520 50 20 JCGD Cc1oc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1S(=O)(=O)N1CCCC1 728328313 RQGOYWPTMZNUTG-KRWDZBQOSA-N 493.494 0.517 50 20 JCGD CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1Cl 728373813 BPORCJDODXJSLZ-NSHDSACASA-N 451.954 0.613 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2C[C@@H](O)CN2C(=O)OCc2ccccc2)n1 728730012 FJHGSTSGCBVZOX-CVEARBPZSA-N 476.511 0.457 50 20 JCGD Cc1ccc([C@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)N2CCOCC2)o1 729044735 IRWWROKJQGQXNW-SFHVURJKSA-N 457.535 0.998 50 20 JCGD Cc1ncsc1CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 729616423 WUFAERZJBVRVKW-UHFFFAOYSA-N 467.573 0.936 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)C[C@@H](C)O1 731794482 WSTJCVLAEZWOHJ-CALCHBBNSA-N 477.587 0.606 50 20 JCGD C[C@H](CCN(C)C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 744866877 ZKOSHEVVWOYQNG-MRXNPFEDSA-N 455.581 0.311 50 20 JCGD CSCC[C@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)NNC(=O)N(C)C 746003349 HOBXGFVITMNOHQ-AWEZNQCLSA-N 480.012 0.744 50 20 JCGD CN(CC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1)C1=NS(=O)(=O)c2ccccc21 746262746 HDKIXZMMBPKGFO-UHFFFAOYSA-N 464.887 0.725 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNC(=O)c2cc(-c3ccccc3)on2)cc1 749719964 SMHSAATZFSPDRC-UHFFFAOYSA-N 485.522 0.848 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 751209273 NRYFAOHORZUNNN-OAHLLOKOSA-N 495.539 0.777 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 751214736 DWSHHMOYZDNOQL-UHFFFAOYSA-N 470.504 0.099 50 20 JCGD O=C(NNS(=O)(=O)c1ccccc1OC(F)F)c1cccc(S(=O)(=O)N2CCOCC2)c1 751260023 HCVZKJSVMNEDLE-UHFFFAOYSA-N 491.494 0.932 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccccc2CN2CCOCC2)cc1 915927461 OJHRSXCTZANMHX-UHFFFAOYSA-N 489.598 0.978 50 20 JCGD CC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1 915931474 KRCQQIFQKXYMRU-UHFFFAOYSA-N 451.549 0.816 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(C)(C)N2C[C@H](C)O[C@@H](C)C2)cc1 916234770 QDYFMKSBVCXFBG-IRXDYDNUSA-N 469.608 0.834 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)nc1 916245219 FHEBMFBJEKRASH-UHFFFAOYSA-N 462.580 0.741 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccnc(N3CCOCC3)c2)cc1 916389308 VWDAUHSUXNOGOG-UHFFFAOYSA-N 476.559 0.378 50 20 JCGD COc1ccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)cc1 916390653 OAXYYEVGMMYGIF-UHFFFAOYSA-N 455.515 0.992 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=S)NCCCN(C)C)N(S(C)(=O)=O)CC2 916547219 LGMHYDJIKROYSO-MRXNPFEDSA-N 487.648 0.400 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCS(=O)(=O)NCc2ccccc2)nc1 916645088 AWWXKXFNQDKFMU-UHFFFAOYSA-N 470.577 0.514 50 20 JCGD O=C(CN1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 917107760 QUWPEOHREQSDGG-UHFFFAOYSA-N 462.444 0.784 50 20 JCGD CS(=O)(=O)N1CCC[C@H](NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1 920238914 MZEVGQIOQTWGSU-IBGZPJMESA-N 498.569 0.756 50 20 JCGD O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)c1csc(N2CCOCC2)n1 920274935 JOAONYKUXSOMFG-UHFFFAOYSA-N 468.495 0.378 50 20 JCGD COCc1oncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1778344240 ZZTWJQJMFQGIHO-XMSQKQJNSA-N 472.502 0.261 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CSc3ccccc3)CCO2)C1 1779031137 LZEVQSREMKNEKV-QFIPXVFZSA-N 455.540 0.921 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3ncnn3c2)C1 1779168946 JPKCOJGJANBQGE-VFHFUPNESA-N 492.540 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(O)n1)C2 1779371047 JWSRRTGOWNCBSU-VGOFRKELSA-N 454.487 0.227 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)N1CCCC1)C2 1779371333 PMYKIVRMEJKUQL-NTKDMRAZSA-N 486.573 0.215 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1 1780186003 DSZGWUGBKQNOJY-XMMPIXPASA-N 466.542 0.960 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccn1C)C2)NC(=O)NCc1ccccc1 1780559072 ZEZYZSBXVINEGF-CJFMBICVSA-N 497.600 0.894 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780939374 YUTGXKUYNZDXAO-LIRRHRJNSA-N 485.404 0.895 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@]34C[C@@H](CO3)N(C(=O)OC(C)(C)C)C4)C2)C1 1781063452 UKNWORIKLBCXSR-QDGJQWLKSA-N 487.981 0.849 50 20 JCGD C[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)Oc1ccccc1 1782878782 ITBHEQLDXJMXHG-HOYKHHGWSA-N 452.316 0.668 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)CCO2 1783933249 TYTGDTOCQHMQSV-UCFCWBNQSA-N 458.559 0.485 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1F 1783934547 IAZADJBKALXOHE-DNQXCXABSA-N 491.564 0.380 50 20 JCGD Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1C(F)(F)F 1785528314 AATNJPISXXKIDZ-UVBJJODRSA-N 495.462 0.345 50 20 JCGD C=C(Oc1ccccc1O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1787502089 APOKOESMZKHEMU-XERREHJYSA-N 481.509 0.577 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C(=O)NCc3ccccc3)C[C@@H]21 1791287988 KWOCTMQVDSMGHW-INTILAQOSA-N 485.585 0.212 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cccc(Cl)c1 1792747317 AFMPPRLLSIKOMT-VTEUUUEMSA-N 473.917 0.621 50 20 JCGD COC(=O)C1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC1 1793879202 MSCXHWBCINKCRF-XGUBFFRZSA-N 473.954 0.661 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](COC)NC(=O)OC(C)(C)C 1796393014 VGKFYCDEAMPCBK-YIDVYQOGSA-N 463.959 0.370 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(=O)Nc1ccc(F)cc1)C2 1797752922 MQNFZZFIBIYTOH-GFENJXEQSA-N 484.488 0.056 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)N1CSCSC1 1797841896 BAFLISPQIPVYCV-YGADERNFSA-N 494.643 0.753 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)ccn1C 1798527723 FUNUUGBMEXEXDS-USGNIVHTSA-N 484.465 0.736 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1799260249 ABIWVKKRLWGDDC-NEBZKDRISA-N 482.347 0.808 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)[S@](=O)c1ccccc1 1800217327 VCRMIZPRTNMENN-PJWGTFSHSA-N 464.588 0.145 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1800759826 JWHHUSJJWAQUSA-IKVITTDRSA-N 471.377 0.265 50 20 JCGD CC(C)Oc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1C#N 1801012369 VWIOTCOUJIZXNS-BBIADKPPSA-N 471.558 0.922 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1802862596 JLNAWFDSCXEWIS-LRQRDZAKSA-N 496.373 0.994 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1 1804086722 ACYFTOAASJPLEG-MRRJBJDNSA-N 466.336 0.670 50 20 JCGD N[C@H](CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccnc1 1807258952 JRZQZUWBSKXIBX-FJIJXJHWSA-N 473.342 0.566 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376354 VLBZWGIERJQLKO-HNAYVOBHSA-N 464.247 0.026 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)[C@@H]2C=CCN2)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1808221288 YIMTYJMNTFRBIB-WPFOTENUSA-N 491.596 0.962 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1 1810306338 XGFVSLSBPXIPOM-HRAATJIYSA-N 474.525 0.856 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C(=O)C(O)O)[C@@H]1c1cccnc1 1811357773 AQVSZAQBLIDVRS-RDTXWAMCSA-N 458.427 0.545 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1 1813075220 XZKDNBXVLJBECK-VGSWGCGISA-N 455.519 0.329 50 20 JCGD O=C(/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)NCc1ccco1 1815344122 IWVUABOSHFOLPB-SCOAYWHSSA-N 494.338 0.514 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1[nH]nc2ncccc12 1817913958 QXKQEWDBXOKBJV-QGZVFWFLSA-N 459.275 0.981 50 20 JCGD CN1CCCC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793910 VBHFBJOYKWAKGV-LRDDRELGSA-N 457.560 0.852 50 20 JCGD CC[S@](=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797918 ONBYGVBXWQSYKY-JTZKDVPQSA-N 464.573 0.526 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2CCN(S(C)(=O)=O)CC2)[nH]n1 1822416071 MGHQDYFGHUMBET-KRWDZBQOSA-N 497.622 0.446 50 20 JCGD COc1nccnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1825507405 IYAAPKBLVVBGJP-LJQANCHMSA-N 452.320 0.712 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)cc21 1828500336 OWCSPKDPZNQNGC-NRFANRHFSA-N 493.373 0.244 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n(C)n1 1830535841 UOAPFRMFSDDPIR-ACJLOTCBSA-N 459.341 0.530 50 20 JCGD O=C(c1cccc(OCC(F)(F)F)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830723939 ACXGMUIVZXOYSM-KDOFPFPSSA-N 481.855 0.692 50 20 JCGD CC(C)[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)N1Cc2ccccc2C1=O 1830726560 QRLCZPUAYMNJHH-NMMYMHLASA-N 493.988 0.723 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733930 WZIOUWJDKNRHAM-IIBYNOLFSA-N 453.923 0.298 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCn2ccnn2)CC1 1832246839 FUGQTDARKQFPLV-IBGZPJMESA-N 454.535 0.600 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3CN1C)CCO2 1832472883 UPPXKOMEZZLTNN-MZKRTTBSSA-N 465.978 0.753 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccnc3OC)CCO2)C1 1833508100 BEPHCJPICKUXEI-UGSOOPFHSA-N 457.325 0.729 50 20 JCGD Cc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc1 1833823769 SWHGMQOQMIHHFT-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccsc1)CCO2 1833963247 IAQGOVYHSSPKMV-VQYZLWMVSA-N 459.528 0.952 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@H]3Cc4ccccc4O3)CC2)CC1 1835477354 NJGFPXJDHWXGPU-HSZRJFAPSA-N 492.580 0.874 50 20 JCGD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931815 DDPLWRZSCDHJEC-CWMLTSOLSA-N 456.348 0.263 50 20 JCGD O=C(Cc1ccc2ncccc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934342 WEASOKRQNMOKIX-SANMLTNESA-N 489.337 0.227 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3C=CCN3)CCO2)C1 1836477156 ZFOYGYPWYUNBEH-CKJXQJPGSA-N 472.970 0.103 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836722687 JDNXDMSXUBRPOC-JOCHJYFZSA-N 457.380 0.463 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccc(O)c3)C2)C1 1837460801 KPQPKPLHNSMOQR-MCCBOCGNSA-N 481.509 0.174 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919150 KCEOKQAPLRAGGK-NRFANRHFSA-N 458.364 0.552 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(N(C)C)cc1)CCO2 1838962917 YEMKONCLJRSBRY-QTPRHWQCSA-N 496.568 0.957 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199671 ZJJBIXZKXQWGCW-WMZOPIPTSA-N 470.299 0.578 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1839718682 IJGYTIIGBBVGHD-KUHUBIRLSA-N 456.883 0.230 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1 1840151369 ZNQCLCAAOBWNRW-QRWLVFNGSA-N 451.911 0.142 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)c1ccccn1)CCO2 1840501516 KFOSCDGFHZPLJW-UJYBOAGNSA-N 482.541 0.776 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1 1840645834 PZEKNKKLAZSKJR-JLTOFOAXSA-N 468.348 0.887 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C1)C(=O)NC[C@H]2C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1847100606 NDXKEZQEPDJUIV-KIMHZCHSSA-N 484.981 0.163 50 20 JCGD O=C(NNC(=O)C1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1)C1CC1 15794374 MMZMDHMELYTGIR-UHFFFAOYSA-N 481.531 0.390 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O 23157289 MERJMCKZEYPFTD-AREMUKBSSA-N 490.564 0.740 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)CNC(=O)c1cccs1 725741022 KUTRVWPDFGOYKK-UHFFFAOYSA-N 489.373 0.756 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)n1 728721852 JEHGPFCBSGPYEP-OAHLLOKOSA-N 480.568 0.786 50 20 JCGD COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)o1 730765612 FQUPSHZIIOLNMY-UHFFFAOYSA-N 471.513 0.864 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCC(O)CC1)c1cccc([N+](=O)[O-])c1 745474971 QSTICCSPDVCOJM-UHFFFAOYSA-N 454.486 0.877 50 20 JCGD CC(C)(C)c1ccc(C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)C(=O)N2CCCC2)cc1 748241117 PZRAUNYQOGMVPM-KRWDZBQOSA-N 480.587 0.287 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)cc1 804030536 UFJPGTDFOIGMQV-UHFFFAOYSA-N 455.518 0.116 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)CNc2ccccc2)c1 823328141 JMJHUPDPFREVHC-UHFFFAOYSA-N 461.544 0.706 50 20 JCGD O=C(COC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1cccs1 825248913 ITAIYVPNNDTTPP-UHFFFAOYSA-N 497.551 0.972 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccc(O)nc1)N(S(C)(=O)=O)CC2 913161837 YIDZBHBKFQSFLY-HNNXBMFYSA-N 464.500 0.515 50 20 JCGD COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 916104920 DTVCHXYUMIXYIG-UHFFFAOYSA-N 469.545 0.878 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCS(=O)(=O)NCc1ccccc1 916645272 MCRSHVSVZLYEDW-UHFFFAOYSA-N 482.588 0.352 50 20 JCGD CCC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 917528289 ARHUXLGUUGEWFU-MRXNPFEDSA-N 452.533 0.117 50 20 JCGD C[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CCCCC1 918119399 ARBKSIKZKXBTPC-MRXNPFEDSA-N 453.565 0.526 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCN(c3ccc(F)cc3)C2=O)ccc1Cl 919690547 OQQSRVUOGXMOSL-CYBMUJFWSA-N 454.867 0.941 50 20 JCGD CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 919779015 MOAGHDDKPKMZMQ-ZDUSSCGKSA-N 483.572 0.550 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N[C@H]1CCS(=O)(=O)C1 919886398 WECUQYWKBHRIMW-OLXGIWCBSA-N 470.573 0.217 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779007425 KCPFZCLHSFFFPN-XMMPIXPASA-N 480.525 0.158 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)C[C@H]3COc4ccccc4O3)CCO2)C1 1779028318 CTHDEHSPSRAKFK-UPCLLVRISA-N 481.509 0.359 50 20 JCGD O=C(/C=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)NCc1ccco1 1779208052 DUGMZPDJYPRVPK-NDIJEHHESA-N 458.284 0.972 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)C1 1779371058 AOKMNBSKOWTHNW-BYEUEOSGSA-N 487.557 0.402 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CCc3nc(N)n[nH]3)CCO2)C1 1780097853 OSSSXNOCTSBFTK-OAQYLSRUSA-N 487.473 0.297 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nc1 1780969366 YPUHODDPYHAYTH-VWLOTQADSA-N 496.568 0.880 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781334483 OHHMAGUAGJDSTJ-AEFFLSMTSA-N 485.347 0.203 50 20 JCGD COc1cc(F)c(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1 1781710251 VLNKTINVWZDRGQ-OAQYLSRUSA-N 454.474 0.790 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1 1782042288 GPEUYVNDAXISTD-SGCYSOCQSA-N 455.471 0.675 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C(C)(C)C)nn1)C2 1782212257 MKAFOLVPGKATML-VGOFRKELSA-N 463.583 0.534 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c12 1782373471 XWVIFAZPXLQEOI-DEOSSOPVSA-N 463.299 0.614 50 20 JCGD COc1cc(F)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782854061 SDOWBJCTKLORHK-ZJSXRUAMSA-N 470.306 0.955 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)CCO2 1783538922 YVBVVQYKAYOJHE-NJSLBKSFSA-N 478.384 0.875 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)CCO2 1783876858 XTWDXBKBYQNJJY-VCAMNPENSA-N 475.970 0.440 50 20 JCGD CC(C)CNC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785076443 HLSAHIMEKOUHDB-QAETUUGQSA-N 489.013 0.870 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1 1785488015 PMBDMLMWVJFMOE-XMMPIXPASA-N 477.525 0.638 50 20 JCGD CCOc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cnc2c1cnn2C 1787245638 JULXYGGFTNWNBE-STECZYCISA-N 465.938 0.560 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3COc4ccccc4O3)C[C@@H]21 1787506823 PBQSROVEKGEJRG-FRLZTHOJSA-N 495.536 0.940 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnn3)[C@H]2C1)NC(=O)NCc1ccccc1 1788855013 CCRMHOHHVJACCO-ZJOUEHCJSA-N 481.557 0.416 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c([N+](=O)[O-])cc1O 1789269316 VNPKERHDYJEVCJ-VTBSOJSOSA-N 457.867 0.502 50 20 JCGD CC(=O)NCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1790871366 WEWILNFSFYNHGX-QAETUUGQSA-N 474.986 0.624 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2 1792869932 DQMGMWORCBAVLU-OEYIWLLWSA-N 474.377 0.719 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)COc3ccc(Cl)cc31)C2)[C@H](O)CCl 1792974735 AJXQNPIKAGWIIE-CVGJEZRXSA-N 472.325 0.255 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 1793082924 IBBNVOZDVRNWCX-QMHWVQJVSA-N 490.395 0.995 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1 1793908313 FWTOFWRIGHCXNB-BCDXTJNWSA-N 495.621 0.760 50 20 JCGD Cn1ncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1C(F)(F)F 1794571789 WBUDGDJCOWALQG-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc(N2CCOCC2)n1 1796189231 NKFIRWGZYDEZNR-ACDBMABISA-N 464.331 0.164 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cn2c(Cl)cccc2n1 1796852250 UUEDPTYFKQXQCE-YVWYUNDQSA-N 468.706 0.185 50 20 JCGD COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cn1 1797030781 LFZQWFRJLZEUKN-QDMKHBRRSA-N 452.471 0.432 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2cccc(Cl)c2)CC1 1797114242 FWXMSFVPTIRCJB-UPHUGPLXSA-N 468.746 0.955 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798443522 FOZXCVZNIMNMBM-ORDFZIBCSA-N 455.515 0.692 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800436804 OFOFIAUPRKQLQH-UJMXGEILSA-N 496.402 0.733 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(=O)OCCO)C2 1800760084 AUBPDKKPCYEPGB-ZJOBFFGXSA-N 469.332 0.822 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1)C2 1800977408 NZSIYJCANDIURW-WUUQAYSMSA-N 475.970 0.514 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2 1802333736 ZAFOKQZDTRFMBS-YYIAUSFCSA-N 468.599 0.240 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)CN)[C@H]1c1cccnc1 1804239824 RRCCYDCKQCSCBY-QZWWFDLISA-N 468.986 0.506 50 20 JCGD COc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1OC 1807360174 HWFPLOZCMHTJLD-AVRDEDQJSA-N 490.325 0.807 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)COc2ccc(O)cc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361071 UYPIBKSKMVIXPQ-YADARESESA-N 475.310 0.866 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365293 XJZNIAQNWPLMKO-VGOFRKELSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CC2CCOCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371483 VQFDSAFZMZEYMN-OFNKIYASSA-N 451.332 0.898 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cnc(OCF)cn3)CC2)C1 1809975009 NGIWNHZZCBXBMS-UHFFFAOYSA-N 456.283 0.621 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1 1810084303 NOPKOHNOZHIAJJ-VFNWGFHPSA-N 485.508 0.985 50 20 JCGD O=C(CSc1ncccn1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1 1810123312 JAHBWEDKIWZBQR-UHFFFAOYSA-N 454.361 0.794 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)N1C[C@@H]2C[C@H]2C1 1810160922 SCKPYNGTGSGHRW-FLAFYDAQSA-N 477.569 0.740 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cc(C)c(O)nc2=O)[C@H]1c1cccnc1 1813038372 YNGVKUFQVOQGRF-BQFCYCMXSA-N 463.922 0.612 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2c(O)cc(O)cc2O)[C@H]1c1cccnc1 1813073410 PJPKAPSRLSOARS-NYHFZMIOSA-N 471.514 0.891 50 20 JCGD Cn1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1=O 1815337647 VHMBIWMXTITNTK-AWEZNQCLSA-N 452.301 0.061 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)n1cccc1C=O 1815380940 DJZYFRLGMXZDFT-CZUORRHYSA-N 466.328 0.924 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)N1CCN(C)CC1 1817476898 GMFRJAZMWVHFKX-UZLBHIALSA-N 468.367 0.031 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1 1819402018 IXLVGZHGRYMXNN-MRXNPFEDSA-N 454.491 0.337 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](N)c2ccccn2)[nH]n1 1819402100 NDGIDXZNYYHEAT-IEBWSBKVSA-N 463.502 0.809 50 20 JCGD NC(=O)c1nccnc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1 1823006378 DXPIJRXSPBUDQF-KGFZYKRKSA-N 457.285 0.948 50 20 JCGD CNC(=S)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1828928215 AOVUOJKISOQRJG-IBGZPJMESA-N 460.409 0.084 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)CC2=O)c1 1829635810 ABFGIQDAJORIQN-HFXUHXBXSA-N 495.960 0.104 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1830163926 SNANMPIYFHGRQZ-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD O=C(Cc1ccc(Br)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725897 MRPACBBYVXKTBH-CRAIPNDOSA-N 476.755 0.443 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CSc2nc[nH]n2)CC1 1831876494 GMPAAFLBPHPQJL-INIZCTEOSA-N 451.597 0.890 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832043653 BJLLUEBPJWNWTC-QEEYODRMSA-N 461.943 0.052 50 20 JCGD Cc1ncccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1832636911 PLTUHCHZRIYZDY-DEOSSOPVSA-N 482.541 0.091 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833313216 ABUAWBWGHOCQFK-RDJZCZTQSA-N 462.975 0.001 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C[C@@H]3CCCCO3)CC2)CC1 1833681532 ONPCIOBQVUVXKF-IBGZPJMESA-N 472.590 0.830 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@@H]1COc2ccccc2O1 1833715903 RVMGGPNVCVWJLT-DEOSSOPVSA-N 493.369 0.392 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1834325565 IODBMHIPBKKOBW-AWEZNQCLSA-N 495.422 0.843 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H]3Cc4ccccc4O3)CC2)CC1 1835479315 RCXDCWFKCVORGJ-QFIPXVFZSA-N 471.602 0.935 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccncc3)CC2)CC1 1835737021 HMNJTPNUXPNAHK-UHFFFAOYSA-N 451.531 0.579 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C3CCC(CO)CC3)CC2)CC1 1835737060 JOYJNDPDBVMQJU-UHFFFAOYSA-N 486.617 0.669 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(F)nc3)CC2)CC1 1835737840 GRIOEIFUUTZKHI-UHFFFAOYSA-N 469.521 0.718 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1835927855 YXLGGQZVDHWDJS-PPJWLVRDSA-N 494.353 0.249 50 20 JCGD CN1N=C(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)CCC1=O 1836414170 XIMPWANSRXCTDE-INIZCTEOSA-N 460.348 0.857 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3cccnc3n1)CCO2 1836834447 MAUBOJXFUYTTJA-HSZRJFAPSA-N 470.530 0.073 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837456704 MDPFEFIHLQUVJC-QHCPKHFHSA-N 485.545 0.020 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1 1837457875 UHKUGWJDCCCOSY-QFIPXVFZSA-N 485.522 0.877 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)N1C[C@H]2C[C@@H]2C1 1837919203 QDKPTRGYMZWKQA-MISYRCLQSA-N 469.391 0.319 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)CC2)CC1 1837921547 LHEGDFJFNHIFSO-PWRODBHTSA-N 456.373 0.854 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnncc1C(=O)O)CCO2 1837947520 PVNTVMDJJBUFEJ-IBGZPJMESA-N 452.540 0.096 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3[nH]nc4ncccc34)CC2)CC1 1838049747 UAUQCMJXNDLOTK-UHFFFAOYSA-N 471.562 0.943 50 20 JCGD CC(C)n1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1C(=O)O 1839197727 GQDOGJXIDYMGHD-RDTXWAMCSA-N 491.314 0.923 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200840 QOGWKXYYNRRKFC-GUYCJALGSA-N 489.323 0.517 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839463837 DQXMDXTXTUYRMB-VWLOTQADSA-N 482.342 0.376 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1839963075 ZCYUNHREOQKESL-OXQOHEQNSA-N 483.363 0.441 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1839964051 DLUSQPDMCSJYOH-KUHUBIRLSA-N 466.336 0.973 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1839966462 FPKUQNVHCZZNAQ-DNVCBOLYSA-N 471.352 0.909 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1 1840156332 QVKYAAHZZNAXLC-SIFCLUCFSA-N 463.959 0.610 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1 1840905880 UCNUDTWUGGTBOB-KKSFZXQISA-N 482.375 0.965 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2 1844265241 JVKAJYPIAOTPNS-OSPHWJPCSA-N 460.494 0.412 50 20 JCGD COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)nc1Br 1844613215 CESJSSFBWVAPNZ-UHFFFAOYSA-N 489.330 0.982 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)[C@H]2OCC[C@H]21 1846183779 AOPICIUOUDGUMP-XUWVNRHRSA-N 457.955 0.814 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN2CCN(C(=O)OC(C)(C)C)CC2)C1 1846968126 GSXNCEPQXOTZKQ-MRXNPFEDSA-N 458.987 0.996 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)c2ccccc2C1=O 1848086991 FIXREXCJKSUOTD-ROUUACIJSA-N 455.515 0.248 50 20 JCGD COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 24257101 YXABALPYVHWXOZ-UHFFFAOYSA-N 483.524 0.117 50 20 JCGD COC(=O)c1ccc(F)cc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 727350109 GANYECKSTNSBSF-UHFFFAOYSA-N 473.504 0.551 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cccc(C(=O)NCCN(C)C)c1 727480435 ZVAPXTJUPBVEMN-UHFFFAOYSA-N 489.602 0.724 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)cc1 727799845 VCXZNFQGKMCZAK-AWEZNQCLSA-N 480.465 0.926 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccc(C(C)(C)C)cc1 753010832 WPKRCSJXTJZBIL-INIZCTEOSA-N 468.576 0.189 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1 790006015 DLRJPIALYGQVBV-UHFFFAOYSA-N 455.514 0.618 50 20 JCGD CCn1nc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)c2ccccc2c1=O 791162372 UQYSDNABUNXHLP-MPGHIAIKSA-N 458.544 0.903 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccnn1C)c(=O)n2Cc1ccccc1 914559176 BGFUCEQIODZYJT-UHFFFAOYSA-N 462.514 0.948 50 20 JCGD O=C(O)[C@H]1CC(=O)N(c2ccc(S(=O)(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2)C1 914746283 NMIANMCQOZRVKM-SJCJKPOMSA-N 461.452 0.274 50 20 JCGD CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 915063271 WTDNDCYNAWOZHU-UHFFFAOYSA-N 469.545 0.124 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC1(NS(C)(=O)=O)CCCCC1 916253651 DPQXJJGEILODAA-UHFFFAOYSA-N 474.609 0.484 50 20 JCGD NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 916625475 KFQOFAGPDZIBGV-UHFFFAOYSA-N 481.556 0.263 50 20 JCGD O=C(CCN1CCCS1(=O)=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 918186584 FPWYBOHXMGALMM-UHFFFAOYSA-N 458.562 0.048 50 20 JCGD CCn1c(O)nc2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)ccc2c1=O 919689787 FOFUOBDJZLOGAU-UHFFFAOYSA-N 465.875 0.498 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CN3CCCC3=O)CC2)c1 920826614 PRIQUOHMEXRFQK-UHFFFAOYSA-N 450.517 0.060 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCCc3ccncc3)CCO2)C1 1779028229 HSUOIZSBKZMKEX-HSZRJFAPSA-N 452.515 0.547 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc4c(c3)OCO4)CCO2)C1 1779031713 WYOPQPMLOGXDGV-DEOSSOPVSA-N 481.509 0.490 50 20 JCGD COc1cc(F)ccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779035021 ZZEBBVYNNHPDRH-QFIPXVFZSA-N 457.462 0.590 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnncc1C(=O)O)CCO2 1780097914 RPZDWOITNZINPE-JOCHJYFZSA-N 499.436 0.766 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc[nH]n1)C2)NC(=O)NCc1ccccc1 1780559255 GMFXZNIIMMFYKH-WZONZLPQSA-N 484.561 0.278 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1782864497 NDSLATIKHKYNCL-FBGPZHRUSA-N 481.264 0.695 50 20 JCGD O=C(CCc1cnc2[nH]ccc2c1)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1783680021 OIGBJQJNTXTLPH-XMMPIXPASA-N 462.315 0.319 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(C4CCN(C(C)=O)CC4)CC3)CCO2)C1 1783873908 ADUOMEMREQTGIQ-ZJSXRUAMSA-N 499.052 0.793 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1=NO[C@H](c3ccccc3)C1)CCO2 1783935278 PMEOWDIFBSPGKB-WMZHIEFXSA-N 457.531 0.707 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CC1)CCO2 1783935286 RPNQFICYEUUHJF-CVDCTZTESA-N 481.594 0.493 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784086704 ZGSCCPRQCUEFPP-SIRPWMCASA-N 475.970 0.202 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Cn3ccnc3)C2)C1 1784499178 WCGSMMBEJVIRNH-TVJSXDHMSA-N 455.519 0.483 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3C(=O)c4ccccc4C3=O)[C@H]2C1 1785064494 KHPMBJDHOBTKQG-FZDIXFNVSA-N 477.945 0.906 50 20 JCGD COc1nccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1785647591 KAINKNIAPZWKGY-AGJPEOOQSA-N 469.502 0.213 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNCP(=O)(O)O)[C@H]2C1 1786792870 HQEGOQKICGPIPP-JLBONTIYSA-N 498.423 0.576 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccncc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980182 SDMILPDABSMXPP-VDGAXYAQSA-N 455.345 0.147 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3nnc(C)o3)[C@H]2C1 1787029411 WEYWGIPZLAZLLD-XUFZZIBESA-N 457.491 0.034 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)[C@H]1CN(Cc2ccccc2)CCO1 1788199277 AYXNCBBXQLOSLI-UQVNRYHBSA-N 465.978 0.467 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)c3ccccc3)C[C@@H]21 1788611326 UDALXRCZQVMOBI-YYWHXJBOSA-N 494.552 0.099 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCS3(=O)=O)C[C@@H]21 1790963401 ACZSRSVZGLKXCW-YTFOTSKYSA-N 451.383 0.717 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@@H]1CCc2ccccc2C1 1790993614 UHYNDZPLTYUXPD-NMTNEYKDSA-N 462.355 0.765 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C[C@@H]21 1791254008 LMQJEWZYPBKWSJ-GGXPGOJBSA-N 464.950 0.724 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1C[C@H]1c1ccc(F)cc1 1792808373 MHIORGCUPIYAAI-OQZLWFJBSA-N 452.291 0.512 50 20 JCGD CN1CCN(c2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)cc2)CC1 1792972030 LFPFFYZGUKSWMH-HNJRGHQBSA-N 450.967 0.241 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)CC2)CC1 1793111510 LSPIBEPHUWZZRN-GFOJFJKKSA-N 469.026 0.947 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1793302158 RLGSQXZCLWGLFV-VYMBSIRNSA-N 479.537 0.701 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)c(F)c(Cl)c1)C2)c1ccc(B(O)O)cc1 1795736862 LLDVJGJLMRTIDW-HBCWATKFSA-N 464.661 0.815 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS(C)(=O)=O 1795788231 QBLGBEBPENDIAR-CRWXNKLISA-N 451.973 0.801 50 20 JCGD Cc1nnc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)o1 1795789285 SHVSBJUVMBXJAX-LOUJCGABSA-N 471.942 0.642 50 20 JCGD CCOc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Cl)COC)C3)cnc2c1cnn2C 1796074062 AGSYMUNQIIGXNR-DLTLXFJOSA-N 465.938 0.824 50 20 JCGD Cc1ccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)c2c1 1796269719 OPHVRBVVYVPQSR-YVWYUNDQSA-N 463.498 0.158 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)C2 1797748620 MXEUEGWMAGBFSX-MGKRVJGCSA-N 467.501 0.831 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2 1797953050 ZKBDFSZFFCOTNO-ZUMXRPEOSA-N 464.595 0.434 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(=O)oc1)C2 1798522663 JQGXOWNNUQZITR-YVWYUNDQSA-N 471.422 0.990 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1798637392 SLZLQHPSDGXDPI-QEOTZNIISA-N 474.986 0.908 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)C1 1799198043 RGPNBEOVYNLUAP-XHJNMGKDSA-N 466.362 0.608 50 20 JCGD C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1799322269 GBDYDTHCTCGNJV-NYUBLWNDSA-N 495.621 0.809 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCNC1=N)C2 1800333174 RIJKVBDHBQIIMD-AHHPBITISA-N 458.469 0.301 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nn1-c1cccc(=O)n1C)C2 1800975118 JFOFGGWHXSOODU-UIVXKWKOSA-N 477.949 0.336 50 20 JCGD Cc1nnsc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365117 WADOPOAXVLCFJG-AEFFLSMTSA-N 451.317 0.555 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)c(C)n2n1 1807376597 VFQLJOSWJSSERM-AUSIDOKSSA-N 499.340 0.449 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CS(=O)(=O)N2CCCC2)[C@@H]1c1cccnc1 1808410968 DQOPRXOSRUSKBQ-LNLFQRSKSA-N 472.995 0.767 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809969970 XLTOWJWLZJIKSH-GOSISDBHSA-N 475.351 0.054 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)CCC(N)=O)[C@H]1c1cccnc1 1812777806 XBAZDBNIJFYCOD-JKQORVJESA-N 454.369 0.854 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@H]1c1cccnc1 1813073140 HSSJXDIDSBCZQE-SBUREZEXSA-N 454.531 0.804 50 20 JCGD CC(=O)Nc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)ccn1 1815341244 TYKJHJRLMRCXGB-MRXNPFEDSA-N 479.327 0.716 50 20 JCGD CN1CCCn2nc(C(=O)N[C@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)cc2C1 1815360134 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COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)CCO2 1832042697 IPTRGMRVHOTWLL-BTYIYWSLSA-N 477.986 1.000 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3C[C@@H]3F)CCO2)C1 1832116395 UIMDCKIBCLXLBV-OHNQJVKOSA-N 463.934 0.933 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832945793 AIRQZILMZNINOG-KBXCAEBGSA-N 465.856 0.699 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833025607 DQOBRKQMGBEVSI-ZUOKHONESA-N 499.362 0.234 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1 1833075713 NQDARVAPGPRRPB-LFTXJPJQSA-N 455.471 0.062 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cn1 1833600610 JOBVNDNRKXTMFW-UHFFFAOYSA-N 460.579 0.648 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCN3C)CC2)CC1 1833621648 GIIIWTZPJXPPLU-XLKFHUSGSA-N 471.606 0.786 50 20 JCGD CC(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1834734929 LMBZHVUVLGXSSP-HSZRJFAPSA-N 461.563 0.445 50 20 JCGD CO[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccc1 1834797885 HUCWOSXJTYBRDG-XMMPIXPASA-N 479.386 0.939 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1834824861 NYTOFOQLJMLZAT-NRFANRHFSA-N 481.391 0.625 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CC(F)(F)C(=O)O)CC2)CC1 1835072904 CGFUODUTLOOOJK-UHFFFAOYSA-N 461.510 0.041 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CN3CCOCC3)CC2)CC1 1835118165 BZWMTNLNEAMFFG-OVVQPSECSA-N 487.605 0.024 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cccnc3S)CC2)CC1 1835734384 DJMQAVVJTIOROV-UHFFFAOYSA-N 483.598 0.868 50 20 JCGD COc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)ccn1 1835930401 SDHVZPKALNGMLE-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C)cc(C)n1)CCO2 1836308829 MFAZDWQRIDSJQD-JZZXMACJSA-N 482.541 0.902 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1)[C@H](F)Br 1836414084 WDIUCHQEMYWAJQ-GJZGRUSLSA-N 468.389 0.826 50 20 JCGD CC[C@H](Br)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1836541814 HPZLEXPSXBCUIP-AWEZNQCLSA-N 495.382 0.171 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1836592455 OMBHAKFMRPRNGB-XMMPIXPASA-N 496.369 0.721 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1 1836962105 HPGCPRJWJDTLPM-YWZLYKJASA-N 454.886 0.797 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc[n+]([O-])c3)CC2)CC1 1837240764 LRSIEAWTVBYYDE-UHFFFAOYSA-N 468.514 0.245 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837318733 ZVMVJNVAQNYWAS-MRXNPFEDSA-N 456.490 0.400 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1837716053 YSGXSPGTTCRROM-FQEVSTJZSA-N 465.558 0.790 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1ccccc1=O 1837919212 QSBQUZKPIRLFJB-GOSISDBHSA-N 481.358 0.402 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1C 1838394705 PCHXTACWNJEWEE-UHFFFAOYSA-N 483.573 0.907 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839152175 PUAISTNFLRXKDW-NMGFGJDYSA-N 488.372 0.813 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc2nccn12 1839202785 PHSBUWPYDUFRPZ-KSSFIOAISA-N 470.299 0.798 50 20 JCGD N#Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)ccc1Br 1839400981 LBIDAWGSIYJZOX-QFBILLFUSA-N 486.750 0.990 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1839962415 DGLAKALUKUYODF-SGTLLEGYSA-N 471.308 0.418 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1 1839964935 JKCMLSYQRWCWES-VCBZYWHSSA-N 462.385 0.921 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1 1839999552 IZOPJVQPDZVZFR-AVRDEDQJSA-N 452.935 0.874 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)C1 1840031666 YXZZONMXSBNGNR-IERDGZPVSA-N 497.390 0.772 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nn(C)c4c3CCC4)C2)C1 1840032868 MMIXQZPHSYVEOE-DJJJIMSYSA-N 455.353 0.762 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 1840155607 BFVCCELWCVAUGE-OXQOHEQNSA-N 473.885 0.987 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccccc4n3C)C2)C1 1840184326 GWFSJOLSPFTXGA-XMMPIXPASA-N 471.558 0.621 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)C1 1840218780 PADUQNAQMSJPST-PNHOKKKMSA-N 479.933 0.349 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)c3ccccc3)CCO2)C1 1840800698 OSRFRDHBZSOHJG-GCJKJVERSA-N 467.950 0.517 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)CCC#N)C1 1842812927 PKZWAGORALAGON-IBGZPJMESA-N 484.362 0.309 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(Cc3ccccc3)CCO2)C1 1843924902 JMIXJSCQBYDEEI-NRFANRHFSA-N 478.553 0.403 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)C[C@@H]2C1 1846105263 JTEUHEILWICWBJ-IQGLISFBSA-N 483.374 0.831 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCC(=O)NN(C)C)C1 1847457386 OYFVEEIMDUSCEY-OALUTQOASA-N 471.558 0.342 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN(C)NC(=O)NCc2ccccc2)n(C)n1 1848340379 PIXPBUDPTKLFIP-ROUUACIJSA-N 469.546 0.590 50 20 JCGD O=C(CCC(=O)c1ccc(I)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1 9930589 OFVDGWZYJYWIMH-NSHDSACASA-N 464.281 0.836 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H]1CC=CCC1)c(=O)n2Cc1ccccc1 10161309 NSTHMMKEFNGCOC-KRWDZBQOSA-N 450.499 0.932 50 20 JCGD COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 16785773 JNCLKVNUXQQXBP-AWEZNQCLSA-N 473.573 0.456 50 20 JCGD CSc1nc2nc(C)c(CC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c(C)n2n1 22621689 DGODDCHHAZMYID-UHFFFAOYSA-N 477.572 0.717 50 20 JCGD Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 24880557 OVHLCVHULRSJHW-UHFFFAOYSA-N 455.496 0.757 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1 725871216 DORDZCASIAFTEM-UHFFFAOYSA-N 483.547 0.754 50 20 JCGD COc1cc(Cl)ccc1C(=O)NNC(=O)NCCC(=O)N1CCN(c2ncccn2)CC1 726710494 CJGABJCPCITVHQ-UHFFFAOYSA-N 461.910 0.822 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCNC(=O)c2n[nH]c3ccccc23)c1 726883502 ATGFAXPVLGRAPZ-UHFFFAOYSA-N 458.500 0.394 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)c(Br)s2)c2ccccc2c1=O 745474456 JSTVIQGBYKHOCV-UHFFFAOYSA-N 486.329 0.480 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)[C@H]2Cc3ccccc3O2)cc1[C@@]1(C)NC(=O)NC1=O 748214854 LGABVHLGVKTXEG-OXQOHEQNSA-N 460.468 0.063 50 20 JCGD NS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl 793991101 NGZGTXOYLHDILS-AWEZNQCLSA-N 469.859 0.132 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1)c1ccc(-n2cnnn2)cc1 906441212 CGRHSKSWWACTCJ-UHFFFAOYSA-N 491.555 0.460 50 20 JCGD CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1 913628002 NIZULIHZWLTALV-UHFFFAOYSA-N 458.504 0.493 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)cc1C 916266919 NSLMIRZBXBBVJJ-UHFFFAOYSA-N 454.535 0.575 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1ccc[nH]1)c(=O)n2Cc1ccccc1 916333845 WNNULQWRNYAPPE-UHFFFAOYSA-N 463.498 0.923 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCNS(=O)(=O)Cc1ccccc1 916517330 RVBMJEDJWXBMQK-UHFFFAOYSA-N 488.614 0.649 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@H]1CCN2CCC[C@H]2C1 916572914 GCQJWRCKOMJMLN-OALUTQOASA-N 479.603 0.597 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN(C)S(=O)(=O)CC)nc1 916580444 ZYSBPTFVKAVJAA-UHFFFAOYSA-N 450.587 0.410 50 20 JCGD COc1cc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1OCC(N)=O 916640983 RAELZOZGAIMFQF-UHFFFAOYSA-N 493.542 0.019 50 20 JCGD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 917720132 CMSRTEITLANFDX-UHFFFAOYSA-N 472.501 0.542 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)n1ccnn1)C2 1778093004 ZOWAFTZSJQQHQV-GZLZXURSSA-N 470.534 0.487 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1F 1779036599 BEJFKAOWOAJJEI-QHCPKHFHSA-N 488.495 0.787 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)o1 1779370677 QJFCGAQILGBGQD-AUSIDOKSSA-N 469.303 0.359 50 20 JCGD C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2)N1CCN(C)CC1 1780639268 YLNGPXKTXHTYLZ-NNMXDRDESA-N 454.688 0.988 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)C2)[C@@H](F)Br 1780771006 PAZRRZDOAXDEHO-XNRPHZJLSA-N 462.276 0.996 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2)C(=O)C1 1780794377 VDLKSQHZFVQMIE-VWLOTQADSA-N 490.325 0.236 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc[n+]([O-])cc1)CCO2)NC(=O)NCc1ccccc1 1780968179 GIKYFHAPVRHJCR-DEOSSOPVSA-N 482.541 0.110 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1782804329 ALIMGVLISJOSDC-XPGGBCAFSA-N 464.327 0.922 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(C(N)=O)cc2)C1 1782864859 BLXMTGZMSRZSMD-NTKDMRAZSA-N 480.525 0.225 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnc4ccccn34)[C@H]2C1 1784045733 SHGXLSXEJFQCAV-OTXPKVLDSA-N 491.552 0.991 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3c(C)nn(C)c3C)C2)C1 1784509296 DEGPIILUDFARIM-DZQSVEARSA-N 469.546 0.543 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(S(C)(=O)=O)CC3)[C@H]2C1 1788111856 YCEQLEZWWOVRHE-BZSNNMDCSA-N 475.684 0.489 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1788222167 DKSQWCQTAJACGV-VGWMRTNUSA-N 459.971 0.823 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncncc4c3)C[C@@H]21 1788611388 YYMWUXABZGESOW-ZRCAFCQKSA-N 475.509 0.535 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21 1790176100 NBMPWCNUGUHHBA-XSWJXKHESA-N 459.616 0.661 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc2c[nH]nc12 1790359058 SZHMQROIYNWXPC-NDXORKPFSA-N 462.315 0.458 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3[C@H]4C=CS[C@@H]43)[C@H]2C1 1790625753 ZYFVKSLQUNYTNJ-ZLMOOEKQSA-N 457.556 0.975 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C[C@@H]21 1791257098 OODHHCOESDRHIC-ZIEJDFEHSA-N 468.963 0.973 50 20 JCGD COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1F 1792105978 GEHIWJDJDOSZEP-QSFXBCCZSA-N 456.279 0.421 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1CC1)NC(=O)NCc1ccccc1 1793262545 YOYCORMINASPPX-JHDGKUDLSA-N 453.543 0.336 50 20 JCGD Cc1ccncc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1794102340 RORQQRDJIVVGNB-UPHUGPLXSA-N 452.515 0.225 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796191979 XHKPQTQYGGHMPL-BCDXTJNWSA-N 461.287 0.685 50 20 JCGD Cc1nnsc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1796592059 OTNDSCATFWTOGE-IZZQQSIFSA-N 487.586 0.396 50 20 JCGD Cc1[nH]ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1796653017 WTDYSBFXTWIDAK-HATOLVCRSA-N 468.558 0.873 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)nc1Br 1798388258 BNCOTRDSYQDLKM-QPPBUOOMSA-N 462.728 0.656 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1 1798442825 IGFFOHYTKRXMSV-BTTYYORXSA-N 489.529 0.793 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O)C2 1799273339 DLAUHRWLIFSAIO-RCJHGTSTSA-N 486.997 0.673 50 20 JCGD CN(C)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1Cl 1800312922 WHWJLIHDRRZQQM-YVCBRDFCSA-N 485.777 0.526 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)[C@H]2C1 1800723335 NRBADVSIJSCNTE-ZJZYOEKZSA-N 475.945 0.992 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ccc1O)C2 1801011848 KOXWBLGNZXOYPT-DBWKPXFBSA-N 483.363 0.731 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1 1801352121 MHVFRCWCBOAZKZ-KOUNCHBCSA-N 493.369 0.723 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1805301458 NTCVEIIMAAFTPM-YLJYHZDGSA-N 463.303 0.137 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807362130 DUXZZOYQESOPBM-WGGBDISSSA-N 473.342 0.977 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377154 YQCMZXRCKBDSDK-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1810160795 BNLBQGRZCTYLMD-WCDSQHRASA-N 456.591 0.801 50 20 JCGD CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1 1812774383 RKSRIQUYMSTRTN-JKIFEVAISA-N 466.336 0.813 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C[C@](C)(O)CC(=O)O)[C@H]1c1cccnc1 1813066404 AMCHGXGILODZCP-HVETUWLQSA-N 463.535 0.076 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc3c2NC(=O)C3=O)[C@@H]1c1cccnc1 1813073344 LOHFVUYQHWNLPN-KSFYIVLOSA-N 492.536 0.909 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CNC(=O)O2)n[nH]1 1815277885 LLIPGMPMAOQFJW-KJQHPKAKSA-N 456.463 0.644 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)CC2)c1cccc(B(O)O)c1 1815347783 OOIBJVBJTUXGBG-LBPRGKRZSA-N 456.245 0.864 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3n(n2)CCCO3)[nH]n1)c1ccc(B(O)O)cc1 1817471349 FXUQAVNXWLAWPO-GOSISDBHSA-N 464.291 0.688 50 20 JCGD CN(C)c1ncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)o1 1817473332 NYCKSRSKBXRNRT-INIZCTEOSA-N 452.280 0.763 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1)c1ccc(B(O)O)cc1 1817474925 JHKLWJXUPQBACN-AWEZNQCLSA-N 467.213 0.074 50 20 JCGD CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)[nH]n1)NC(=O)NCc1ccccc1 1820711131 KRFYUVZCJDWPGL-HKUYNNGSSA-N 496.572 0.884 50 20 JCGD CN(C)c1ncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)o1 1825754662 OVJIEPPJDNAESA-IBGZPJMESA-N 454.336 0.968 50 20 JCGD COC(=O)C12CC(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)CC3)(C1)C2 1827060624 VBLUFNMDQRUYQR-NWSMCOELSA-N 468.359 0.943 50 20 JCGD O=C(Cn1ccnc1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828737393 FQGSUPSMADFVNN-AUSIDOKSSA-N 489.960 0.935 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829074073 WTNALHRJPRVDTR-DYESRHJHSA-N 457.380 0.905 50 20 JCGD Cc1cc(Cl)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830119303 QPNOTYLNZDDRPE-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)COC1CCCCC1)CCO2 1830384151 ODCDVIURAGDPSA-QFIPXVFZSA-N 454.568 0.165 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccccc3)CCO2)C1 1830679227 LOSWAMCGAQJEMK-HJCKOOHDSA-N 479.961 0.569 50 20 JCGD O=C(c1cc(Br)ccc1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830730651 BSYCUFXOHXHZKO-MAUKXSAKSA-N 477.739 0.824 50 20 JCGD COCC1(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)CC1 1831373767 LGKGOIUTNVAVLL-OLCUMFGGSA-N 461.519 0.003 50 20 JCGD O=C([C@@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)CCO2 1831522432 ALUFIVXIPSPZHJ-UWJYYQICSA-N 465.934 0.461 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1831687136 JYJFPVKOENCMIG-LIRRHRJNSA-N 462.385 0.636 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1832438093 XPCUZSPSEOLSKS-RUZDIDTESA-N 482.342 0.132 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833312885 KGXBDWRDIMIPNC-IPMKNSEASA-N 455.983 0.913 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@H]1CCc2ccoc2C1 1833364956 NUHZDNYVGNKGDL-FQEVSTJZSA-N 479.386 0.950 50 20 JCGD C[C@H](Nc1nccs1)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835107048 QUFFLXLNCYLGEI-INIZCTEOSA-N 485.419 0.509 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1 1835212522 ABDYYKHIBLILQJ-MGPUTAFESA-N 463.959 0.564 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CC3CCOCC3)CC2)CC1 1835736793 IEAFPWKERIHONG-UHFFFAOYSA-N 472.590 0.687 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737126 ZTPDIVRYYFNNNV-KRWDZBQOSA-N 494.600 0.766 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccncc3F)CC2)CC1 1835738146 VJWGCKJHBFLMLX-UHFFFAOYSA-N 469.521 0.718 50 20 JCGD C[C@@H](Sc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927153 JDIYZHVKIXXPEP-HOYKHHGWSA-N 484.383 0.617 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1 1835937906 ATTHSMMUALCFCN-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)n(-c2cccc(=O)n2C)n1 1836259536 FKDWPRZSXZNAKQ-RXVVDRJESA-N 481.912 0.484 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1 1836896005 LTNFWEOCCFFUDM-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC(OC2CCN(C(=O)CNC(=N)N)CC2)CC1 1837089532 OMPNNVMQRRDIEO-INIZCTEOSA-N 489.017 0.600 50 20 JCGD O=C(C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccco1 1837109828 DCKPLOUZOAQAHF-UHFFFAOYSA-N 454.288 0.455 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1 1838529299 VQOZYANPYFWGQU-KUHUBIRLSA-N 456.337 0.486 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(Cl)c3)CCO2)C1 1838918615 IIXSAHIUZBTIJR-QFIPXVFZSA-N 473.917 0.722 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1839043854 WUBHWYZMYFEYPA-NRFANRHFSA-N 485.006 0.613 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)F)C2)C1)NC(=O)NCc1ccccc1 1839054358 VRACKGSMVXYUDM-HSZRJFAPSA-N 479.553 0.537 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)C#N)C2)C1)NC(=O)NCc1ccccc1 1839054449 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CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)CO2)C1 1847564211 VCXIAAZUHVAIRK-VGWMRTNUSA-N 457.955 0.814 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1848099670 XUDCKLBRGWAAMF-XDQVBPFNSA-N 462.931 0.385 50 20 JCGD C=CCN1C(=O)c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)cc2C1=O 9701860 FEDIXMSHSWHUDQ-UHFFFAOYSA-N 452.379 0.995 50 20 JCGD Cc1nc(N2CCOCC2)[nH]c(=O)c1CCC(=O)NNC(=S)NCCc1cccs1 11523933 CLDDGYMUAVZCKL-UHFFFAOYSA-N 450.590 0.647 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)COc2cc(C)cc(C)c2)c1 15668488 LDFRYOHZJHQBDD-UHFFFAOYSA-N 464.544 0.722 50 20 JCGD Cc1nccn1CCCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 725877519 DKFCTKNGDVXQER-UHFFFAOYSA-N 463.560 0.773 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cn1C 725882084 SGULTXCVAVVDLL-UHFFFAOYSA-N 492.587 0.279 50 20 JCGD Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(=O)Cn3cnnn3)CC2)c(C)n1C[C@@H]1CCCO1 725882882 GPGAZQKYBYRFBZ-FHTAPLDASA-N 452.519 0.548 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)C[C@@H](C)O1 726162041 AUIGYXDQVKBGOC-BRWVUGGUSA-N 470.567 0.873 50 20 JCGD NC(=O)CNC(=S)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1 727065005 PEKMAJINPGBOPP-UHFFFAOYSA-N 486.373 0.844 50 20 JCGD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1 728729908 XKMFKGFREJXHIB-UHFFFAOYSA-N 465.879 0.636 50 20 JCGD O=C(NCc1cccc(OCCN2CCOCC2)c1)NNC(=O)C1CCN(c2ncccn2)CC1 728950412 NQWJCBAEFQXISK-UHFFFAOYSA-N 483.573 0.935 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)[C@@H](C)N1CCOCC1 729623455 JMLXBFTZEJYNPU-JKSUJKDBSA-N 453.565 0.524 50 20 JCGD Cc1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)c(C)o1 732923335 XISQEADFXFNMMG-UHFFFAOYSA-N 484.556 0.406 50 20 JCGD O=C(CCOc1ccccc1)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 747182566 NMRVKARIGUVZBC-UHFFFAOYSA-N 453.542 0.928 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)COc1cc(C)on1)N(S(C)(=O)=O)CC2 771851360 SMCVNGCCXNRLTA-OAHLLOKOSA-N 482.515 0.476 50 20 JCGD O=C(Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O)NNC(=O)c1cn[nH]c1 916147993 RNCLFUMFVRYMIY-UHFFFAOYSA-N 498.503 0.641 50 20 JCGD CCc1n[nH]cc1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 918016248 GMVIXBNCIWKUQA-UHFFFAOYSA-N 492.540 0.811 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1779010738 CXNDCNORAVDBEI-HSZRJFAPSA-N 459.547 0.219 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CN3CCCC3=O)CCO2)C1 1780097339 XZOFVQHBRXIIHG-QFIPXVFZSA-N 474.470 0.586 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781326443 XSDAXPGIEPVAEG-JKDFXYPNSA-N 468.320 0.392 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC13CCCN1CCC3)C2 1782212157 KJUNJVLEVZJDAM-AUSIDOKSSA-N 463.623 0.892 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)CCO2)C1 1783883131 FKBQHAFZWWQRMS-JTSKRJEESA-N 461.902 0.813 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cn3cc(Cl)ccc3n1)CCO2 1783935041 OCEFBSUGSZBUHE-NRFANRHFSA-N 462.938 0.804 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CNC(=O)OC(C)(C)C)[C@H]2C1 1783992248 BKWXMHXWLPCRFQ-LXFSFDBISA-N 478.384 0.635 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@]3(O)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1784009600 ADHCXKSMQHUXQD-KPOBHBOGSA-N 490.395 0.972 50 20 JCGD Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)nc1 1785306757 ZSHNUTJBSAWOPZ-NYVOZVTQSA-N 451.332 0.296 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)on1 1786071753 JCHAZDYGYJVOCU-ZJOUEHCJSA-N 484.557 0.923 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)CC1 1789868667 ZYIRNJVJUCUJNE-BOSXTWCSSA-N 463.406 0.367 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)c3ccccc3)[C@H]2C1 1792119733 LZHDNNCOKQEYPL-YYWHXJBOSA-N 494.552 0.099 50 20 JCGD CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1cccc(Cl)c1 1792978661 LUBAADFVDXMIGV-QJESEZNXSA-N 458.342 0.707 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCO)NC(=O)OC(C)(C)C 1793087436 FVNLBINQHWAIHA-DGADGQDISA-N 463.959 0.106 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)nc1 1795739705 DJQSXLPGRRGZHR-RMFSNUHRSA-N 467.331 0.131 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)n(-c2cccc(=O)n2C)n1 1795933630 VWPSNJIYKFWAGS-JGTCGTHISA-N 451.886 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OCC2 1796794030 AXGZEBDZPIBPFT-CCWDJLKJSA-N 451.483 0.137 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c([N+](=O)[O-])c1 1798442821 HQKXGOUHBHAPCS-QDMKHBRRSA-N 496.480 0.946 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])cc2c1OCC2 1798521035 VZQDNDPFAKKUAR-YVWYUNDQSA-N 475.502 0.106 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)C1 1799200472 XDRNRCOHZVKQLP-FSNPWBFUSA-N 485.654 0.655 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2 1799273641 FLGWWEQNHSLMSO-DCMJDACFSA-N 473.357 0.819 50 20 JCGD O=C(/C=C/c1ccc(O)cc1Cl)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800902953 GRXCKFOPAMYPJW-JMJLSGOLSA-N 470.718 0.642 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1Cl)C2 1801009251 VKGDBKBJBFTISQ-GFENJXEQSA-N 454.930 0.984 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1Br)C2 1801011962 ZFICSKSVIOUVDQ-FVCICTRLSA-N 468.352 0.420 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)c12 1801012603 BNRARDTUKFWYOL-YEZVWNJWSA-N 457.531 0.753 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803138415 ABXSWGPLMBRJEY-YYIAUSFCSA-N 470.954 0.573 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1803791588 PEULOSOLSCDJRG-UGKGYDQZSA-N 461.331 0.745 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1804461202 MYNWKSVRNFPHRJ-XFIYOXNOSA-N 490.001 0.566 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360046 GQVFNVHPXPUDTN-OXJNMPFZSA-N 463.259 0.631 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3cccnc23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375534 PWFIZCNAHSWGLN-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1 1808414361 IBAHBTRGHZTCSU-HGWFVYMKSA-N 465.514 0.500 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1CC(c2ccccc2)=NN1 1812306232 NOTCMRAJUVLEFL-FTBPSBKWSA-N 497.364 0.847 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CN2CCCCC2=O)[C@H]1c1cccnc1 1812976367 DLDXXXJEKJQSKX-FDDCHVKYSA-N 458.563 0.473 50 20 JCGD CN1CCN(C2(C(=O)N3CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)CC2)CC1 1813072095 BEFNPWSMHSDRQN-OFNKIYASSA-N 485.633 0.240 50 20 JCGD CCOC(=O)C1(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1 1815348437 NYHUFVBJEJYZLN-AWEZNQCLSA-N 457.317 0.392 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)Cc2ccccc2)[nH]n1)c1ccc(B(O)O)cc1 1817474985 KQBQZABIYSPQBC-RTWAWAEBSA-N 462.315 0.999 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2ccccc2=O)n[nH]1 1817518425 YBXSQJPZZUCATF-KRWDZBQOSA-N 464.486 0.576 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc2c(n1)OCCO2 1817961220 FOKDQTMZWUARCD-GOSISDBHSA-N 477.286 0.875 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)C3=NNC(=O)C3)sc2C1 1819666384 BOROKUJKWVNJEL-CTWDJJQWSA-N 456.488 0.065 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cncn1)CC2)NC(=O)NCc1ccccc1 1822518747 SKQULMCNTHTQDS-MRXNPFEDSA-N 497.585 0.693 50 20 JCGD C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNCP(=O)(O)O)CC2 1825641365 HEQBCAUFVHPINO-HTQZYQBOSA-N 455.271 0.563 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCC([C@@H]3CCCCN3C(=O)[C@@H](F)Cl)CC2)n(C)c1=O 1827609260 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O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cc(O)ccc4n3)C2)C1 1835937127 PTTDVTDNQDYWBJ-VWLOTQADSA-N 491.309 0.004 50 20 JCGD Cc1nc(C)c(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)o1 1835940260 FADNQRFBSZMJSZ-UHFFFAOYSA-N 454.336 0.470 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(Cl)c1 1835941854 SKHYSRDQXSQARM-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3cccc(Cl)c3)CC1)CCO2 1836578182 UVTUCCFUTIFMOR-DEOSSOPVSA-N 498.772 0.822 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837483704 XOOPHILDSFNDEL-JDFRZJQESA-N 460.304 0.424 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(-c3ccccc3)no1)CCO2 1837997153 JOSTXNWQVBWGMQ-DEOSSOPVSA-N 485.541 0.785 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3ccnnc3O)CC2)CC1 1838103253 UEQGXUQWMVFDDE-CVKSISIWSA-N 483.529 0.928 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)CC1 1838300655 XGLHXJTXNBSYMG-IBGZPJMESA-N 491.402 0.840 50 20 JCGD O=C(c1cnc2ncccn12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201511 ZJNHGVKDBHFHLA-DYVFJYSZSA-N 456.272 0.490 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840033181 XADPBEWZKVPPOD-PZPQDCAKSA-N 484.351 0.360 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1840034016 YBVYYUPJSADWMX-FZKQIMNGSA-N 455.309 0.260 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840035072 FPOJKULVFUVGQY-QDVHYIHRSA-N 484.347 0.996 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1840435664 JJMYWNNYBWPDFR-IBGZPJMESA-N 457.369 0.821 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)CCO2)C1 1840915533 MOCUOXUYJHIQTC-WIEQDCTASA-N 490.985 0.229 50 20 JCGD O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014754 YEUTYIYUEQORFN-UHFFFAOYSA-N 458.283 0.660 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)CC2=O)c1 1844263389 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913500029 BTDAKMCXRJXXGJ-SQFISAMPSA-N 494.595 0.743 50 20 JCGD COc1ccc2c(=O)c(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)c[nH]c2c1 915357447 KCNIGYRDUGDMBG-UHFFFAOYSA-N 458.496 0.927 50 20 JCGD CN1CCN(c2ccc(CNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cn2)CC1 916247125 BTAQJFCRYRWTAS-UHFFFAOYSA-N 475.575 0.228 50 20 JCGD C[C@]1(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)CCS(=O)(=O)C1 916649879 VMNCCORPHRLVCO-YJBOKZPZSA-N 460.578 0.025 50 20 JCGD C[C@H]1CCCN(C[C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1 919914457 HGWYZUUZCPCOFU-DLBZAZTESA-N 453.613 0.764 50 20 JCGD O=C(CNC(=O)c1cc(F)cc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 919963156 IBWKOXUQIQVWBK-UHFFFAOYSA-N 466.466 0.940 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)c1 1322064591 XNFQHPZSPFIJIJ-UHFFFAOYSA-N 460.512 0.707 50 20 JCGD O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)c1csc(N2CCOCC2)n1 1324479072 TWLQNQLYHYXSJH-UHFFFAOYSA-N 474.543 0.596 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1 1779031802 GJZXJXQCVMVHJL-FQEVSTJZSA-N 455.500 0.380 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)ncn3)C2)C1 1779818325 RFCJOHKJVDDHAR-ORBAKXMTSA-N 459.894 0.708 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1780203835 WPUBVHSIRBFHQD-UGSOOPFHSA-N 484.282 0.813 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1)NC(=O)NCc1ccccc1 1780968750 PIAZQUSPTITOAK-YYYGAUAXSA-N 499.616 0.634 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)C1=O 1781332251 XCANPWJXADQNGZ-KBXCAEBGSA-N 454.252 0.955 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782210556 ZTIFVIKDIQQYPW-YGKZAACZSA-N 483.610 0.787 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1OC 1783935097 PEGNENQGWJXMOB-QHCPKHFHSA-N 462.547 0.829 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)n(C)n3)[C@H]2C1 1784240479 VLZRICKNTIJMPH-PEMCSMIHSA-N 469.546 0.385 50 20 JCGD 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0.849 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1C 1835737049 UGYICRYBOZARNL-UHFFFAOYSA-N 467.574 0.831 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCCn3ccnc3)CC2)CC1 1835738306 UPXQPGDJVHTRHX-UHFFFAOYSA-N 482.589 0.547 50 20 JCGD O=C(CCCCn1cccc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930576 NMWAJRIBQKMKMQ-DEOSSOPVSA-N 469.347 0.108 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934343 WIULWDSJWNALCM-RUZDIDTESA-N 495.316 0.230 50 20 JCGD O=C(c1ccoc1I)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836261999 AYSOHBOQASMHPU-LRDDRELGSA-N 498.701 0.554 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1 1836711033 GQOPCEMCWGUQSN-RTBURBONSA-N 486.374 0.568 50 20 JCGD O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)CC2)CC1 1836715328 PSUPPIGLDJPXHN-SCLBCKFNSA-N 482.965 0.591 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1cnccn1)CCO2 1837610652 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C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)CCO2 1839084463 DCUZTWHKMZDFEU-ULMVMLMRSA-N 472.380 0.627 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1839151926 IIGFAIBCQKFXID-PWIZWCRZSA-N 459.374 0.644 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840183505 IBXKGEHLOGBRSH-QHCPKHFHSA-N 462.547 0.067 50 20 JCGD CCn1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c2ccccc21 1840184154 VUJIJDJRVDUFIL-DEOSSOPVSA-N 486.573 0.499 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C(C)(C)C)cn3)C2)C1 1840184478 PHFAGYKUWWRQDC-QHCPKHFHSA-N 476.578 0.217 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(F)cc1 1845009305 RUUVHDMAOSEZOO-HXUWFJFHSA-N 453.279 0.200 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C1 1845230311 ZZEATXDUUMDSCU-KSXCTLEASA-N 490.561 0.600 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C1 1845437683 GBGUBJHOXKILTF-ANDSAHIGSA-N 462.507 0.167 50 20 JCGD C[C@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)[S@@](=O)c1ccccc1 1845777452 PKXKOXHZHFCOFH-IBADJEFMSA-N 455.540 0.698 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1F 1846894441 XKPJYZXPCLOAIK-UHFFFAOYSA-N 460.292 0.040 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1847040118 JGLJFHXQYRVDPK-SAABIXHNSA-N 457.336 0.487 50 20 JCGD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)C2=O)cc1 13082417 HVWSASZKRPUBQV-HSZRJFAPSA-N 478.465 0.815 50 20 JCGD C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)NNC(=O)CNC(=O)c1ccco1 725872898 SVJILISFXZDWKZ-ZDUSSCGKSA-N 456.459 0.446 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)n1 728723806 WDSVJPWEFBNTHJ-UHFFFAOYSA-N 460.516 0.509 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNC(=O)[C@H]2c3ccccc3C(=O)N2C2CC2)n1 728732640 APEHHBVGXMTHCN-HXUWFJFHSA-N 485.522 0.160 50 20 JCGD O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 742454094 STWVGMNJGMSVOO-OCCSQVGLSA-N 462.450 0.571 50 20 JCGD CN(C)S(=O)(=O)c1ccc(I)c(C(=O)NNC(=O)N2CCOCC2)c1 745986017 IRDMQOIPEWBCPF-UHFFFAOYSA-N 482.300 0.228 50 20 JCGD CN1CCC(N2CCC(NC(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)CC2)CC1 747987062 DDEFEXQUVZNLNL-UHFFFAOYSA-N 492.646 0.974 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)CC2)cc1 748271764 GDEAGVLYMVJDHV-FQEVSTJZSA-N 458.540 0.452 50 20 JCGD NS(=O)(=O)c1cnn(CCC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)c1 749388772 ANLLYGIJJPUOKY-UHFFFAOYSA-N 480.510 0.630 50 20 JCGD N#Cc1ccc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 769642921 GZUUYEPSBZRTEL-UHFFFAOYSA-N 450.860 0.494 50 20 JCGD CN(CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)[C@@H]1CCS(=O)(=O)C1 914532050 WHVZZBAYNQFEEY-LJQANCHMSA-N 483.554 0.268 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1cccc(S(=O)(=O)N2CCCC2)c1 914748698 ZMLKDDMUNGTRAL-UHFFFAOYSA-N 496.567 0.923 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCNS(=O)(=O)/C=C/c2ccccc2)ccc1Cl 915787703 OUOWZPIFYWFYEV-PKNBQFBNSA-N 486.959 0.729 50 20 JCGD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 916095485 VXYUKFDZOONBHC-UHFFFAOYSA-N 479.906 0.649 50 20 JCGD CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 916646835 QFSXPHAHZJFIMO-UHFFFAOYSA-N 483.572 0.331 50 20 JCGD COc1ccc(C(=O)NCCNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 918001731 HECLDMJUKIYBSJ-UHFFFAOYSA-N 462.532 0.671 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC3CCN(C(C)(C)C)CC3)nc2)CC1 918095053 XERNEOWJNSZWNX-UHFFFAOYSA-N 453.613 0.907 50 20 JCGD CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1Cl 919885498 PLXGLYUZNAFABL-NSHDSACASA-N 466.969 0.548 50 20 JCGD Cc1nc2ncccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1778632983 PAKMROOFKKVSLV-HOYKHHGWSA-N 492.540 0.478 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCN(C)CC2)C1 1778845612 AOWWWNUHDNRMDU-MBOZVWFJSA-N 459.429 0.779 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779373466 UNUIAXNMERKHHX-SRDOKRBCSA-N 481.557 0.708 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)no3)C2)C1 1779671837 DZZBXFRLHXCDDP-HXPMCKFVSA-N 458.899 0.956 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2)C1 1781356175 XMDHSRZYYKLEAA-QEEYODRMSA-N 463.959 0.346 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1781487277 LASCTGYOMVXYJV-CTRXZIQJSA-N 452.939 0.314 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCN(C)CC1)C2 1781998451 VPJWAHSJAJUZTK-SQGPQFPESA-N 459.429 0.921 50 20 JCGD COCCOCCOCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2 1782063845 KGGBUPZLINKCIX-DBXWQHBBSA-N 464.987 0.824 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(=O)n3[nH]cnc3n1)CCO2 1782864971 ZIXCVESAOQBUHB-RGPRSXKESA-N 495.446 0.746 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)CCO2 1783936018 AIUGQWDBSSWRMH-NRFANRHFSA-N 465.482 0.479 50 20 JCGD C[C@@H]1[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CCN1C(=O)OC(C)(C)C 1783939857 MNZRCWHFFNDTGS-NXMSCROESA-N 495.621 0.835 50 20 JCGD COc1ccc(COCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1784098379 BLLHJGODSXRMGX-XMMPIXPASA-N 483.525 0.354 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787506838 PYYPKCXYUQSDEH-IOODAUMOSA-N 460.535 0.015 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726699 NMJYOLFXSFJURS-NSYZTORCSA-N 488.633 0.686 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(Cl)n3)C[C@@H]21 1791288598 KANLFODNZOQLHY-XIRDDKMYSA-N 451.955 0.630 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)c2c1 1793970849 DQMBHXIIAMOKEX-MRSFGVLCSA-N 455.559 0.981 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(Cc2cccs2)C1 1793976029 GACRMZYBOOVTEL-DBHNTLKXSA-N 491.614 0.059 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)COc2ccc(Cl)cc21)c1ccc(B(O)O)cc1 1794023833 OWOMKBRYGWVJQB-REPLKXPHSA-N 497.744 0.697 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794112962 KWQAYMJPYCLGEJ-ZUMXRPEOSA-N 464.595 0.434 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc2nc(Br)nn2c1 1796189166 GBTCKRWJFOAJKR-BJWYYQGGSA-N 498.146 0.737 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)n(C)c(=O)n2C 1796982825 GGNLNHWOACNWLG-DPYKFYPSSA-N 465.348 0.864 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1c(=O)n(C)c2ccccc21 1797172916 MDXUNQITXXHQRY-NXEZDXNNSA-N 450.923 0.183 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797753617 BGUNWJCBGMYHHM-DBWKPXFBSA-N 484.469 0.124 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)ccn1 1798122020 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JCGD Cc1cc(C)n(CCC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807373325 BLDFHFDNXOZKCD-XUZZJYLKSA-N 475.358 0.985 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C2=NNC(=O)C2)[C@H]1c1cccnc1 1808417563 MNFQTJWPTDQRMV-IFQKHITRSA-N 464.486 0.097 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1 1810054775 IPRVGDMUCDHZRR-HRAATJIYSA-N 485.508 0.756 50 20 JCGD Cc1c(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cnn1C 1810300448 YJNYDSXNPVIEGQ-UZLBHIALSA-N 462.514 0.755 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CNC(=O)CNC(N)=O)[C@@H]1c1cccnc1 1814231752 VSVPRSYWALKYBR-YWZLYKJASA-N 484.469 0.903 50 20 JCGD CCN1CCC(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1 1815364173 OQJPPRIWJHNEEO-QGZVFWFLSA-N 456.377 0.781 50 20 JCGD O=C(CNC(=O)c1ccco1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1815648846 BEJOWOGKYVCNML-CQSZACIVSA-N 468.300 0.072 50 20 JCGD CC(C)(NCCC#N)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1817315921 VQVHBHGFUAFEAS-GOSISDBHSA-N 452.324 0.677 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1)c1cccc(B(O)O)c1 1817475022 JNDJVOBPCWVZFH-IBGZPJMESA-N 455.324 0.118 50 20 JCGD Cn1ncnc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828549108 VNVWDYRJAIGZMO-VGOFRKELSA-N 490.948 0.481 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)CCO2 1830429272 UAXVQLMLWNRRCE-NMMYMHLASA-N 476.549 0.759 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1833587824 GRSSWXWDNGBWSK-QHCPKHFHSA-N 485.545 0.020 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1833714374 VNMXZOFLMPOOAQ-OAHLLOKOSA-N 493.468 0.072 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3)CCO2)C1 1834951250 WQSBNIIBXQVRBF-FXVMGJAWSA-N 483.525 0.656 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1 1835048315 NFRGJLZMRXHFNK-FXZATJRASA-N 485.516 0.959 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3sc(N)nc3c1)CCO2 1835788164 ODMDXWPMVRTNDX-JOCHJYFZSA-N 490.586 0.322 50 20 JCGD O=C(CCCc1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926524 QFGPAEKCOZJJEO-RUZDIDTESA-N 484.333 0.598 50 20 JCGD Cc1cc(C)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835939251 IUZBKAKZSDIXGY-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836878323 GDRNWAIIBWRJFD-UHFFFAOYSA-N 474.562 0.212 50 20 JCGD COc1ccccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837456945 TZIBEIXROLMXOE-RUZDIDTESA-N 497.552 0.397 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ccoc4c3)C2)C1 1837459355 DHIRWZBIOVMPNG-XMMPIXPASA-N 479.493 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C34CCC(CC3)CC4)C2)C1 1837461598 ZFLZOEWBCIUUIK-FSEIRDBJSA-N 471.558 0.726 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCOC3)CC2)CC1 1838395532 ZELMWSLOQNSKTN-MRXNPFEDSA-N 459.547 0.724 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn2[nH]cnc(=O)c12 1838471373 MUSCVBHLINQBRG-WOJBJXKFSA-N 486.356 0.637 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528457 ZPIVIASJXYWQCZ-FPTDNZKUSA-N 492.485 0.115 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839518976 OTWQKKAFZQPQTG-SCLBCKFNSA-N 457.325 0.519 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCO1)CCO2 1840014437 FMGFYWZGECJZHY-SIKLNZKXSA-N 477.470 0.769 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1 1840185395 QENWNTWFSDFIEF-OAQYLSRUSA-N 454.474 0.408 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c12 1840185723 WBZQDCHALCJGRP-DEOSSOPVSA-N 487.557 0.620 50 20 JCGD COc1cc(C)ccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840186725 CZNBIPDOOMAGOQ-QHCPKHFHSA-N 462.547 0.447 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCC(=O)N2CCCC2)C1)NC(=O)NCc1ccccc1 1841875282 RVSZWIYHJCXFSQ-UHFFFAOYSA-N 484.601 0.939 50 20 JCGD O=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)CN1Cc1ccccc1 1843013183 RHFJXZOAJUEFEP-HXUWFJFHSA-N 461.327 0.232 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)CC1 1844265442 CKYKALWRLXCMMO-UHFFFAOYSA-N 458.519 0.371 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1)C1CC1 1847619795 FSALLIQBUYZOPU-AABGKKOBSA-N 471.363 0.875 50 20 JCGD O=C(NNC(=O)c1cc(O)nc2ccc(S(=O)(=O)Nc3ccc(F)cc3)cc12)C(=O)NC1CC1 9889776 PLBCCIFXSLQRAI-UHFFFAOYSA-N 487.469 0.920 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc3n[nH]cc3c1)c(=O)n2Cc1ccccc1 726374486 GSYSJMUAUXQTIV-UHFFFAOYSA-N 486.492 0.765 50 20 JCGD CSc1nc2nc(C)c(CC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c(C)n2n1 728848132 WRLKWUOIDNJHJF-UHFFFAOYSA-N 455.548 0.860 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1 729276215 ZLPSQZFHQQFCAI-JTQLQIEISA-N 492.938 0.979 50 20 JCGD O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1 729346190 JVYJVXPVXDIONW-HNNXBMFYSA-N 457.453 0.717 50 20 JCGD Cc1nn(C)c(C)c1S(=O)(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 731051361 VDPNPPLUKWFWSS-UHFFFAOYSA-N 485.588 0.000 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccc3nncn3c1)N(S(C)(=O)=O)CC2 749719884 GBPYMULVRQCALL-MRXNPFEDSA-N 488.526 0.457 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H]1Cc3ccccc3O1)c(=O)n2Cc1ccccc1 789855618 ZACIHXNJLLZAAH-LJQANCHMSA-N 488.504 0.579 50 20 JCGD Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c1C 912919048 HIAOIJWUXOUNSO-HZPDHXFCSA-N 454.593 0.845 50 20 JCGD Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 913497581 BCXOTUGDAZYXEA-UHFFFAOYSA-N 468.557 0.050 50 20 JCGD Cn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)c2ccccc2c1=O 913572969 AAZNQKWPOKBYTR-UHFFFAOYSA-N 484.321 0.980 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(F)c(S(C)(=O)=O)c2)c2ccccc2c1=O 918754223 JXASKSATGQNMAP-UHFFFAOYSA-N 482.515 0.972 50 20 JCGD CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919885479 PIBXCQQUJIBDAE-WMZOPIPTSA-N 482.584 0.660 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 920033129 VRCZGZQPGFJBRQ-GIHFNCESSA-N 474.481 0.227 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3c(Cl)ccc4c3OCO4)C2)C1 1777799611 ODCQTNQPSXERNT-JOCHJYFZSA-N 472.690 0.506 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4ncccc4c3)CCO2)C1 1779029700 XHFOQQOBDVAYGP-RUZDIDTESA-N 474.521 0.920 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779032826 XEGIWFFZUVXARP-HSZRJFAPSA-N 469.498 0.460 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)c1ccco1)CCO2)NC(=O)NCc1ccccc1 1780969487 MOGJUJLQTMQRQI-URXFXBBRSA-N 485.541 0.489 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)n4[nH]cnc4n3)CCO2)C1 1783341471 FIUNXRGKDLFWTR-APPDUMDISA-N 453.297 0.035 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1)CCO2 1783870884 IFUUZGIVCMZNND-MDKPJZGXSA-N 488.006 0.746 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C[C@H]2C[C@H]21 1784083982 ITDJTIIATZFIOP-XTESEXHKSA-N 471.982 0.964 50 20 JCGD CCOC(CC(=O)N1CC[C@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2)OCC 1784164718 JKQBJICAKXOMTK-OLCUMFGGSA-N 463.535 0.740 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(O)cn3)C2)C1 1784641433 RUVRZHOSJOAOAQ-IBUSPFOHSA-N 454.487 0.294 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)C34CC(C3)C4)C2)C1)NC(=O)NCc1ccccc1 1784836204 USDSINFWCDYTGL-TVNWEXPRSA-N 455.559 0.963 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(F)c3)C[C@@H]21 1788610803 VLNWXECMTRSRML-YSSFQJQWSA-N 455.490 0.660 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(F)F)C[C@@H]21)NC(=O)NCc1ccccc1 1789726668 LJBSCEYRTHXBKA-BZSNNMDCSA-N 467.517 0.968 50 20 JCGD CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1790255754 ZPKZSVPEMGYIKW-WPUCRFQZSA-N 494.397 0.905 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4sc(C)cn4c3=O)C[C@@H]21 1791254721 SGDVKYXWJXNFES-TUUVXOQKSA-N 468.963 0.912 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791290854 BQXQHPWRCALYHT-UGUYLWEFSA-N 452.581 0.296 50 20 JCGD C/C(=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21)C(=O)O 1792167475 FQNNHTPPMVJOMV-IKWYWRLNSA-N 487.557 0.343 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1C(=O)Cc2ccccc2C1=O 1793053242 ULYQWBVHDREBEQ-VWFIUDSGSA-N 477.945 0.445 50 20 JCGD CC(C)(C)OC(=O)N1CCC(O)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)CC1 1793664793 WKQKYRVTKZSMKJ-LXTVHRRPSA-N 463.934 0.872 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)ccc3c1OCO3)C2)c1ccc(B(O)O)cc1 1795734644 WWYWORSNOWSOIT-HBCWATKFSA-N 472.690 0.266 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)c(F)c1)C2)c1cccc(B(O)O)c1 1795737813 VVEYSUGDEBNDJM-FAQVEIGNSA-N 458.270 0.481 50 20 JCGD O=C(CCN1C(=O)c2ccccc2C1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188259 IDWBVMTUJXNKGR-REPLKXPHSA-N 475.310 0.305 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2c(c1)CCCC2=O 1797021877 OITKSMMQBSZVFD-BBIADKPPSA-N 462.311 0.402 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)ccc21 1797503605 ILZDVVLTCQYBQP-REPLKXPHSA-N 462.315 0.122 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccc3)CC1)C2 1797748725 YCCBMGYVBWVLAD-BBIADKPPSA-N 492.580 0.805 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc(C(F)(F)F)n1 1798083133 LNFYAPHMYIMHQF-ZSBFGKGUSA-N 463.221 0.297 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)NC(=O)OC(C)(C)C 1799684158 CQJXZGKQPPSUIT-DIACKHNESA-N 450.330 0.203 50 20 JCGD O=C1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)Cc2ccccc2)N1 1800436093 QRFLUKVZKCVXDI-FSNPWBFUSA-N 464.360 0.861 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1 1800854982 WTQZZYRIFVVOPR-ACDBMABISA-N 459.315 0.821 50 20 JCGD COC(=O)[C@H]1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)C1 1800964971 QONSSSPXQRCYCO-CFAUTMRTSA-N 487.557 0.689 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1 1801049807 GORCELYLMYKGEE-AUGJRDSBSA-N 490.395 0.731 50 20 JCGD CCn1c(-n2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)CCC(=O)NN(C)C)cc2C)cccc1=O 1802332748 HCLCYQWLUJTYTR-REPLKXPHSA-N 497.600 0.987 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)C(=O)N(C)C)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1806944022 NQFCPDRSALCHTQ-IFMALSPDSA-N 495.584 0.522 50 20 JCGD CCc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n(C)n1 1807363325 ZHURWUYZFOMJHJ-PGRDOPGGSA-N 461.331 0.691 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CSc2ncccn2)[C@@H]1c1cccnc1 1807572885 MNGXZZQAYXBWOW-UZLBHIALSA-N 492.565 0.982 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810526534 BSFJTWPACVPVRF-PTSWNOGYSA-N 465.514 0.090 50 20 JCGD COC(=O)C12CC(C(=O)NC[C@H]3CCN(C(=O)c4cnccc4C(=O)NN)[C@H]3c3cccnc3)(C1)C2 1812835938 JMKALNSENPKTIQ-LINFSVTHSA-N 492.536 0.743 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1 1813071072 MIUCDRZTXWFDCH-IERDGZPVSA-N 459.576 0.863 50 20 JCGD CCn1nc(C)cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1816712396 PVDZOAIMZMZZIG-HNNXBMFYSA-N 453.333 0.887 50 20 JCGD CCOc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1 1817471263 UALQLTVWELIODD-GOSISDBHSA-N 464.291 0.898 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)[C@@H]1SC(=N)NC1=O 1817475577 UQRVWJVEHWLYOE-KCTSRDHCSA-N 484.347 0.198 50 20 JCGD CC(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822518989 ZKBJJCGRWYHXFH-OAHLLOKOSA-N 458.544 0.990 50 20 JCGD CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)CC2 1822841101 HXQIDAYYVPEPJR-GHMZBOCLSA-N 493.977 0.520 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1823436416 CWRBUUAPWUODHI-MJGOQNOKSA-N 455.324 0.700 50 20 JCGD CN(C)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828927422 DMPCOUKBQSTLRI-WMZHIEFXSA-N 480.993 0.990 50 20 JCGD CCSc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1829576521 UUTPZSQPYHOVKX-QHCPKHFHSA-N 485.371 0.257 50 20 JCGD Cc1ccc(F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1830075151 VXGANAOSSJPYEM-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD O=C(c1cc(=O)c2ccccc2o1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830307027 UWPMHAVEHPCWBX-IERDGZPVSA-N 450.875 0.463 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)CCO2 1830419589 XEYMBRIFSFCWNM-RQTOMXEWSA-N 482.317 0.379 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)nc1Br 1830731191 HQIQPUMCQOLDNB-UGSOOPFHSA-N 492.754 0.522 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CCC(CO)CC1)CCO2 1832519365 ZCXPCBWIUHAHMI-IURXLQRKSA-N 489.573 0.376 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCn3c(=O)oc4ccccc43)CCO2)C1 1832759798 SNZVWLIZFFPICB-ZHRRBRCNSA-N 481.933 0.695 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cn1 1833310537 MOVNWSVYBRIDQR-IBGZPJMESA-N 487.022 0.411 50 20 JCGD CCc1oncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834312059 UTURSYUZZSFXOI-UHFFFAOYSA-N 454.336 0.416 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C(=O)NCC(C)C)CC2)CC1 1835128300 BVNKYTUINRSIQG-OGLMXYFKSA-N 487.605 0.464 50 20 JCGD CC(C)n1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1835204098 KGZOEYQJDSDNBG-UHFFFAOYSA-N 468.367 0.038 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1nc2ccccc2[nH]1 1835296902 BSKIAINJWSOQDD-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930465 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O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cccc4ccnn34)CC2)CC1 1837920181 QNESXKLLVUYWIM-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838526801 DNZGQLKURSVEQL-RSDPBLMXSA-N 493.513 0.997 50 20 JCGD CSc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1O 1838564698 QQRJCYHHFMCYTI-HSZRJFAPSA-N 486.355 0.178 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3nc4ccc(F)cn4n3)CC2)CC1 1838717069 NCYUBXGUAUNUBJ-UHFFFAOYSA-N 489.552 0.854 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(C(F)(F)F)c1)CCO2 1838935721 JTFFHIHGVZRJID-JOCHJYFZSA-N 492.259 0.769 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccc(F)cc1 1839038828 DQBZUYHJWYVVKE-DBXWQHBBSA-N 471.913 0.059 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839725400 HGIZEUPCNGRCMF-ABFIKHOGSA-N 494.353 0.549 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C(=O)OC)(C1)C3)CCO2 1840007308 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COc1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c([N+](=O)[O-])c1 1844264745 CNLXNRLAVGGIPK-UHFFFAOYSA-N 468.470 0.662 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2nn[nH]c2C(F)(F)F)C1)NC(=O)NCc1ccccc1 1844807389 BHQCXUHIIGQMSC-UHFFFAOYSA-N 494.478 0.987 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1845003731 UWZIIRPXSCRURI-CQSZACIVSA-N 468.489 0.460 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)[C@H]2OCC[C@H]21 1846184247 CJZQJCZFMPPCKV-XUVXKRRUSA-N 499.373 0.208 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@H](F)CN1C(=O)OC(C)(C)C)C2 1846386514 UZNIQUXJVJFELN-HOTGVXAUSA-N 469.558 0.910 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)NCCCOC)c1 728263093 QOWZTMBODZUGJW-UHFFFAOYSA-N 456.974 0.900 50 20 JCGD CN(C(=O)CN1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1)C1CCCCC1 728594247 KGIBPOTWAGZOST-UHFFFAOYSA-N 493.634 0.743 50 20 JCGD O=C(CCNC(=O)NNC(=O)c1ccc(Br)cc1Cl)N[C@@H]1CCS(=O)(=O)C1 728956313 QXKALZWIGSGDFV-SNVBAGLBSA-N 481.756 0.740 50 20 JCGD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)C1 728959638 OLRNMONBTUZLEH-IBGZPJMESA-N 480.573 0.925 50 20 JCGD Cn1c(=O)nc(O)c2nc(CCC(=O)NNC(=O)c3ccc(F)cc3Br)[nH]c21 746236105 PVLTVHOJAMCJCO-UHFFFAOYSA-N 453.228 0.658 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccnn1C)N(S(C)(=O)=O)CC2 748833957 FDWTWIRZUYJVLQ-OAHLLOKOSA-N 451.505 0.147 50 20 JCGD O=C(COC(=O)CCn1cnc2ccccc2c1=O)NNC(=O)[C@H]1COc2ccccc2O1 792694103 PGAGRUVRYLOTGW-GOSISDBHSA-N 452.423 0.317 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 913455089 JINNNGTZANYZGH-UHFFFAOYSA-N 479.511 0.751 50 20 JCGD Cn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)c2ccccc2c1=O 913573077 PWEKOBAHZAFUTP-UHFFFAOYSA-N 494.327 0.436 50 20 JCGD CN1C(=C(C#N)C(=O)COC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)N(C)c2ccccc21 914653443 KEZLBTVOFGMVJJ-CABCVRRESA-N 472.523 0.456 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1C 916562558 QHPNAMOQDNMYQR-UHFFFAOYSA-N 476.511 0.529 50 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50 20 JCGD CCn1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n1 1780968487 AMBMRVKAWSRLBG-XMMPIXPASA-N 483.573 0.693 50 20 JCGD COc1ccc(OC)c(CCCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1781324354 TVJRCGRDUXUVBW-SANMLTNESA-N 496.369 0.850 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)[S@@](=O)c1ccccc1 1782688585 YHPYBNLDDJRPMH-JPBCIWCSSA-N 464.588 0.386 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1783538541 UYKHZVGBYWDQPR-DIFFPNOSSA-N 455.334 0.983 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1783666963 PGPXEUQITVPTLM-MAUKXSAKSA-N 451.358 0.669 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1785272175 FJSZEUUCNBIMGT-QHCPKHFHSA-N 485.733 0.736 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCC4)C[C@@H]21 1787508884 ZXSPMSCYQMKTQX-AYOAJRLASA-N 467.530 0.557 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)n1 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JCGD CC(C)(NCCC#N)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1807148082 VAOONIICXWJNFD-FXAWDEMLSA-N 478.557 0.682 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2csc(N)n2)[C@H]1c1cccnc1 1807231667 BNLMNRHQDCTSIY-CXAGYDPISA-N 466.527 0.752 50 20 JCGD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc2nccn12 1807372836 IWXFTSWYKIEUHX-UGKGYDQZSA-N 484.325 0.746 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CC[C@@H]2CCOC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373369 CSDZRQMQSHXJBW-MONBJTKQSA-N 451.332 0.898 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375355 SMTXYRGPFNNKLI-PIPMEXSNSA-N 461.331 0.614 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C(=O)NCC(C)C)[C@@H]1c1cccnc1 1808417534 LBMULNVPRUBHCM-ZLWFPSTDSA-N 481.557 0.994 50 20 JCGD Cc1c(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cn2[nH]cnc(=O)c12 1809978068 TXQALQOLMFAKOW-UHFFFAOYSA-N 477.330 0.169 50 20 JCGD Cc1cc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1C 1810295134 RBOZZXKGRJUZQH-HTAPYJJXSA-N 476.541 0.684 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302481 KMZSSMVZNQUBOI-XLIONFOSSA-N 478.557 0.682 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)C(=O)C(=O)O 1810544433 LNXKRNIDYZSUEM-CRAIPNDOSA-N 450.568 0.482 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1812863240 FYKBPHIAHQYABI-LNSITVRQSA-N 463.269 0.596 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1 1813029936 BKFIBAAEWYGPQD-KEYYUXOJSA-N 459.894 0.386 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)[C@H]1c1cccnc1 1813073039 LCALXNZMGFVDIH-FFZOFVMBSA-N 492.577 0.304 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1 1813176274 WPCCLIIVKDTHKY-PGLHNWFYSA-N 491.508 0.146 50 20 JCGD CNc1nsnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1814431309 DQIJRZVJGBAHCQ-CQSZACIVSA-N 455.309 0.602 50 20 JCGD CCN1CCC(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1 1815347902 WSDDAERTSJZZIE-KRWDZBQOSA-N 456.377 0.781 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc2c(c1)CNC2=O 1819367904 XMUORHOTPIDLDU-INIZCTEOSA-N 476.323 0.606 50 20 JCGD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1)N1CCN(C)CC1 1820787867 PFKGXTFRKWPRPX-KXBFYZLASA-N 483.577 0.350 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3ccccc3-n3nccn3)sc2C1)c1cccc(B(O)O)c1 1823548007 MKISMSSEHQKIEV-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1824466628 HMTXZZARQZGNBL-LJQANCHMSA-N 450.366 0.034 50 20 JCGD O=C(Cc1ccc(O)cn1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1827051929 VUYCHNNLXNEHKD-HNNXBMFYSA-N 452.301 0.392 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829715923 DQXYEAZYPBYEAB-CRAIPNDOSA-N 464.426 0.665 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830363524 ABTBZYJZTVZYPJ-XOBRGWDASA-N 463.959 0.551 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1830398710 AWCXSXJRZZBBQP-OALUTQOASA-N 456.547 0.539 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(=O)n3C)C2)C1 1830538149 XFYDKBOMNZUUIV-IFXJQAMLSA-N 456.337 0.486 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725769 RSEQSBXLNYIDSW-IERDGZPVSA-N 469.922 0.317 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2)C(=O)C1 1830730847 FEMIDDSOFUGWNI-XMSQKQJNSA-N 478.933 0.469 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1 1831874537 KEPHLAXTNNTVJQ-SFHVURJKSA-N 490.561 0.749 50 20 JCGD CCn1nc(C)cc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834984354 UZAFHAJIYHCTNV-UHFFFAOYSA-N 482.589 0.709 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1 1835250628 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DLGXNGPWAZMNEL-UHFFFAOYSA-N 453.304 0.393 50 20 JCGD Cc1n[nH]c(C)c1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919245 TWQBQEJTMIAPRU-UHFFFAOYSA-N 454.336 0.632 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cnc4ccccn34)CC2)CC1 1837919370 JTQLXQLYRDDOKN-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD C/C=C(/C)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054205 LQMDOSCIXLCWPU-IHXJRPOTSA-N 473.574 0.755 50 20 JCGD C[C@@H](CC(N)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839741825 DDLBTNOIOQLWOA-BRLOGJFQSA-N 476.480 0.840 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1839965142 OBOADNDGRDLNHN-BZNIZROVSA-N 460.285 0.561 50 20 JCGD CC(C)c1nc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)no1 1840031572 URTZKUACQIHGTL-UGSOOPFHSA-N 459.341 0.975 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1840033776 PSELAXWGAKCCJR-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCOCCOCCOC)CCO2)C1 1840076343 GHLGOAGPILXERN-RXVVDRJESA-N 464.987 0.920 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1 1840077724 ICIBLJWVMUGCGM-LPHOPBHVSA-N 481.384 0.296 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC=CC[C@@H]1C(=O)OC)CCO2 1840143850 GVJPNUXCUBFFCR-NWZZKEMCSA-N 458.939 0.452 50 20 JCGD O=C(CSc1nc[nH]n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840381006 HOOLPJPZCHOABK-BXUZGUMPSA-N 452.306 0.044 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C1 1841298594 CTYQXBUKXQMBFT-MMDHUZEPSA-N 476.534 0.209 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)/C=C/C2CC2)C1 1841373646 HPQFBYDLDMXGCD-ZRFOIIEFSA-N 497.401 0.972 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263171 BECCYDPLCWINMN-CQSZACIVSA-N 460.535 0.663 50 20 JCGD O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2ncn3c2CNS(=O)(=O)c2ccccc2-3)C1 1844623409 NNCPWFKZFLRRTE-OAHLLOKOSA-N 479.946 0.081 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)CO2)C1 1846119196 ATRFCUINXXHYOL-GJZGRUSLSA-N 457.955 0.816 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1 1846386345 BQLQHNZGNBGLGX-QGZVFWFLSA-N 483.566 0.019 50 20 JCGD CSCC[C@@H](O)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1846395642 RMODBTIPMVFGIR-GOSISDBHSA-N 463.604 0.650 50 20 JCGD Cc1ncc(Br)cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1848324456 ZBLIQUMUCQCWGD-ROUUACIJSA-N 458.121 0.962 50 20 JCGD Cn1cc(C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c2ccccc21 10737074 FVVKJPBYBQYEBQ-GOSISDBHSA-N 492.579 0.721 50 20 JCGD C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 16203373 XCTFVTUSQSLOFU-ZDUSSCGKSA-N 454.480 0.414 50 20 JCGD N#Cc1cccc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)c1 728825902 VHBXKLJKMGRSMO-INIZCTEOSA-N 454.464 0.957 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ncoc1C)N(S(C)(=O)=O)CC2 729515563 HWEGDAOZFPZMTJ-CQSZACIVSA-N 452.489 0.710 50 20 JCGD COC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)c1 751282376 KLYMGYRZDDXJAM-UHFFFAOYSA-N 460.262 0.568 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cnc(C)cn1)N(S(C)(=O)=O)CC2 913161511 NCFZXPIZGQDOHD-INIZCTEOSA-N 463.516 0.512 50 20 JCGD Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc(C3CC3)nc21 914338880 BKVHVQVLRLRRNZ-UHFFFAOYSA-N 471.499 0.279 50 20 JCGD CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 916228371 ADGMHTDQKNJOSA-UHFFFAOYSA-N 483.572 0.130 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1)N[C@@H]1CCS(=O)(=O)C1 919884850 HONGDXOOILWGQT-CMPLNLGQSA-N 459.322 0.320 50 20 JCGD O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)N[C@H]1CCS(=O)(=O)C1 919885867 OLHZCUUKFYKING-HNNXBMFYSA-N 470.504 0.758 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1 1779028218 HHCMZBSHGPGPHP-OAQYLSRUSA-N 476.440 0.439 50 20 JCGD Cc1nc2ccccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030002 DGKYBDBYXDVUDJ-HSZRJFAPSA-N 463.498 0.399 50 20 JCGD O=C(O)c1cnncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1779698856 YYGUDQMZPCCVPG-PBFPGSCMSA-N 459.272 0.993 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1781861249 PAIRXIRZKUTCQQ-UUWFMWQGSA-N 454.351 0.896 50 20 JCGD COCCOCCOCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1782064753 VDVZDXMCIKOGSE-MBOZVWFJSA-N 450.960 0.170 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(-c4ccc(O)nn4)cc3)C2)C1 1782115315 BQVADVFIMPTBMA-VWLOTQADSA-N 488.309 0.286 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)C1 1782256539 SPZBHDOLLZDPMK-LDHQQMMRSA-N 489.997 0.472 50 20 JCGD COc1cc2c(O)cccc2cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1782390521 OAZQBGRHKYIVTM-SANMLTNESA-N 490.321 0.991 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)n2cncn2)C1 1782529397 RFAQJDSSUBFQNX-IGXHXOIESA-N 470.534 0.487 50 20 JCGD 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CCOC(=O)[C@@H]1CCC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)C1 1784073265 TXSLBSNUCYAIIU-WPVAHCMFSA-N 480.606 0.709 50 20 JCGD CC(C)(C)OC(=O)CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784136478 IEFUIIUXFLPXIE-IHPCNDPISA-N 474.363 0.472 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)n4[nH]cnc4n3)[C@H]2C1 1786974920 BFOQSZMHPQOOST-UHXUPSOCSA-N 467.324 0.042 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4cccnc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786979817 RLXOCOBHTONOPS-NYVOZVTQSA-N 459.311 0.822 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1O 1786981725 IXWTYPTUYWFMGK-LRQRDZAKSA-N 468.315 0.378 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)nn1 1787508850 WVMFGXNGIRZWBK-GDJYOZILSA-N 483.529 0.603 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)c3ccccc3)C[C@@H]21 1788610808 VQAFYETYVLLFDQ-KNTRFNDTSA-N 453.499 0.012 50 20 JCGD 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CS(=O)(=O)c1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)nc1 1827056164 PRSZIMUYHWAQIU-JOCHJYFZSA-N 499.398 0.712 50 20 JCGD CN(CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)CN)CC1)NC(=O)NCc1ccccc1 1827584524 GLFUJBLGTCPXRD-SFTDATJTSA-N 473.622 0.238 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CNC(=O)O2)CC1 1827677242 NROFDYUGLHGXIP-BWJSHVIVSA-N 458.519 0.849 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)N1C(=O)OC(C)(C)C 1829640426 ZDOYIACZZQIVIJ-DOWNOZBLSA-N 489.997 0.831 50 20 JCGD O=C(Cc1c(F)cccc1Cl)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830285888 IFFCHVSENRJSCA-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCN(C)CC3)C2)C1 1830537760 NVCRPGJSFUATNR-PXNSSMCTSA-N 475.428 0.111 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1830538659 LYZGYLQENHRJTC-BFUOFWGJSA-N 482.335 0.536 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1830573679 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CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3C3CC3)C2)C1)NC(=O)NCc1ccccc1 1839054272 QTALIBOWQDAZQG-AOJNWGRGSA-N 499.612 0.835 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1 1839144965 PMCFWSVLELIKOK-MGPUTAFESA-N 450.927 0.829 50 20 JCGD CC[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)CC1 1840057026 FVNJCUHIOUUOIP-JXQFQVJHSA-N 458.364 0.653 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3C)C2)C1 1840151073 VEZAOZDTYIIBOY-MZKRTTBSSA-N 465.978 0.753 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)c(OC)c3O)C2)C1 1840154617 AIJWDHPDAJCCDZ-VFNWGFHPSA-N 472.922 0.733 50 20 JCGD Cc1cc2cccc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2[nH]1 1840184651 ZQIAYYWGLZUFMY-DEOSSOPVSA-N 471.558 0.919 50 20 JCGD Cc1ccc([C@@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840184714 CAKDHASYXHJOHS-DVECYGJZSA-N 460.575 0.928 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)C1CC1 1843010326 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914829994 NUJZNTWGBGSOMJ-HZPDHXFCSA-N 451.545 0.680 50 20 JCGD O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1nnc(O)c2ccccc12 916267894 RVUBUAMDBKFEMU-UHFFFAOYSA-N 455.475 0.924 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)NCCCn2nc3n(c2=O)CCCC3)c2ccccc2c1=O 916649843 LEQJOHYDIAKZIU-UHFFFAOYSA-N 468.518 0.706 50 20 JCGD CN(Cc1ccccc1)C(=O)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 918091296 ZULDRALHYHRXKR-UHFFFAOYSA-N 489.554 0.310 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 919807503 RYXAEPZKTZLYIZ-UHFFFAOYSA-N 461.500 0.816 50 20 JCGD CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N(C)CCCC(=O)O)cc1 920385478 ZBPNTOWNBZXNCO-HNNXBMFYSA-N 474.561 0.382 50 20 JCGD O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)CN1C(=O)CNC1=O 1317698329 GKBTYXYKWJNWHR-UHFFFAOYSA-N 478.553 0.483 50 20 JCGD COC(=O)C12CCC(C(=O)N3CC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)(CC1)CC2 1778303797 WHWWQYMWVKMPFM-DDJHWDJXSA-N 484.358 0.324 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1 1779037378 YNSOUUUXTOTRSX-HSZRJFAPSA-N 476.497 0.023 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1780202810 WESCIIYTBVKSSI-BLVKFPJESA-N 480.319 0.905 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n1 1780970016 QHVIATGLLHZFMZ-VWLOTQADSA-N 496.568 0.880 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782158877 DJSDQCJIDDBIAL-UPUUWEMXSA-N 484.358 0.249 50 20 JCGD CCOC(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)OCC 1782339626 MCMUZJZFRSJMEQ-AUSIDOKSSA-N 462.352 0.283 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1 1782482995 STSSHHYLWQNJCB-JOCHJYFZSA-N 467.461 0.458 50 20 JCGD O=C(CCCc1cccnc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782650984 VCYRYMYGNZWMKU-RCZVLFRGSA-N 465.359 0.912 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1783185816 WWAJRGCEIAGJMY-OFUJIHMTSA-N 488.589 0.939 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCO[C@@]3(CCN(C(=O)[C@@H](Cl)COC)C3)C1)C2 1783882736 QQNFQURBMVAUKK-PONJGIIJSA-N 482.965 0.706 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1cccc(Br)c1)CCO2 1783935181 QHZVODKWMOHDRX-TZIWHRDSSA-N 497.390 0.685 50 20 JCGD COc1ccc(Cl)c(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1F 1784055188 ZLFBWLMLIBRZKW-QHCPKHFHSA-N 490.724 0.854 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CCc3cnccn3)C2)C1 1784559235 YTOMMMUJXNJSJD-SYOQMXFQSA-N 453.503 0.373 50 20 JCGD NC(=O)c1ncccc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1787013625 KCUULEHFCCKPMC-UHFFFAOYSA-N 458.283 0.922 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cnc2c(Cl)cccn12 1787242635 JCGUWWQEHGKHLF-KNBMTAEXSA-N 482.733 0.575 50 20 JCGD Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(C(F)(F)F)o1 1787481897 QKZTWGYWBSQOCL-IHRRRGAJSA-N 475.468 0.968 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1788093364 SWKHIWSPCXCLCH-FQMQPWHVSA-N 477.961 0.913 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4ccccc34)[C@H]2C1 1788333892 YCPXDGUIOYDKQT-IXDGSTSKSA-N 463.498 0.469 50 20 JCGD CC(C)n1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610951 CBHODDFBFWWKIJ-FNHZYXHNSA-N 455.519 0.370 50 20 JCGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)CBr)C[C@@H]32)cn2[nH]cnc(=O)c12 1789172259 BNQQLLRPPZANPF-MZGVZZPPSA-N 480.363 0.955 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O 1792780235 LPXCONXGAQSNEO-YHDJZSDMSA-N 467.950 0.009 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Cn1cccn1 1794207279 JOVAUVQOXURLBP-LEGQKXAZSA-N 455.519 0.243 50 20 JCGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cn2[nH]cnc(=O)c12 1795114822 AGJQGEIAXTYNLD-JJLQDPRZSA-N 452.309 0.319 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)c1cccc(B(O)O)c1)CC2 1795741304 SWUUJRJHPRHGNY-KTIHBUSBSA-N 478.354 0.383 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nn1C(F)F)C2 1796441677 OVBLIQQKHCBLAN-SUGIQXKYSA-N 477.472 0.924 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C)CN(C(=O)OC(C)(C)C)C1 1797276282 ICGBFMYVQWLABJ-HGKCTWBKSA-N 481.594 0.206 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2 1797873007 KNKVDZBXTDWYDI-VYSMIANISA-N 458.346 0.421 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNCP(=O)(O)O)C2 1799217769 GCHQLCQKUFTUDD-BTTYYORXSA-N 484.402 0.497 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-c2cnco2)c1 1799648023 OYJOWWOGCJJOCB-OPMZPASUSA-N 455.515 0.918 50 20 JCGD Cc1cn(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)c(=O)nc1O 1800334271 NFJSPEABXXTWJJ-QDQGZUORSA-N 499.474 0.732 50 20 JCGD CC(=O)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1800513355 LCXWCHITZYOYAE-ZMMAXQRCSA-N 452.349 0.718 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1cnccn1)C2 1800641705 IEJIDHLLVSKXTL-JAAXMTQOSA-N 468.352 0.358 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2 1800978346 AZZAYENWDVESML-XRGAULLZSA-N 465.894 0.136 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)c3ccccc3o1)C2 1801009047 MZQCRGNMYZKDRG-YEZVWNJWSA-N 456.499 0.369 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1N(C)C)C2 1801012516 MKHQITKBEKNOHF-USGNIVHTSA-N 476.534 0.237 50 20 JCGD CSc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1801178692 GSGPGKVELOSWPH-VPTLXERWSA-N 469.567 0.853 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1 1804599818 WTFOQBHQNCDBPN-BJWYYQGGSA-N 481.509 0.803 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807362125 DUXZZOYQESOPBM-NYDSKATKSA-N 473.342 0.977 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)no1 1807365808 YTRVRFTYKNPOPN-WZONZLPQSA-N 491.313 0.406 50 20 JCGD N=C(N)SCCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807366428 ZEESQVGKBULGQB-LPHOPBHVSA-N 455.349 0.098 50 20 JCGD CCN1CCC(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1807374790 NESXETRETWWKFH-GMAHTHKFSA-N 464.375 0.813 50 20 JCGD CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1 1811625851 PDIUCUVTTAOAEB-KKSFZXQISA-N 490.524 0.902 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360658 WKZFIHSDBGYGFV-XJKSGUPXSA-N 493.354 0.262 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360663 WNAGPWABLPVHPX-OAHLLOKOSA-N 453.333 0.631 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](N)CN)sc2C1 1817064180 ULBGVHOKTACDNS-NHCYSSNCSA-N 460.988 0.473 50 20 JCGD CN1CCN(CCC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)CC1 1817153808 RJPAFYFASYGSJI-HXUWFJFHSA-N 468.367 0.033 50 20 JCGD COC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)cn1 1817540195 IEBTZXHPWQUSKS-LBPRGKRZSA-N 495.521 0.863 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(O)nc3)sc2C1 1821486160 GZHGJPGDPKHUEJ-LLVKDONJSA-N 453.484 0.782 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCS(=O)(=O)CC1)CC2 1825993714 DPCSDZUATHKBPH-NEPJUHHUSA-N 464.997 0.039 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)[C@H]1SC(=N)NC1=O 1827674337 WMEGSUDZCATTHC-ZSZQSSIHSA-N 480.635 0.782 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCC(N)=O)CCN2C(=O)OCc2ccccc2)C1 1829306152 LWKGZMMUZQFDJW-WZONZLPQSA-N 494.976 0.958 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCN(Cc4ccccc4)C3)C2)C1 1830726035 NQAGDUQPYSZJHU-LGVFNWMJSA-N 480.005 0.955 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C1)CC2 1830736925 XUFYKKXGELJVRR-HFJQGTKSSA-N 466.962 0.856 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1)n1ccnn1 1831170695 JAWUAWNLMICQFC-DNVCBOLYSA-N 454.535 0.771 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1831693977 DNDSXWDPARGKKO-SUMWQHHRSA-N 452.321 0.296 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc(O)cn2)CC1 1832317371 KBLVZWQQCOJWNR-JOCHJYFZSA-N 451.332 0.943 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1832438450 XRWSKUQPRWBTAB-VWLOTQADSA-N 497.552 0.451 50 20 JCGD COC[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1833526778 FHPMGUYKPWJVAF-MSZQUAHTSA-N 460.579 0.975 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@@H]1CC(=O)N(C2CCCC2)C1 1833686060 OHMSZWKIZSZOMT-UZLBHIALSA-N 469.026 0.949 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3C[C@@]3(F)Cl)CC2)CC1)c1ccc(B(O)O)cc1 1834799029 KYJVHXOUXPQXFR-RXVVDRJESA-N 451.735 0.476 50 20 JCGD Cc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834799898 BMZIMHXVUYVVSG-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD Cc1cc[nH]c1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737082 LFSWEEOOTIXYNP-UHFFFAOYSA-N 453.547 0.821 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1 1835937062 MUIFHKLXWWGIJZ-QHCPKHFHSA-N 498.732 0.280 50 20 JCGD CC(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939557 SVYQGFKEVJHRRX-VWLOTQADSA-N 466.343 0.874 50 20 JCGD O=C(c1nc(-c2ccccc2)ns1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836249880 MTKUBHOIJBWZOB-FOIQADDNSA-N 466.947 0.875 50 20 JCGD CN1N=C(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)CCC1=O 1836414171 XIMPWANSRXCTDE-MRXNPFEDSA-N 460.348 0.857 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1 1837026400 VYZNFZAERJNTJO-DEOSSOPVSA-N 491.508 0.012 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1c[nH]c3cccc(Cl)c13)CCO2 1837180357 LOCNVQVZSIJXBY-XMMPIXPASA-N 497.744 0.885 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCCC3(F)F)C2)C1 1837456192 KRXXTMLUOXKGKC-UTKZUKDTSA-N 481.500 0.581 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1C 1837459362 DNKLXTQIXARKLE-DEOSSOPVSA-N 467.526 0.686 50 20 JCGD CCOc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459856 NNYWXMHAGQBPEX-XMMPIXPASA-N 483.525 0.468 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CS[C@H]3CCCCO3)CCO2)C1 1837509346 XOZNZGLFTNNQNJ-SIKLNZKXSA-N 493.586 0.015 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccnc(Cl)n3)CC2)CC1 1837921110 AYXCMNAJRQGMHG-UHFFFAOYSA-N 472.738 0.736 50 20 JCGD CN1CCC[C@H](C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)C1 1838394734 QYUBHODZKUNHMZ-KRWDZBQOSA-N 472.590 0.639 50 20 JCGD C/C=C(\C)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054207 LQMDOSCIXLCWPU-ZVUKBESYSA-N 473.574 0.755 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1839143706 GFLROBRBMXNGPY-ACTFIFLWSA-N 489.997 0.831 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1839148104 MVXSELRAKPVKGL-AVRDEDQJSA-N 450.967 0.857 50 20 JCGD CC(C)c1nc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)no1 1839199170 RTASWRRLOXSIBL-WMLDXEAASA-N 463.304 0.882 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839351681 HGZTVAPCOCXDDQ-KBXCAEBGSA-N 458.284 0.546 50 20 JCGD Cn1nc2c(c1C(=O)N1CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C1)CCC2 1839583717 OQWRTFKEOHMHNO-NRFANRHFSA-N 450.612 0.830 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839880998 IOAHDMSXGMPITQ-KVDKEEBASA-N 476.480 0.853 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1839965248 RVNUMTAVWZEESI-KXBFYZLASA-N 466.336 0.973 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1839966528 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10792538 VJHXUQSSUZZPJP-UHFFFAOYSA-N 481.914 0.979 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)c1 15764885 GEQAYTGKEJTMGW-AWEZNQCLSA-N 468.507 0.633 50 20 JCGD O=C(NNC(=O)[C@@H]1CCOC1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 109259108 RDFDWSTUDUMGSY-HXUWFJFHSA-N 472.567 0.991 50 20 JCGD CC(=O)Nc1nc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1 727350619 RJDWVZGNIPZZGZ-UHFFFAOYSA-N 461.547 0.284 50 20 JCGD Cc1ccc(CCC(=O)NCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 728340828 NWUAWXPSYCNIEW-LJQANCHMSA-N 455.467 0.574 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1 728488660 OMPOSVUKIOBKIR-UHFFFAOYSA-N 472.470 0.941 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)C2CCN(c3ccc4nnnn4n3)CC2)c1 728529764 NSDZEWLNEIELTN-UHFFFAOYSA-N 475.307 0.968 50 20 JCGD C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCS(=O)(=O)N1CCOCC1 748111185 IDDVGBCHHYYADS-HNNXBMFYSA-N 450.517 0.600 50 20 JCGD CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 811874891 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C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNCP(=O)(O)O)C2 1779543603 KSDLYKCGSBHWDE-RHSMWYFYSA-N 451.533 0.077 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CSC(=N)N)CCO2)C1 1780097173 RRGPYALZDLYFNT-IBGZPJMESA-N 465.488 0.590 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1NC(C)=O 1780211093 PVDOBVQZGNBJKU-XMMPIXPASA-N 481.314 0.091 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc3ncnn3c2)C1 1780549996 INULYEUKPJLZFI-NTKDMRAZSA-N 492.540 0.098 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1781232481 VDAOSRXOYANCIQ-OALUTQOASA-N 454.314 0.769 50 20 JCGD COc1cc(C)c(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1OC 1781893031 BIYIACOKCCVWPE-HSZRJFAPSA-N 462.547 0.829 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(F)c(OC)c1F 1781949815 ZJLLDTIGKFHXML-QHCPKHFHSA-N 490.268 0.419 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c3c(nn1C)CCC3)C2 1782213216 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CC(C)(C)OC(=O)N1CC=C(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)C1 1784343257 FEQDGRDGXRLHIO-JBACZVJFSA-N 499.373 0.137 50 20 JCGD O=C(/C=C/c1ccc(F)cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784862894 SHJQMEBQYGNHSO-WWJWVQJMSA-N 470.281 0.951 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(Cl)n3)C[C@@H]21)c1cccc(B(O)O)c1 1786984695 YYKWSUBUKSVCRU-SNRMKQJTSA-N 457.723 0.251 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1[C@H]2Sc3ccccc3[C@H]21 1788622916 VVHIWKHVARVTIW-YIDIZNGVSA-N 478.379 0.848 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ncccc1C(F)(F)F 1788995400 JTKHRSPVVVDZJA-ZVZYQTTQSA-N 477.248 0.687 50 20 JCGD CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1 1789523509 DKOWCTXSZCCJKH-UHFFFAOYSA-N 467.530 0.806 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cccc([N+](=O)[O-])c3=O)[C@H]2C1 1790652571 RWBJOIPZYZYVOQ-HOSILWTGSA-N 485.335 0.767 50 20 JCGD 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CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1802225815 DGUCDKZJELIYBG-XFIYOXNOSA-N 496.026 0.552 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncn3nc(N4CCOCC4)ccc13)C2 1802332866 IVVHELJQKJHWLZ-BCDXTJNWSA-N 498.588 0.191 50 20 JCGD COCC1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1803537809 SYPFAEWLVBYPHT-LPHOPBHVSA-N 452.515 0.826 50 20 JCGD CC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)C2)CC1 1806900258 CCSCSNYRMFAIGY-HNNXBMFYSA-N 478.981 0.682 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1807119714 DKOXCNGSMZVFJB-BSDSXHPESA-N 483.997 0.929 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CC2CCOCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361648 CMIRUKWYUFBPQZ-NZQKXSOJSA-N 451.332 0.898 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365806 MNBJXPDKOOERRL-IKJKNFHUSA-N 490.369 0.482 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C2CCC(O)CC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374098 IFOJEFMNTBWDBB-ZIVFUPILSA-N 451.332 0.632 50 20 JCGD Cc1ncc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1810298593 KEXFJRHWJTUMMA-JXFKEZNVSA-N 460.498 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1 1810302453 JFHUYOMWFLVTQE-KUHUBIRLSA-N 490.480 0.202 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1)C(=O)C(=O)O 1812391693 DPSONLBHCJENEO-OHNRDTAOSA-N 459.330 0.867 50 20 JCGD CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1 1812778443 HUVZVULNSNWLRL-YCPHGPKFSA-N 469.336 0.804 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813071923 YWOJDLZIKXQKKA-ZZXHSXFOSA-N 496.572 0.594 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)N1C[C@H]2C[C@@H]2C1 1813072189 BBPSZZAEFMFRLQ-LNNATVOCSA-N 456.591 0.801 50 20 JCGD O=C(CSc1ncccn1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815340100 GDEMVFGKJGHCLF-CQSZACIVSA-N 469.357 0.631 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3[nH]ncc3c2)[nH]n1)c1cccc(B(O)O)c1 1817476092 FDDGDDXKGKJJLO-SFHVURJKSA-N 459.275 0.981 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1828953517 PDCIPKZRHMMBAH-VXKWHMMOSA-N 488.346 0.095 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)NC=O)CCN2C(=O)OCc1ccccc1 1829228093 QSURVYUNONVFIY-WCAVRKLYSA-N 494.976 0.827 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)CCO2 1830574137 ZUMOEZCNBBAZGD-KSMMKXTCSA-N 494.383 0.112 50 20 JCGD O=C(c1cnccc1C(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726076 UAASVPYQJXONAI-WMLDXEAASA-N 451.829 0.770 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830736954 CAIKERLLFGUVNC-JLHGSKIFSA-N 489.997 0.690 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1 1830737126 ATHMXKWMTPAGFC-KUHUBIRLSA-N 461.943 0.100 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830737708 IKUSUKCCWYVFAT-DNVCBOLYSA-N 473.935 0.743 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831157810 RUMCNCCLNDQMHU-UUOWRZLLSA-N 484.383 0.617 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)CC2)CC1)[C@@H](O)CCl 1833308638 ZHJLABVWWVGAIC-ACJLOTCBSA-N 481.981 0.164 50 20 JCGD CN(C)C(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1835436342 WVUSVBORNRHATB-DYESRHJHSA-N 482.375 0.537 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C(F)(F)F)o1 1835935028 CFUBTTFTMGDXPY-OAQYLSRUSA-N 496.247 0.670 50 20 JCGD O=C(C[C@@H]1CCCCO1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837048856 CMXQTYWQMVHMED-QFIPXVFZSA-N 458.364 0.938 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837164476 IGHBJZGICRNNKY-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD Cc1ccsc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457093 VRFAZDUXEMDADL-NRFANRHFSA-N 459.528 0.439 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)C(=O)CC4)C2)C1 1837459962 PPJGLBSHDFAZCI-VWLOTQADSA-N 493.520 0.198 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838499054 MVIUOPBOLWKTMS-XOBRGWDASA-N 494.346 0.191 50 20 JCGD O=C(Cc1ccc(Br)nc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839027613 KFSVFIQYIQRLQP-KBXCAEBGSA-N 476.755 0.443 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc1 1839197919 LZQOPQNIWYYLJI-YOEHRIQHSA-N 494.339 0.246 50 20 JCGD Cc1nc(N)sc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198896 FJGGFJCWQLLBKK-IAQYHMDHSA-N 451.318 0.794 50 20 JCGD Cc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1839312041 ZQGQZCYNRLJPFA-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839742316 VLMDHRKUYJZJCU-CQTHNFAISA-N 497.520 0.763 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)ccn3C)C2)C1 1839966250 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1841894939 NOKJYYZUDFTZRQ-GOSISDBHSA-N 498.443 0.926 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccncc1O)C2)NC(=O)NCc1ccccc1 1845038893 DORHJQNQGWCVPI-UHFFFAOYSA-N 452.515 0.950 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CN1CCS(=O)(=O)CC1)C2 1845870442 MHJZPMCOALPLLI-LICLKQGHSA-N 478.521 0.806 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1846926484 NOMKZUJCOULPDE-UHFFFAOYSA-N 491.957 0.873 50 20 JCGD CCc1[nH]nc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)c1I 1847558288 JALFJJZOMGKSCK-GARJFASQSA-N 466.707 0.992 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc(C)cc1)c(=O)n2Cc1ccccc1 14046641 DDHDNOFYYPAYBE-UHFFFAOYSA-N 490.520 0.824 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CN3CSCC3=O)c2)cc1 17396441 DQMOKMQDTGCVFN-UHFFFAOYSA-N 464.525 0.790 50 20 JCGD O=C1COc2ccc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc2N1 24257165 VGMHODUEXWDXGV-UHFFFAOYSA-N 480.524 0.425 50 20 JCGD N#Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)c1 728954423 DZZWUDWIUGJHJG-UHFFFAOYSA-N 471.524 0.924 50 20 JCGD COC(=O)NCCCC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 730830320 RCGVRSKOUYLOLG-HNNXBMFYSA-N 486.547 0.236 50 20 JCGD COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1C 731181077 KJKWFJACSIIJNH-UHFFFAOYSA-N 461.905 0.706 50 20 JCGD CCN(CC)Cc1ccc(C(=O)NNC(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)o1 746396224 FVTZUBDZAGVSNI-ZDUSSCGKSA-N 453.521 0.048 50 20 JCGD O=C(NCCN1CCOCC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 915884762 GNCNDUHZIKHQBJ-UHFFFAOYSA-N 453.546 0.825 50 20 JCGD CN(CCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)S(C)(=O)=O 916580037 BGKHIQFULJAVCU-UHFFFAOYSA-N 489.601 0.774 50 20 JCGD O=C(NCCS(=O)(=O)NCc1ccccc1)NNC(=O)c1nn(-c2ccccc2)cc1O 916645270 MATRDXDRIREIIA-UHFFFAOYSA-N 458.500 0.642 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 920077325 VHEOETYMMSBZSD-CYBMUJFWSA-N 477.634 0.713 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c(=O)cn1)C2 1778092543 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CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1 1781853434 DXWMJNHGQGGHRS-GUYCJALGSA-N 450.330 0.444 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)C=CC3=O)CCO2)C1 1782866769 JABIVNFYRLEVKU-CBFKJKJLSA-N 470.432 0.627 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784094955 WJIYLGNTCCIRJD-PLNSCZHZSA-N 489.997 0.326 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784096481 XHTLYANTFIBFNS-FUJDEKNSSA-N 499.996 0.425 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786406165 WGOQMYYHYOWAOD-AJNGGQMLSA-N 478.384 0.637 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc2c[nH]nc12 1788610056 ZMYXMWRGCKPQAT-GKCIPKSASA-N 477.525 0.777 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4nc[nH]c4C3)[C@H]2C1 1791528211 MBYWNHVCPGOJEL-CTOHXUJISA-N 481.557 0.628 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21)n1cncn1 1791612462 YBNSXMQZXVPRBA-XAJHFOFHSA-N 484.985 0.951 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccc2ccc([N+](=O)[O-])cc21 1793214670 MUEKYEVXOXBRDE-GPVSGQMNSA-N 486.529 0.512 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1795259231 LEMJDCNVCKHWDK-VPTLXERWSA-N 453.499 0.140 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS(C)(=O)=O 1795790625 UMPXFRPJJAUQQO-BTTYYORXSA-N 453.473 0.817 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)n1 1796356332 KJBSNXFLWUSEIQ-RMRMTIIFSA-N 471.420 0.976 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C(C)(C)C)c1)C2 1796441277 SBHWNCYMOPXPDV-DECYYXMYSA-N 469.546 0.975 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1c(=O)n(C)c2ccccc21 1797171429 LIJQQSJZZUXIGK-BKEDOTJMSA-N 479.375 0.961 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NO[C@@H](c2ccccc2)C1 1797177074 TYMLULCMBLEIKZ-VAKZPMALSA-N 478.509 0.406 50 20 JCGD COc1ccc2oc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)cc2c1 1797350476 FNNITQNRSYQGTK-USGNIVHTSA-N 479.493 0.957 50 20 JCGD CCC[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)n1cccc1 1797750926 VVBZZHJEEXPULD-WOUAJJJCSA-N 454.531 0.731 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)nn1C 1798525033 YQSRPUMXTPLSNC-VTEUUUEMSA-N 487.469 0.779 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(F)c(F)c2)CC1 1799067903 JUDBMSVSHFTXGF-USGNIVHTSA-N 464.513 0.959 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H](O)CN1)C2)[C@@H](Br)Cc1ccccc1 1800435252 BDAOHMAINUNFLY-QSMSVPEVSA-N 466.376 0.305 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1O)C2 1800978575 VPRBMVCRPXSZNK-BQULAQKPSA-N 489.997 0.448 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1804086723 ACYFTOAASJPLEG-SUYBPPKGSA-N 466.336 0.670 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1 1806342785 LHUZCNFHZRUHMS-RYQLBKOJSA-N 455.353 0.523 50 20 JCGD Cc1nc(N)sc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807243671 LTNFZDGYLBZEBK-SJLPKXTDSA-N 465.344 0.742 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807359055 DJJQENSWBCPVJV-TZIWHRDSSA-N 466.347 0.243 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)COc2ccc(O)cc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361068 UYPIBKSKMVIXPQ-NTKDMRAZSA-N 475.310 0.866 50 20 JCGD COc1cccc(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807362954 NJFLNQJIAMTTDT-CYFREDJKSA-N 474.326 0.727 50 20 JCGD CC(C)c1nc(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)no1 1807369276 DRZDILNTWKWUFB-PGRDOPGGSA-N 477.330 0.830 50 20 JCGD COc1nccnc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807369656 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CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(=O)OC(C)(C)C 1815339932 VQSIITJBUYDGPV-OAHLLOKOSA-N 488.375 0.916 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=N/O[C@H]2CCCCO2)[nH]n1)c1ccc(B(O)O)cc1 1817472220 NYEJWAPVTAJOFJ-WEEQGOHXSA-N 469.307 0.924 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819417501 BYSBGHBVPKPIPV-RDTXWAMCSA-N 463.307 0.686 50 20 JCGD CC(=O)c1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n[nH]1 1819796026 YDOAXLKSNDSURU-JTQLQIEISA-N 468.499 0.607 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)N1CCN(C)CC1 1820784170 BFKIFGFUAVJDND-UZLBHIALSA-N 468.367 0.031 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3nn[nH]c3C(F)(F)F)sc2C1)c1ccc(B(O)O)cc1 1821642818 BNSPHHGFTCFLBZ-JTQLQIEISA-N 480.237 0.499 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CC(F)(F)C(=O)O)CC1 1827595267 UDFYRETWBDFYBH-KRWDZBQOSA-N 452.263 0.710 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCSCC2)CC1 1828922311 RMNCBXJKYITZST-FQEVSTJZSA-N 474.631 0.967 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C(=O)N(C)C)CCN2C(=O)OCc2ccccc2)C1 1828936795 YSVKYOFXOVFRIE-FDDCHVKYSA-N 494.976 0.781 50 20 JCGD COCC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCN2C(=O)OCc2ccccc2)C1 1829356119 LNSBEWIGZBSDOI-DEOSSOPVSA-N 489.573 0.458 50 20 JCGD O=C(c1cnc(Cl)nc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1829521448 RVIWPCWEXKFXRZ-IAQYHMDHSA-N 451.680 0.891 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1830544367 WIFBYLOJLMGTAP-SCLBCKFNSA-N 473.324 0.048 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830735292 GHQZXFBNKFKJCA-VVBPWWLESA-N 487.981 0.300 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830735739 MLTFQPZWUIRFDI-LPHOPBHVSA-N 459.858 0.333 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(C)c1 1830737710 GPTRVNRFQLXFGI-UTKZUKDTSA-N 454.907 0.451 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)C(C)C)CCO2 1830870580 XKKVDDWJNVLYNM-UGKGYDQZSA-N 479.486 0.607 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2 1831248989 JELVDIKKRSBRIY-LVCYWYKZSA-N 451.907 0.236 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCCC1(F)F)CCO2 1831716354 PKAWFVVUDUEOQS-RXVVDRJESA-N 466.290 0.262 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)COC(C)(C)C)CCO2)C1 1832311455 WMIHCKVLOYIDIL-OLCUMFGGSA-N 463.535 0.392 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832729851 NYSLGYVJCOBVBX-UXHICEINSA-N 473.357 0.504 50 20 JCGD COc1ccc([C@@H](O)C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1 1833181364 XAKIZAXJCFIKHQ-VQTJNVASSA-N 453.967 0.900 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1scnc1C1CC1)CCO2 1833727752 GRSRTQLPESLPNW-JOCHJYFZSA-N 471.344 0.084 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1coc(Cl)n1 1833984983 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Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)no1 1837921075 XMPHGNUSXSWOPY-UHFFFAOYSA-N 455.320 0.518 50 20 JCGD O=C([C@@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1840017146 AGGVGDOYUAVUDI-GNBIQWSPSA-N 451.882 0.887 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840142959 FIDIWVNZWPIJGJ-HRLGVUPISA-N 477.327 0.889 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccnc(OC)c3)C2)C1 1840150059 DYUKMIBOWJIYLG-UWJYYQICSA-N 455.939 0.733 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1840314148 TXMDZPIARIEWOU-UGKGYDQZSA-N 453.967 0.741 50 20 JCGD COC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)CCC1 1840616480 YDIUBLCRSMBHHT-QADUPLGGSA-N 475.546 0.536 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840803673 PORPFBXHLLPQTD-AUSJPIAWSA-N 463.959 0.346 50 20 JCGD CCn1nnc2c1[C@@H](C(=O)N1CCCC13CN(C(=O)[C@@H](O)CCl)C3)CN(C(=O)OC(C)(C)C)C2 1842055979 GSLGNQYMTGJFOM-HOCLYGCPSA-N 496.996 0.935 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)O2)C1 1843009795 JYUOXFINKNTESS-IBGZPJMESA-N 499.373 0.352 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038268 LEEXIUPJWLQOEK-QGZVFWFLSA-N 458.563 0.451 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1845520150 YUCLAXCAXRHHJG-UHFFFAOYSA-N 452.276 0.471 50 20 JCGD COc1ccccc1NC(=O)COc1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1OC 16785793 ZBFZGXIAYDVQLB-HNNXBMFYSA-N 491.522 0.917 50 20 JCGD CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 20901160 JLIREHRVEUSQMT-UHFFFAOYSA-N 466.541 0.454 50 20 JCGD Cc1ccc(NCC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c(C)c1 726101771 PSHUXLUFXMNWPQ-IBGZPJMESA-N 496.611 0.645 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 726613657 MJARXFZNTFTVQS-UHFFFAOYSA-N 476.511 0.934 50 20 JCGD CC(C)CNS(=O)(=O)c1cc(C(=O)NNC(=O)C(=O)NC2CC2)c(Cl)cc1Cl 726615270 GKDILRWLQKSXDA-UHFFFAOYSA-N 451.332 0.967 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=S)NC1CCOCC1)N(S(C)(=O)=O)CC2 727780541 QUSCRPAPGGQTBK-INIZCTEOSA-N 486.616 0.627 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)cc1 728203649 YUNBVVZBYQANKN-HNNXBMFYSA-N 464.548 0.695 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CC[C@H](C(F)(F)F)NC3=O)cc2)CC1 728214881 UHQRBJDIYBGLPE-LSDHHAIUSA-N 463.482 0.523 50 20 JCGD NC(=O)[C@@H](NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(Br)cc1 729676587 ORRNBCPISSNZSD-KRWDZBQOSA-N 497.371 0.931 50 20 JCGD CC(=NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 729816729 RDDYXTIZBCMZRY-UHFFFAOYSA-N 487.581 0.970 50 20 JCGD COc1ccc(CC(=O)NNC(=O)Cc2ccccc2F)cc1S(=O)(=O)N1CCOCC1 731329985 JNYGVOKIKBUNBG-UHFFFAOYSA-N 465.503 0.788 50 20 JCGD COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N3CCOCC3)CC2)cc1OC 745996119 NUIDWIQRITVOIC-UHFFFAOYSA-N 456.521 0.178 50 20 JCGD CC(=NNC(=O)C(=O)N1CCCC1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1 748137731 VAJDLGUZXWRYDD-UHFFFAOYSA-N 450.517 0.635 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1csc(N2CCOCC2)n1 748465123 KGOWBPVJLTZPGX-UHFFFAOYSA-N 487.586 0.663 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl 751206343 FKLNVXGGEKNXCT-UHFFFAOYSA-N 454.892 0.909 50 20 JCGD Cc1nc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nn1-c1ccc(F)cc1 756744213 BXJRUUDSHLFJBY-KRWDZBQOSA-N 455.402 0.859 50 20 JCGD NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)=NN1c1ccccc1 913081317 IEOWEVBNQDJVCX-FQEVSTJZSA-N 498.565 0.742 50 20 JCGD CN1CCN(S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(CCCl)cc3)CC2)CC1 917878009 HZZXZACPLVNIAB-UHFFFAOYSA-N 451.014 0.266 50 20 JCGD CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 919779259 OPPBRCPHGZCHHI-GFCCVEGCSA-N 482.588 0.901 50 20 JCGD CNC(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2c(C)n(C)n(-c3ccccc3)c2=O)cc1 919880079 YWDFKVYQUYVEOS-UHFFFAOYSA-N 458.500 0.859 50 20 JCGD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1csc(N2CCOCC2)n1 1319160796 JKHSPLMZUZBFFU-UHFFFAOYSA-N 460.559 0.315 50 20 JCGD CC(=O)O[C@H](C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1)C(C)C 1778797575 USGUTUBOJVQTMA-JHBFSYOZSA-N 461.519 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)OCO4)CCO2)C1 1779030384 PQEVWZPGEHPPAI-QFIPXVFZSA-N 453.455 0.171 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969282 VODGZQMUMFKHGV-YADARESESA-N 498.588 0.090 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccon1)CCO2)NC(=O)NCc1ccccc1 1780970672 ZOTABBNKMJEJNE-QFIPXVFZSA-N 456.503 0.464 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)nc3cccnn13)C2 1782173910 SYOPRDPFYSWUMP-CMPZQBNXSA-N 463.922 0.471 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)CSC2=S)C1 1783245773 DCJPQBFXLNLWHJ-SNUQEOBHSA-N 464.009 0.614 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)CCO2 1783936918 LRCFOBPVCJFQIZ-GAJHUEQPSA-N 481.594 0.589 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1C 1786980224 XDSUFNUDIPMPIY-PMVMPFDFSA-N 450.344 0.819 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788141050 FGYZHICUAMPFLO-UHFFFAOYSA-N 485.371 0.540 50 20 JCGD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)[C@@H]1SC(=N)NC1=O 1788141380 WHOCEIMBAXIJKF-ACJLOTCBSA-N 480.355 0.917 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4O3)C[C@@H]21 1788609708 CCEMYQLJGQWPQC-PWZKMPOXSA-N 479.537 0.672 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)o3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726618 GEORJQXTNDYKGJ-VCOUNFBDSA-N 499.568 0.711 50 20 JCGD O=C(COc1ccccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790966598 MCDXZEBWQHNSEA-MDKPJZGXSA-N 456.279 0.178 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Oc3ccccn3)[C@H]2C1 1791620876 DEHRRSKSHKTQCG-QATFAZCYSA-N 482.541 0.963 50 20 JCGD CC(C)(C)OC(=O)N1CCn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)c2C1 1792981550 MZGTVOAPDLIFQN-DACLVMHWSA-N 497.980 0.437 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 1793082925 IBBNVOZDVRNWCX-RBGFHDKUSA-N 490.395 0.995 50 20 JCGD O=C(CC[C@H]1CNc2ccccc2C1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1795648268 WEFDJEJRKQBGTJ-CCIIEHSASA-N 477.370 0.634 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)N1CCOCC1 1798485594 HYIASSJMUKYWHH-IWSXDTNSSA-N 474.986 0.407 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)n1 1799349781 KYIWBHOPNPSBRR-NEBZKDRISA-N 459.316 0.567 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1 1800856574 YYNVHGPFKHFBTP-FUUZJDILSA-N 462.522 0.810 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1OC(F)F)C2 1801012135 HMPSBGCWNBJQQT-HBCWATKFSA-N 454.474 0.864 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C)C2 1802339771 LRZNIROBDUCRBT-YVSFHVDLSA-N 479.578 0.924 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ncn(C)n2)[C@@H]1c1cccnc1 1805323207 TWHHDZASCXQGOH-QRTPEGJISA-N 463.502 0.664 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1nccc2nc[nH]c12 1808133004 ZXOCMUUCRRFODO-HTAPYJJXSA-N 470.298 0.666 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1 1809385446 CEMWSHFCZGLKLA-IERDGZPVSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1 1810306062 SERROAMPOHOLMU-KSSFIOAISA-N 481.542 0.310 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C[C@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1812774226 NCQLASJDZRCKHY-AYDFFVQHSA-N 466.336 0.859 50 20 JCGD O=C(/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)NCc1ccco1 1815344123 IWVUABOSHFOLPB-ZNFPLGDCSA-N 494.338 0.514 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817281578 HIULPLJSGKJPIB-WRXGMEBTSA-N 471.543 0.880 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470789 YRRZDBKSCJSSPL-INIZCTEOSA-N 460.321 0.302 50 20 JCGD Cc1cc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)n[nH]1 1819989244 KODVSRHUELEYJE-LLVKDONJSA-N 454.516 0.642 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc2n(n1)CCNC2=O 1823002212 BCWMAODCBAROCA-KRTXAFLBSA-N 471.312 0.999 50 20 JCGD O=C(Cn1ccnn1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551100 ITOUTBYLLGLNPW-PGRDOPGGSA-N 490.948 0.330 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828954086 UZWMNDCCDTUTIR-YADHBBJMSA-N 488.346 0.095 50 20 JCGD C=CCCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(O)n1 1830725849 SEZQSROPPXUHFH-UTKZUKDTSA-N 453.923 0.576 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830730827 DXWSTLDDFHSOOA-PXNSSMCTSA-N 470.910 0.331 50 20 JCGD CC1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC1 1831107642 PJKALGPKMWQIEX-WMZOPIPTSA-N 450.349 0.865 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1832003846 GLHSPTALYNJQDC-XGKMFUNXSA-N 481.949 0.905 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1 1832718305 INPJIMDZFGOAQC-QFIPXVFZSA-N 488.932 0.046 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(N2CCC(NC(=O)C3(c4ccc(O)cc4)CC3)CC2)CC1 1833329365 UDEBHGDCBGOSJV-UHFFFAOYSA-N 491.397 0.989 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@@H]1CNc2ccccc21 1834728430 LUJSFGOALYWHKP-HSZRJFAPSA-N 476.386 0.761 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccccc3O)CC2)CC1)c1ccc(B(O)O)cc1 1834797329 DHFKMIZKPYRLRB-UHFFFAOYSA-N 451.332 0.571 50 20 JCGD COc1nccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1F 1834908121 NUISYROXQXLNND-UHFFFAOYSA-N 478.569 0.788 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCc3ncc[nH]3)CC2)CC1 1835738252 PGLYTDCPIJWPQH-UHFFFAOYSA-N 468.562 0.226 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1 1835931890 FWZNTNQZRRPNGL-SGIRGMQISA-N 464.327 0.240 50 20 JCGD CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835935719 NWINGYJZSBEDLE-DHLKQENFSA-N 466.343 0.630 50 20 JCGD Cc1cccc2cc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)[nH]c12 1835936833 FXKYRWXRFOPMAO-RUZDIDTESA-N 477.326 0.540 50 20 JCGD O=C(c1cncc(C(F)(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937903 ATACMYSOBIBGJS-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cc(=O)nc2cccnn12 1836098200 JIVQRMLBXYURSF-SFHVURJKSA-N 495.353 0.965 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836717346 CBMJTHBPUNRHRP-JKSUJKDBSA-N 463.959 0.428 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836719340 PZJAXZPEPACSNU-KXBFYZLASA-N 466.966 0.798 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4=O)CCO2)C1 1837140115 PKZMILWEOHWVTN-YUNKPMOVSA-N 480.315 0.675 50 20 JCGD CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc(C)n1 1837457466 DBSOQDQROJFXEK-DEOSSOPVSA-N 482.541 0.335 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837632739 WIIYJWIBFTWGSR-DNVCBOLYSA-N 469.336 0.650 50 20 JCGD Cc1c(Br)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)nn1C 1838768375 GVAMVZCUZKNVEB-SJKOYZFVSA-N 479.759 0.161 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1839154911 BRBYNHKLLMFITC-HOTGVXAUSA-N 452.364 0.590 50 20 JCGD COc1cc(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839256549 JAEWCVKJJILUGY-HSZRJFAPSA-N 462.547 0.447 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1 1839556405 UOCZVFWJAYRHOW-VLIAUNLRSA-N 454.886 0.797 50 20 JCGD Cc1ccc([C@@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1839947407 NNHZHWZCDPBMFA-CJAUYULYSA-N 481.553 0.867 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3OC)C2)C1 1840149480 QRWZIJKXNBEDNJ-IERDGZPVSA-N 456.923 0.784 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1 1840153069 CAYYWXCWJDZOBL-DYESRHJHSA-N 451.907 0.254 50 20 JCGD CCCc1onc(C)c1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184199 CPADNSBPWMNFRN-JOCHJYFZSA-N 465.551 0.379 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1cccs1 1840186035 WRINHZRWCIUMBD-IIBYNOLFSA-N 452.577 0.681 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187330 SPRCITFXJIDYFS-UZUQRXQVSA-N 499.609 0.119 50 20 JCGD C[C@@H](Cc1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840473311 URHYNYLHNMTOOH-HTAPYJJXSA-N 450.536 0.288 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc(F)c1F 1840705654 ZVZONJDWAXKERM-JOCHJYFZSA-N 468.501 0.716 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(NC(C)=O)c3)CCO2)C1 1840730941 SDQVTDRSCPHFAG-WIYYLYMNSA-N 453.923 0.969 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(OCC3CC3)cc1)CCO2 1840749074 DAVVVSRWKCSNHM-AREMUKBSSA-N 494.353 0.539 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1 1840955413 OBPXMJZHZRYFLB-IFXJQAMLSA-N 461.943 0.100 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)cc2)CC1 1844265456 DWPPWXAMHIIZBO-UHFFFAOYSA-N 491.596 0.958 50 20 JCGD COc1cc(C(=O)NNC(=O)NNC(=O)CNC(=O)c2cccs2)cc(OC)c1OC 725872109 NLOKNYWWWSENMI-UHFFFAOYSA-N 451.461 0.179 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC(NC(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1 726092070 STSPTUWALWTYOK-UHFFFAOYSA-N 463.516 0.502 50 20 JCGD CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1 726273835 JGENBUYUVJMXDT-UHFFFAOYSA-N 463.502 0.475 50 20 JCGD CN(C)N(C(=O)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12)[C@@H]1CCS(=O)(=O)C1 728177893 LRNWNWPXXFDPDR-CQSZACIVSA-N 498.583 0.067 50 20 JCGD CCn1c(O)nc2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc2c1=O 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O=C(NNC(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1)N[C@@H]1CCS(=O)(=O)C1 919886342 RHDPHHOAOUUKRC-GXTWGEPZSA-N 462.450 0.571 50 20 JCGD COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 919955515 JENSRSFRFPOWPL-UHFFFAOYSA-N 497.551 0.730 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NCCc3cccs3)cc2)CC1 920861162 GJYNLVQXAPQUGE-UHFFFAOYSA-N 479.584 0.788 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1 1779001393 PNQSCIUCLDNJBV-OAQYLSRUSA-N 450.612 0.641 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c12 1779036586 BBKBJHKICGNJNC-DEOSSOPVSA-N 478.509 0.932 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1779279898 FDELKEDFFHBWTK-PEBXRYMYSA-N 474.470 0.654 50 20 JCGD COc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cc1C 1779371210 RWUTVLQIELWGTI-NTKDMRAZSA-N 482.541 0.838 50 20 JCGD Cc1ncncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372215 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Cc1cc2nnc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](C)Br)C4)C3)c(C)n2n1 1783534044 DGNKWSXCTGTTRH-KPZWWZAWSA-N 451.325 0.968 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(Cl)nc1F 1785486442 ZRVQFQDKILOGLI-JQFCIGGWSA-N 461.686 0.461 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)ccc1C 1786981735 JHIFSHADTFDPIV-VCOUNFBDSA-N 452.316 0.591 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@]3(NC(=O)OC(C)(C)C)CCOC3)[C@H]2C1 1789912740 RHYZRGCRQGOSQM-VMDVDIMUSA-N 489.997 0.904 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C[C@@H]21 1790961029 FVDFBILMYIMIFF-QAETUUGQSA-N 494.452 0.811 50 20 JCGD O=C(COc1ccc(O)nn1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1791053550 MJRQEOJDXGQKQF-UHFFFAOYSA-N 462.271 0.689 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C[C@@H]21 1791292245 KHIQLNRKEQWHFQ-ADARVHTPSA-N 476.530 0.169 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797955913 ORBOOORPYHERSV-DFGXFYAUSA-N 473.643 0.967 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2cccnc2)[nH]n1 1798157969 VOYUZRPLXJXJBU-FKWFMORESA-N 490.524 0.809 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnccn1)C2 1798521342 CEHLIARQKOELOM-USGNIVHTSA-N 469.454 0.756 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)Cc1ccccc1NC2=O)c1ccc(B(O)O)cc1 1799123612 JADDIFWBWBYFSR-ACDBMABISA-N 499.336 0.743 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1NC(C)=O 1801011960 ZBSZEXPKCVMZGK-FAQVEIGNSA-N 475.546 0.230 50 20 JCGD O=C(CCC(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804148687 AXXWKRJLXGNDHU-RDPSFJRHSA-N 478.358 0.484 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1804190747 RNISPZDLTODOGV-AXHNFQJDSA-N 456.330 0.876 50 20 JCGD 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COCCn1nccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1817586566 IPVALRKROMYTLL-OAHLLOKOSA-N 469.332 0.205 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nc2ccccn2n1 1817805766 VSIKKRALTMQOPK-QGZVFWFLSA-N 459.275 0.752 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)n1 1820087584 FJKFHYIVYJWVJB-DGCLKSJQSA-N 453.952 0.955 50 20 JCGD CCOC(=O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1828210990 CSLUTLPRDKXXSR-NSHDSACASA-N 474.543 0.957 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1828761672 JCFQACPJTFKJMR-OKGQLZLTSA-N 490.561 0.805 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)Cc2cccnc2)CC1 1828926328 GFWHRFOBKJHQJZ-VXKWHMMOSA-N 479.585 0.883 50 20 JCGD N=C1NCCN1CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1828983997 XMHUGPNQFLIDFK-PGRDOPGGSA-N 494.955 0.813 50 20 JCGD O=C(c1nc[nH]n1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829034000 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CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830720079 SGAIDXNGUAOGQI-GEYWLOKFSA-N 489.997 0.736 50 20 JCGD O=C(c1ccnc(C(F)(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724586 IJZHIVPSPDYPNA-CXAGYDPISA-N 451.829 0.770 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2n1 1830736029 PWWWNSPENZLTOU-LAUBAEHRSA-N 450.923 0.621 50 20 JCGD Cc1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)s1 1833147382 HHMGFWWNJRNFRW-QFIPXVFZSA-N 488.570 0.071 50 20 JCGD CC(C)n1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1C(=O)O 1833608919 ZMTPKLSKHQFPQX-KSSFIOAISA-N 491.314 0.923 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799177 PSEMDZOZCFVMKG-CQSZACIVSA-N 466.185 0.335 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cn3cnc4ccccc43)CC2)CC1)c1ccc(B(O)O)cc1 1834799332 XMVCVOUCIZJVKJ-UHFFFAOYSA-N 489.385 0.602 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3)CCO2)C1 1835374553 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PGWACMGSZLKZJI-QHCPKHFHSA-N 459.547 0.748 50 20 JCGD Cc1nccnc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921178 JENYNUSEIMSFBP-UHFFFAOYSA-N 452.320 0.391 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)COCCO)CC2)CC1 1838102912 GKUGELFAARKOSZ-LFVJCYFKSA-N 463.535 0.128 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838418599 GEQKODBYRBTYDT-ORAYPTAESA-N 454.936 0.843 50 20 JCGD CSc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1O 1838564356 FHSINMMNBOBWMK-HSZRJFAPSA-N 486.355 0.178 50 20 JCGD NC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)c1ccccc1 1839199378 NMUVMLPGCADREF-FCEWJHQRSA-N 458.328 0.876 50 20 JCGD Cc1cccc(Cl)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839339172 OBEUTPJFZHGWJQ-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840045941 HNGVJRALHSVXEZ-WHSLLNHNSA-N 475.970 0.442 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2 1840115159 FSDPBORFZXZEGU-VWLOTQADSA-N 493.564 0.877 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2 1840363192 ONZZQXILBASRIJ-HRAATJIYSA-N 450.612 0.823 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C[C@H]2C[C@H]21 1843010426 OJPNEARZXACSIA-BHIYHBOVSA-N 469.347 0.581 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C[C@@H](F)C1 1843011335 TUABYTQVAFOCHY-PKOBYXMFSA-N 489.353 0.779 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C[C@@H](F)C1 1843886028 GNOHHOMQLGVTCD-PKOBYXMFSA-N 489.353 0.779 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265127 WOLYDQUKUOIGJM-UHFFFAOYSA-N 467.486 0.790 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(CC(C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)=NO2)C1 1846102190 OWESKZSFRCKKPI-YCRPNKLZSA-N 470.954 0.945 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C)C2 1846364713 GHCKVLDVTCXYKW-CABCVRRESA-N 496.026 0.772 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1847070083 UCVGQZFTOQABLK-QGZVFWFLSA-N 470.530 0.419 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1 21191511 RPZNZZGLVZFZPC-YJBOKZPZSA-N 495.941 0.861 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)CNC(=O)c1ccco1 725871725 FUPNVGYPPRQTDI-JTQLQIEISA-N 468.264 0.601 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)CC2)cn1C 726199668 FNBJZKOCYQXYAB-UHFFFAOYSA-N 497.961 0.787 50 20 JCGD CC(C)NC(=O)C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1 728261349 QLHKZYCPVBWHLC-OKILXGFUSA-N 460.578 0.187 50 20 JCGD CCN1CCCC[C@H]1C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 729515804 OABSZBFSJDUJAS-ZWKOTPCHSA-N 482.603 0.975 50 20 JCGD CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 732307828 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C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1C(=O)C=CC1=O)C2 1779539906 QMLQOTHZVGDNAJ-IIBYNOLFSA-N 451.596 0.667 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)[nH]2)C1 1779781609 IBUQVSZIRLKTSC-BYAFEARCSA-N 457.491 0.377 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3c[nH]c4ccccc34)C2)C1 1781010106 WMBBCFPTBLZCHJ-XMMPIXPASA-N 462.510 0.853 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2cccnn2c1 1781327445 CQTGRSDGEHZZNF-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781331295 HYJABYYLVZPZFT-HEHGZKQESA-N 453.261 0.002 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3nccn3)C2)C1 1781421056 DLIVGVQXWLUJCT-HXUWFJFHSA-N 458.431 0.255 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(F)c(OC)c1F 1781948619 HSPUDDVYXLWDLT-QHCPKHFHSA-N 490.268 0.419 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC2(O)CCC2)C1 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C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815364751 ZEFNOJBFMAQSLA-RDTXWAMCSA-N 492.366 0.867 50 20 JCGD C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCS(=O)(=O)CC2)n[nH]1 1815672283 AVRRFGCUHYXKMF-OCCSQVGLSA-N 476.397 0.916 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1 1817475616 WDUDKMQLPZAAMF-IBGZPJMESA-N 477.286 0.891 50 20 JCGD C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1 1817816634 JQUNFHJXNASUCV-GZMMTYOYSA-N 464.284 0.625 50 20 JCGD CN1CCCn2nc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3cccc(B(O)O)c3)CC4)cc2C1 1824381654 IKRKETRDZNHIQJ-MRXNPFEDSA-N 494.386 0.395 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCCC1=O)CC2 1826089629 IKQFEHDMCJVZBU-ZDUSSCGKSA-N 450.565 0.441 50 20 JCGD O=C(CCc1cnccn1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826904484 DIFRPYTZKPWBJO-OAHLLOKOSA-N 451.317 0.472 50 20 JCGD CN1CCN(C2(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1827052748 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O=C(c1ccc(Br)cn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731404 LIDSCUIOLUMUPQ-PBHICJAKSA-N 462.728 0.514 50 20 JCGD C=CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833475185 JVHKLVSPQINMMJ-INIZCTEOSA-N 458.563 0.461 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798818 BMFGUAWEHVWEFR-UHFFFAOYSA-N 498.320 0.913 50 20 JCGD COc1ccnc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c1OC 1834823769 JTKPQTZVSJTBTI-IBGZPJMESA-N 472.336 0.954 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834824561 BEGVFZAHDQRRJG-ZZODWALSSA-N 484.347 0.998 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2n1 1835931769 CCUCUFUXZMZONA-RUZDIDTESA-N 492.341 0.015 50 20 JCGD O=C(CCc1c[nH]c2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935399 DQYURUBNAIJNFT-AREMUKBSSA-N 491.353 0.551 50 20 JCGD CCc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1Cl 1836230080 NBJVPFPIUNVCAK-OAQYLSRUSA-N 491.936 0.008 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2 1836648696 HLFUISJLZBZDOH-AMGAUNKPSA-N 495.536 0.581 50 20 JCGD COc1ccc2oc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2c1 1836822593 SYGZXUWKAGQJRN-XMMPIXPASA-N 488.541 0.884 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cccc4nccn34)CC2)CC1 1837921760 YDJIZBZRJBSJFV-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3F)C2)C1 1838527078 GSLYMDNUQNLOPJ-KUDFPVQQSA-N 465.434 0.948 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3C3CC3)C2)C1)NC(=O)NCc1ccccc1 1839054274 QTALIBOWQDAZQG-VVZHRXSXSA-N 499.612 0.835 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839154038 ZMSYMLFHSOAWPG-GKCIPKSASA-N 488.372 0.288 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1 1839349122 FHXXKEDNYOTMSS-VLIAUNLRSA-N 468.348 0.887 50 20 JCGD Cc1cc(F)c(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839457881 HXGGNBIRJGIGNG-HSZRJFAPSA-N 489.479 0.656 50 20 JCGD O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839482491 ZDFGWXZAZKFBRU-KXBFYZLASA-N 467.866 0.141 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc3ncccc13)CCO2 1839543253 MHXFZEJGRBFILP-HSZRJFAPSA-N 470.530 0.073 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1839780113 ZIHXTVDWFDAGIT-CPUCHLNUSA-N 467.382 0.051 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C2)C1 1840182738 RTJQDMSEQDULCE-HSZRJFAPSA-N 491.545 0.357 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c(F)c1 1840184734 COEPSHYVCRXCOH-LNJOJYBOSA-N 492.548 0.677 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4o3)C2)C1 1840184791 BTSNCXNYKYAAON-QFIPXVFZSA-N 459.503 0.271 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCC3(CN(C(=O)OC(C)(C)C)C3)O2)C1 1841080261 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MWDKTCLXQWBFNX-UHFFFAOYSA-N 466.546 0.372 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)NC[C@H]2CCCO2)ccc1Br)c1cnn[nH]1 729456116 RNEINJMJXRWPLB-SECBINFHSA-N 473.309 0.099 50 20 JCGD O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 730958942 IRRSSDJZPWARLK-LLVKDONJSA-N 467.363 0.585 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCCOCC1CC1)N(S(C)(=O)=O)CC2 731119463 SJHDJNJOTRNGPG-KRWDZBQOSA-N 484.575 0.710 50 20 JCGD O=C(COC(=O)Cn1nc(-c2ccccc2)oc1=O)NNC(=O)[C@H]1COc2ccccc2O1 746189629 ZMURJABBHBCPSH-MRXNPFEDSA-N 454.395 0.034 50 20 JCGD CCn1nc(C(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c2ccccc2c1=O 791161588 MMAXQZHQZZTGAY-UHFFFAOYSA-N 482.522 0.772 50 20 JCGD Cn1cccc1C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C/c1ccccc1 822066356 MRLXQNYIGNCCFW-HFQYIWAZSA-N 468.557 0.180 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)cc1 916514781 NEHBROCZXRCMNM-UHFFFAOYSA-N 488.614 0.768 50 20 JCGD COc1cc(Cl)ccc1C(=O)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916516703 OYYPGBWEBWRGNT-UHFFFAOYSA-N 496.977 0.840 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCCC3)cc2)c2ccccc2c1=O 916647603 HRZRIRDVLWNGPY-UHFFFAOYSA-N 484.538 0.862 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778115728 AEKIJALOSUTOOR-CXAGYDPISA-N 466.398 0.271 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cc21 1778383102 FNOHNHGVSBLMOD-DYVFJYSZSA-N 458.288 0.151 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CS[C@@H]3CCCCO3)CCO2)C1 1779032778 YIGKUANCJRDDRZ-NQIIRXRSSA-N 463.560 0.388 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1 1779593482 RDTPBAKMQKIYSJ-QFIPXVFZSA-N 455.519 0.288 50 20 JCGD COc1c(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ccc(F)c1F 1781842377 QFICBDSOGJFWIO-QFIPXVFZSA-N 460.242 0.411 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)C2)C1 1783787731 XTQHMQLWMDXFLK-VTJXTGGHSA-N 491.969 0.527 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(N4CCOCC4)n3)CCO2)C1 1783876044 UNPMLAAYQSHIKQ-KKSFZXQISA-N 452.939 0.616 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783939381 DOORFUYLHOISQZ-HXOBKFHXSA-N 479.578 0.106 50 20 JCGD CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)C[C@H]1CO2 1784092855 NDURRNBLOFHBDN-FHAIXYJRSA-N 487.981 0.344 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)NC(=O)OC(C)(C)C)[C@H]2C1 1784815116 FLOLBTAILABSRP-ULQDDVLXSA-N 483.610 0.642 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1785342499 LRHOWLDUCVRUIO-UZUQRXQVSA-N 490.561 0.432 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(-c4cccnc4)n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979934 QSTKFBNIDYSPKO-CUWPLCDZSA-N 492.366 0.792 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c[nH]c4ncccc34)C[C@@H]21)c1cccc(B(O)O)c1 1786986843 LYZRQHWJZWRZNO-NYVOZVTQSA-N 476.342 0.469 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1 1787445360 CIJFJWXYUQKYCK-RMEBNNNOSA-N 450.939 0.743 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)C(C)(C)C)C[C@@H]21)NC(=O)NCc1ccccc1 1789724970 UFPAAOVENFMNRB-BPBCIEFSSA-N 489.617 0.719 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C[C@@H]21 1790960477 KVVQZOBUZVYWGQ-JGFGOLAASA-N 482.379 0.748 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)[C@@H]2C1 1791027009 WQLNICPAXJIHOH-OIMRXFJVSA-N 471.982 0.679 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792241987 OPFDBEJNZUWDDB-RHYQMDGZSA-N 464.407 0.610 50 20 JCGD O=C(CSc1ccc(F)cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793290050 GYPQHGXUOHZNAM-USGNIVHTSA-N 476.310 0.640 50 20 JCGD Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cn1 1794051182 OUEYODQYKCYOKP-UPHUGPLXSA-N 452.515 0.225 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@H](c3ccccc3)C1)C2)c1ccc(B(O)O)cc1 1795734210 JNYNBNNLTHDKDN-UDKICSLYSA-N 463.299 0.087 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2c(Cl)cccc2n1 1796853080 CZFKBIXRSZVXPM-DBWKPXFBSA-N 483.916 0.503 50 20 JCGD Cc1cccc(C)c1SCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1797947335 MUBDFAUHMVCBPW-HATOLVCRSA-N 468.384 0.979 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2cccnn12 1798500224 KFQKBYXNPBRAAL-OVZMXSCWSA-N 450.293 0.076 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1799283662 ZNNQSGANQYIUPT-CWPLJXCYSA-N 480.525 0.144 50 20 JCGD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2)N1CCN(C)CC1 1799968997 QTNCFNHYJJEBOF-XBYSBRQOSA-N 499.660 0.607 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)CCBr)C3)C2 1800324783 HPVLMHAQKUHSQL-ZXFNITATSA-N 497.390 0.997 50 20 JCGD O=C1C[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)Cc2ccccc2)CN1 1800437268 TZYNGIWQWMAXOP-NRUGXNMXSA-N 464.360 0.718 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1(O)CCC1 1802462223 MDVIEZVXMUYEMO-PBEJRMEISA-N 451.332 0.632 50 20 JCGD CCc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n(C)n1 1807363314 ZHURWUYZFOMJHJ-AVRDEDQJSA-N 461.331 0.691 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1)[C@@H](F)Br 1808668124 IRVSOITYJJOUEP-MPTYRVRUSA-N 459.316 0.429 50 20 JCGD Cn1cc(F)cc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808866836 WDJKQIAJUSOUKX-UTKZUKDTSA-N 450.279 0.872 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809975043 QNBDLDHJHYQSGD-UHFFFAOYSA-N 450.304 0.019 50 20 JCGD CN1CCC[C@H]1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810293694 GHJWLEZFQSSPNS-FFZOFVMBSA-N 451.531 0.494 50 20 JCGD COCCOCCOCCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1812928679 JYOMTFPFUAHYJU-NLWGTHIKSA-N 457.955 0.757 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1813031582 QTDSXEVVHWLJMZ-FHLIZLRMSA-N 460.922 0.654 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@@H](CNC(=O)CNC(N)=O)[C@H]1c1cccnc1 1814220589 COYDXYAPBJDMQL-YQQAZPJKSA-N 482.969 0.888 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3ncccc13)CC2 1819797265 SBQBGSZUVGBWKU-NSHDSACASA-N 477.510 0.724 50 20 JCGD Cn1nc2c(c1C(=O)Nc1nc3c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC3)CCC2 1824238321 VNZRCPATXQCCQI-CQSZACIVSA-N 465.344 0.585 50 20 JCGD CCOC(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)OCC 1826378419 WUSHRRWIDHAZGM-HNNXBMFYSA-N 461.349 0.838 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3CCc4nc[nH]c4C3)sc2C1)c1ccc(B(O)O)cc1 1826617511 UGCHNHOLVZOVCB-ZFWWWQNUSA-N 465.344 0.577 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053280 IOKKUJRTTOPFGY-NRFANRHFSA-N 466.347 0.728 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)cc21 1828499707 ZTPUYMXTNHNINX-FUHWJXTLSA-N 451.955 0.850 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCCN1C)CCO2 1830755009 WYIVQSXKFSZPKE-IWVPYPNRSA-N 474.562 0.061 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCCC1(F)F)CCO2 1831715224 HXMLGWLCPMXAAZ-WIYYLYMNSA-N 466.290 0.262 50 20 JCGD Cn1nncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549713 YZMHVYFCAMFVTG-XOBRGWDASA-N 486.957 0.017 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cncc(S(C)(=O)=O)c1)CCO2 1833400295 QQSGOWGPMQCEKK-HXUWFJFHSA-N 485.635 0.407 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1 1833621509 MHERMWVGLDPTCM-RXVVDRJESA-N 463.922 0.591 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)CC2)CC1)c1ccc(B(O)O)cc1 1834798849 FDTBJJRHQMZFHT-NJDAHSKKSA-N 455.389 0.427 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)CC2)CC1)[C@@H](F)Cl 1835082038 MAASFIGRKNKMAK-QGZVFWFLSA-N 471.986 0.998 50 20 JCGD O=C(CCc1ccccc1Cl)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835175312 ZYZCNNJBZHNVIR-XMMPIXPASA-N 486.761 0.723 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)c3ccccc3)CC2)CC1 1835736981 OSRDVLGWMPKVFD-QFIPXVFZSA-N 480.569 0.604 50 20 JCGD Cc1nocc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737065 JTPBCYUGOZCENW-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)c3ccccc3)C2)C1 1835927222 MOJHWEDPFJHSAF-REWPJTCUSA-N 456.279 0.147 50 20 JCGD Cn1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc2ccccc21 1835936847 GMLNGUIIVDQMLV-VWLOTQADSA-N 477.326 0.242 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc4cc[nH]c34)C2)C1 1835936927 KFRAIRFXEPGKHW-XMMPIXPASA-N 463.299 0.232 50 20 JCGD O=C(c1ccc(Cl)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939314 LYEBNDNULGFSTA-JOCHJYFZSA-N 458.707 0.404 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1 1837458778 BIWMFRJKULGDNX-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnnc4ccccc34)C2)C1 1837459453 PODRYURDVMUUFG-DEOSSOPVSA-N 491.508 0.012 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4ncccc34)C2)C1 1837460122 VWEJVLFPQZWSHB-XMMPIXPASA-N 491.508 0.012 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C2)C1 1837711874 UXDZPJFEPFYPNW-QFIPXVFZSA-N 476.606 0.888 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1 1838051632 NMPPIUMLDJSOIT-BTYIYWSLSA-N 463.922 0.796 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCSC(=N)N)C2)C1 1839963348 IICQPEWBXAEAJN-WBMJQRKESA-N 451.387 0.633 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(OC)n3)C2)C1 1840151112 VPSPTVVAZPBWDB-LAUBAEHRSA-N 455.939 0.733 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccc(O)cc1 1840185829 YBGLRVYJCZCOLO-HXOBKFHXSA-N 462.547 0.325 50 20 JCGD O=C1COc2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2N1 1840188703 XSDQYMKZHVVYER-IBGZPJMESA-N 458.298 0.891 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)CCO2 1840219566 SGSVIAPDSLXSMB-SSKFGXFMSA-N 489.997 0.832 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1 1840958201 VDJNFLRDXNANHK-XLIONFOSSA-N 458.870 0.843 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013244 YCZFBMAYDGJGJC-QAPCUYQASA-N 475.351 0.112 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1cccc(Cl)c1 1843014443 JYTJXIPSLVMNME-HXUWFJFHSA-N 469.734 0.714 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1 1844264657 UZRDTHMPIPNDHG-UHFFFAOYSA-N 467.486 0.790 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844265515 LDBTZWWGLGZLBD-QGZVFWFLSA-N 488.545 0.138 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)/C=C/C(=O)NCc2ccco2)C1 1844344040 ZPMDTOJSZAQTHG-VCRYYJKCSA-N 466.498 0.789 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)NC1CC1 9889305 TVXCSMOVRJAFPX-QGZVFWFLSA-N 464.569 0.666 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)NNC(=O)C(=O)NC1CC1 10215598 FKUNYXICYPWYCV-LBPRGKRZSA-N 483.399 0.819 50 20 JCGD CCn1c(NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nc2ccccc2c1=O 11161656 TYUOJGYGIRIFQN-UHFFFAOYSA-N 472.527 0.540 50 20 JCGD O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 726867836 WOAQBKOOTAVESU-UHFFFAOYSA-N 480.568 0.905 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCNC(=O)c3cccs3)cc2)CC1 728213402 KHASHZJIUIKEFN-UHFFFAOYSA-N 451.574 0.947 50 20 JCGD O=C(NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)C1CCN(c2ncccn2)CC1 728889847 RPHPBHNBHYIXIA-ROUUACIJSA-N 472.546 0.822 50 20 JCGD O=C(COC(=O)CNC(=O)c1cccc(Br)c1)NNC(=O)[C@H]1COc2ccccc2O1 802067644 YAQXEIWTVYDTOW-MRXNPFEDSA-N 492.282 0.710 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1C 807134509 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CCNC(=O)N[C@H](C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1778951187 RLIDAVKWXHPRKO-WIEQDCTASA-N 490.001 0.656 50 20 JCGD CCc1[nH]nc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1Cl 1779029844 AICYSAJWSGWPGD-FQEVSTJZSA-N 461.910 0.381 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374190 JLIQCALCJYCENT-AUSIDOKSSA-N 469.546 0.395 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/O[C@@H]2CCCCO2)C1 1779428469 LHOFNPGKRDTYBV-UKHSJILJSA-N 467.567 0.402 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1OC 1780656434 OYIUJJYXCAMMNC-QHCPKHFHSA-N 469.498 0.460 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3nccn3)C2)C1 1781419903 DSMHFLVRVQVDAZ-LIRRHRJNSA-N 456.931 0.240 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781502003 IOTPKWSVSMDGMP-MEKIYTOJSA-N 459.396 0.472 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(Br)CC1)C2 1782213255 ICTMPOYINKPDJM-RDTXWAMCSA-N 459.385 0.801 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1 1782514015 DVRVNGPNFJSMCX-XMMPIXPASA-N 478.509 0.327 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCS(=O)(=O)c3ccccc3)CCO2)C1 1783933634 BIIKTVVNQCMEMK-JOCHJYFZSA-N 480.587 0.053 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1 1783936292 SYPYKVBDADKJSC-DICZOGMTSA-N 455.515 0.225 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(F)cc4)CC3)[C@H]2C1 1784982372 FCBKZNBJPJAWBO-HSQYWUDLSA-N 466.318 0.831 50 20 JCGD COc1ccccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786983672 PGYVFDUBRXJSIJ-VCOUNFBDSA-N 452.316 0.211 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@@H]1SC(=N)NC1=O 1787495353 LJKPTGBOSYJUGM-FGPLHTHASA-N 461.382 0.554 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)CC1 1787507580 GDRYZZXQGOOGAR-GZERKGCBSA-N 473.530 0.443 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1C 1788611528 JPNZLKSJBXRQTF-XJABCFGWSA-N 481.553 0.838 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Cl)C[C@@H]32)[C@@H](O)C1 1789812864 VQHQLGGFZBRDAM-OJFNHCPVSA-N 463.934 0.728 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(O)c3)[C@H]2C1)NC(=O)NCc1ccccc1 1791111146 MJZSNDBGWZHDDC-NYVOZVTQSA-N 496.568 0.727 50 20 JCGD CCO/C=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1791461439 QBVZCPCNMATODB-XILNNULGSA-N 473.574 0.863 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793879193 MAODEXVCRWQPBU-PFFSRIRZSA-N 472.970 0.329 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(F)cc1F)C2)c1ccc(B(O)O)cc1 1795735733 ALVLFTSEXWGNDO-DBWKPXFBSA-N 464.661 0.815 50 20 JCGD COCCn1nccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1796584551 LHFZHICDTLKJHE-DFGXFYAUSA-N 499.996 0.865 50 20 JCGD 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O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1)[C@H](F)Br 1808682094 YTOMEDVWFCKSPV-ZLIFDBKOSA-N 453.268 0.703 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1 1810099925 MJFIJVLOPYBNQE-UKPHBRMFSA-N 457.325 0.937 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C1(O)CCC1 1810294273 JBWMFROHFYRJKS-OXFYSEKESA-N 466.542 0.951 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1 1810305590 MBNZPVRPSWONPW-VGSWGCGISA-N 479.541 0.412 50 20 JCGD CC(=O)N[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(C)(C)C 1815335816 SIHICPICEMEILA-YJBOKZPZSA-N 472.376 0.600 50 20 JCGD CC(=O)O[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(C)C 1815356779 QZRMKEAATSTABM-QAPCUYQASA-N 459.333 0.636 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCC(=O)N2)n[nH]1 1817087383 YTFUAORMKBLICH-ZKKDUWIDSA-N 454.491 0.814 50 20 JCGD CSCC[C@@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819404741 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CC(=O)NCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551006 FWRDEMUAINYTNY-AUSIDOKSSA-N 494.976 0.564 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCCS2(=O)=O)CC1 1828924298 NCZIZEJHEGTBQO-RBUKOAKNSA-N 477.587 0.496 50 20 JCGD N=C1NCCN1CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1 1828983995 XMHUGPNQFLIDFK-GCJKJVERSA-N 494.955 0.813 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1829119397 WNNFRBXGXDXEBK-RBUKOAKNSA-N 453.584 0.130 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733545 PAZRTDKOIKPSEL-XXHMAFKTSA-N 471.913 0.000 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830735014 CBIGOXVHWYZLPK-HBLJDGLJSA-N 487.981 0.155 50 20 JCGD C[C@](O)(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)C(F)(F)F 1832163032 VPCXWYJAVJYGLJ-ICCXJUOJSA-N 451.211 0.447 50 20 JCGD CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832463206 QWTUNSKBYCGVDO-XQBPLPMBSA-N 451.951 0.099 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4cccnn4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834799309 TUADPEKNTGBJOO-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CCO2)C1 1835350846 DMCXOAXRDKIVPC-WIYYLYMNSA-N 488.990 0.343 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CNc3ccccc31)CCO2 1835714970 HTAIZCKMRVKUFU-RUILVAJGSA-N 494.552 0.786 50 20 JCGD N[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)c1cccnc1 1835829139 UWQJOZQOQDFDOV-QFBILLFUSA-N 455.353 0.713 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935757 PSWCEGFCVWAGFX-RUZDIDTESA-N 481.358 0.443 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1cccs1 1835939868 LNCFBLQNUCASRU-AOMKIAJQSA-N 458.345 0.302 50 20 JCGD O=C(c1cc(Cl)c2nncn2c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837367779 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Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1F 1838915483 PUXCWHGPFBSNLA-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)nc1 1839053781 XAJNAVOGGYCSJG-XMMPIXPASA-N 491.589 0.377 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C#CC3CC3)C2)C1)NC(=O)NCc1ccccc1 1839054313 SUDPRDZPIBGPBM-VWLOTQADSA-N 483.569 0.202 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1839151775 CUWBFVPSDAFOIZ-WBAXXEDZSA-N 465.403 0.706 50 20 JCGD O=C(c1ccnc2c1OCO2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201126 WTWMBXZKROIPKM-CXAGYDPISA-N 460.256 0.571 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc(C)c1C(=O)O 1839480076 KPOPQBYWLMHOML-VWLOTQADSA-N 496.325 0.065 50 20 JCGD O=C([C@@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)CCO2 1839727255 HBJGJFZOQOCENF-VWNVYAMZSA-N 469.941 0.613 50 20 JCGD Cc1ccc([C@@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1839947408 NNHZHWZCDPBMFA-IQGLISFBSA-N 481.553 0.867 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3cnn4C)C2)C1 1840152368 GVFBPZVQPRONNB-LAUBAEHRSA-N 450.923 0.897 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(NC(C)=O)cc3)C2)C1 1840153083 CHNKDQMEHJWLDM-SIKLNZKXSA-N 467.950 0.898 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(Cl)cccn34)C2)C1 1840184228 XJJANCAUXCPUQQ-QFIPXVFZSA-N 492.964 0.431 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(O)c3)C2)C1 1840185055 KPTRMNYQRSQFSH-HSZRJFAPSA-N 462.547 0.154 50 20 JCGD C[S@@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841348434 RIQMLSBIKLNLLB-JSRFDTRYSA-N 466.000 0.451 50 20 JCGD Cc1ccn(CC(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n1 1842081476 HYOQWXDZDLXNPH-UHFFFAOYSA-N 453.547 0.741 50 20 JCGD N#Cc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c(C(F)(F)F)n1 1843013810 QGGDMWOXSNKTDP-UHFFFAOYSA-N 458.205 0.783 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1 1844264554 HMRHPZZPENWRFI-UHFFFAOYSA-N 457.462 0.972 50 20 JCGD CCNC(=S)NCC(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039325 FMLJDYFNFSPWCD-UHFFFAOYSA-N 475.619 0.020 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(Br)cc2O)C1 1845306124 XIYGLUHDSCKXDD-UHFFFAOYSA-N 459.105 0.965 50 20 JCGD C[C@]1(c2ccc(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2)NC(=O)NC1=O 726281714 CHZSEKDCSDJTGF-HXUWFJFHSA-N 473.515 0.179 50 20 JCGD C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)C2=O 728213199 UTGADKASAZYVCH-OPAMFIHVSA-N 492.602 0.567 50 20 JCGD CCS(=O)(=O)N1CCC[C@@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1 728216317 WDBFXXPVBYIEOX-MRXNPFEDSA-N 473.621 0.128 50 20 JCGD O=C(NNC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F)N[C@H]1CCS(=O)(=O)C1 748232320 QWESTUWQWGRSTD-VIFPVBQESA-N 450.374 0.556 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCn2cc([N+](=O)[O-])nc2C)c1 748696875 BADVDELNWLZXNC-UHFFFAOYSA-N 452.493 0.982 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1 749475097 AIUUBPYVJWKSRW-GXTWGEPZSA-N 458.334 0.636 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccc(C(C)(C)C)cc1 753010846 WPKRCSJXTJZBIL-MRXNPFEDSA-N 468.576 0.189 50 20 JCGD Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)CN3CCCC3=O)c12 789857218 BGKRAGGRFXPNIU-AWEZNQCLSA-N 474.543 0.360 50 20 JCGD C[C@H](Oc1ccccc1F)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1 906470642 ICQRIXIIQSDAPO-ZDUSSCGKSA-N 464.475 0.175 50 20 JCGD Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 913392104 XPDKNUUJWFZZPG-UHFFFAOYSA-N 459.572 0.633 50 20 JCGD CS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 913471313 YRKNNOLNYBCEGZ-AWEZNQCLSA-N 472.570 0.734 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)cc1 915894455 KHIZFEURKDOKJI-FQEVSTJZSA-N 489.598 0.847 50 20 JCGD CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2S1(=O)=O 917386962 BVVYMXSPVNOASZ-UHFFFAOYSA-N 469.479 0.561 50 20 JCGD COc1ccc(-n2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)n2)cc1 919807524 UIYNWQJWHGTHQC-UHFFFAOYSA-N 485.522 0.977 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn(C)c4c3CCC4)C2)C1 1777962511 UJMUQYAKKDIPST-XTVKVDEJSA-N 467.530 0.486 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nccnc4c3)C2)C1 1777974806 HYIOZKIUCBQBKI-QHCPKHFHSA-N 461.482 0.386 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnnc2ccccc12 1778529762 CSQANILYWKZRFQ-RCZVLFRGSA-N 474.326 0.751 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCOc3ccc(F)cc3)CCO2)C1 1779029578 UNDVJWGFTVAZIJ-HSZRJFAPSA-N 471.489 0.737 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1sc3nccnc3c1N)CCO2 1779031621 UORUJYSUJHSXJG-NRFANRHFSA-N 482.526 0.029 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1O 1779037148 PUXKVHQNNOYRKO-HSZRJFAPSA-N 469.498 0.547 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780062612 JWOZJMWBDIWFTH-KZULUSFZSA-N 450.293 0.316 50 20 JCGD Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c(O)n1 1780138060 YLOITTFLPBDWID-AUSIDOKSSA-N 453.304 0.217 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(O)ccc1F 1780906666 YMPRKLRRLAYCNH-NFBKMPQASA-N 456.279 0.652 50 20 JCGD Cc1nccnc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967887 BAUWDGVDIUZRED-XMMPIXPASA-N 481.557 0.575 50 20 JCGD CN(C)CCC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969911 MFMJYWFDXBWWLJ-QHCPKHFHSA-N 460.579 0.114 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@]3(C)CCCN3)C2)C1)NC(=O)NCc1ccccc1 1781145619 LGAXJBOJWFPXJZ-DNQXCXABSA-N 472.590 0.305 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782159093 IQMXSUNJNOELPV-LZXBPCNYSA-N 499.568 0.568 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782789327 QXBOPPAPGQWOOB-YVEFUNNKSA-N 457.281 0.370 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1783083227 DXUXYIOUBCMOKZ-ATIYNZHBSA-N 493.369 0.510 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1 1783535691 BRJBFQDXGVLKKV-BLVKFPJESA-N 480.319 0.905 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1783575472 FJEPTJSZUVBYRA-NTKDMRAZSA-N 487.362 0.209 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)CCO2 1783870784 GFUIDSHVDZZUBJ-BXTJHSDWSA-N 463.959 0.346 50 20 JCGD O=C(C#Cc1ccc(Cl)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1783917338 KDEFKMGJRZMMDO-NYVOZVTQSA-N 466.730 0.665 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1cccc(C(F)(F)F)n1)CCO2 1783933544 PVYDPBXCJCHNEZ-HXUWFJFHSA-N 471.480 0.846 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2 1783937383 HXJOTUONTHCRGU-CTNGQTDRSA-N 452.939 0.576 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785458168 KEZZWMJYUZYOQG-GBXCKJPGSA-N 491.564 0.076 50 20 JCGD NC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1785633756 UWOWIOYQMLFRSE-BEFAXECRSA-N 453.337 0.491 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)c(C)nn3C)[C@H]2C1 1785776867 VHCYSVFIVDVCJL-SKIHNHESSA-N 473.509 0.595 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786982017 XYRRJTUUKPEDNF-KNBMTAEXSA-N 485.277 0.629 50 20 JCGD CN(C)[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)c1ccc(Cl)cc1 1786985024 LFTNPIOBODYKNR-FDTGPBLFSA-N 499.804 0.916 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)OCCO4)[C@H]2C1 1787812873 MPRQESWFDZGPOM-XERREHJYSA-N 481.509 0.363 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc(O)c3)C[C@@H]21 1788610030 XCLULLPKSUBEOQ-NDXORKPFSA-N 467.526 0.617 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc(Cl)n1 1789042623 BMNFIRMSOAXXMA-WBAXXEDZSA-N 473.722 0.331 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4snnc4c3)[C@H]2C1 1789207206 SNMXKWDVSCPAOX-NOLJZWGESA-N 461.548 0.053 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccn3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724924 REKQXXMRPHFLOB-UFYCRDLUSA-N 481.557 0.416 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791293160 MDDDOBRPCZBUMG-XSLAGTTESA-N 463.604 0.915 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccc(F)c34)C[C@@H]21 1791293901 MLQKAFMQFGIUOT-ZVZYQTTQSA-N 460.510 0.440 50 20 JCGD CN1CCN(c2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)cc2)CC1 1792972031 LFPFFYZGUKSWMH-PIKOESSRSA-N 450.967 0.241 50 20 JCGD CC(C)(C)OC(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1794155702 RSOWLIJKGHKPAH-RHQZKXFESA-N 496.992 0.707 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n(C)n1 1794344009 UWJUQYARCHYMNC-LOUJCGABSA-N 485.969 0.764 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc3c1CCCO3)C2)c1ccc(B(O)O)cc1 1795734280 AQYPRSFPUIJACP-CCWDJLKJSA-N 456.329 0.270 50 20 JCGD COc1cccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)c[nH]2)c1 1795737339 SZVMFNHBRUAKKK-IRJINJETSA-N 489.337 0.887 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccccc1[N+](=O)[O-])C2)c1cccc(B(O)O)c1 1795741343 VFYBLWJIDBKCIX-NEGDOWEVSA-N 465.271 0.191 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CO)NC(=O)OC(C)(C)C 1796299121 QDKRRXVYJGUHAE-RMEBNNNOSA-N 478.384 0.493 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1nccs1 1796411941 NIEHXSDMVWRCPD-NOZVUNNQSA-N 473.559 0.667 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c(Br)cnn1C 1797253403 QRHYXMWXHSPWAN-CLLJXQQHSA-N 455.357 0.807 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)on1)C2 1797748054 FCVDGGDQHYMOSJ-VPTLXERWSA-N 476.493 0.857 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2 1797957367 KGNXBASMQJUGOV-JLVBRIDZSA-N 475.578 0.733 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1cccn1C)C2 1798523209 WWXFACPVJCYXCK-YVWYUNDQSA-N 484.465 0.945 50 20 JCGD Cc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)no1 1799099168 RYIMEYWZSQHRHO-BBIADKPPSA-N 484.557 0.461 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C 1799362326 YXFFLSIEECFVLW-LFYQSXPISA-N 492.411 0.883 50 20 JCGD COC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1799426694 GRDJAAQEDGHPHP-CCWDJLKJSA-N 482.497 0.380 50 20 JCGD N#Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(Cl)c1 1799751799 BWWKVYUCWCIYJN-HBCWATKFSA-N 468.901 0.727 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1 1800848754 MBGGNUPTOTXZBX-BTTYYORXSA-N 489.529 0.793 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2 1800979045 PJJMAFXIKITUAB-WJNVRWDZSA-N 455.851 0.781 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OC3CCOCC3)n1)C2 1801011944 XEXSSWNDXSZHLW-GPVSGQMNSA-N 489.573 0.216 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC[C@@H]1NC(=O)OC(C)(C)C)C2 1801014174 JPDXWONWWLBELO-UONLAYADSA-N 495.621 0.642 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CN2CCNC2=N)[C@H]1c1cccnc1 1807114953 GOLUPMDLWZXBFP-CFBFWRNQSA-N 479.545 0.061 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807365828 PPWPCKIARPUWPE-BAGYTPMASA-N 450.348 0.565 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(C)C 1810099662 FNOFOFZFTYTDLG-HJNYFJLDSA-N 467.331 0.669 50 20 JCGD O=C(/C=N/N1CCCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810283464 AVWAPXAFCYNYLN-MYOSFUKOSA-N 463.347 0.553 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1 1810303569 VTGZGSRWGJHCIC-FDDCHVKYSA-N 499.535 0.685 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1810305584 LXGSWSGBZIWWCZ-LPHOPBHVSA-N 480.525 0.743 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1810539849 GGTVPQBYCQVKAQ-MAUKXSAKSA-N 458.528 0.664 50 20 JCGD COc1nccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1F 1815340032 BXKWYLQEACOYAK-ZDUSSCGKSA-N 470.291 0.905 50 20 JCGD O=C(COc1cccnc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350307 PDUWUWBTJUUBEM-HNNXBMFYSA-N 452.301 0.523 50 20 JCGD Cn1cccc1C(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361497 HFDVXOOZAQLULQ-CQSZACIVSA-N 452.301 0.270 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1816986889 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1830888327 QIVDJQMLAPDPIU-XMSQKQJNSA-N 468.934 0.462 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC#N)C2)C1 1832549605 VFYCFJJXLHFDJD-YWZLYKJASA-N 458.943 0.879 50 20 JCGD CCc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1833515843 WCQHSQOUUBJKFM-FXZATJRASA-N 482.541 0.848 50 20 JCGD CCOc1cnc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cn1 1833952424 IXUDULKKWWDHSC-UHFFFAOYSA-N 475.594 0.434 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnc3)CC2)CC1 1834266334 LHHGMIRPMWJXDK-WPWMEQJKSA-N 468.562 0.589 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)COC4)CC2)CC1)c1cccc(B(O)O)c1 1834799954 IJRIUMQIOBZPTA-UHFFFAOYSA-N 477.370 0.896 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(Cl)ncn3)CC2)CC1)c1cccc(B(O)O)c1 1834801208 QMGKLMOEZOAYQE-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)C1=O 1834823318 NLUVULFECTVVHQ-HXUWFJFHSA-N 480.315 0.676 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835738297 SZQFUJUYRNQQBM-UHFFFAOYSA-N 496.616 0.774 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4nscc34)C2)C1 1835939630 WBLYQDVGGXMHOR-QHCPKHFHSA-N 481.339 0.360 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1 1836873916 GSFGTLYVNIBUBO-AUUYWEPGSA-N 466.336 0.973 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC[S@@](=O)CC)CCO2)C1 1837245607 CFTYHVDWZNCFQM-QAPORCKPSA-N 453.399 0.775 50 20 JCGD CO[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccc1 1837456128 CRDZBYOMCORQQY-HYBUGGRVSA-N 483.525 0.143 50 20 JCGD O=C(CCN1CCCC1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922181 UDUNMKIFYNYCSF-UHFFFAOYSA-N 457.380 0.465 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc(C(F)(F)F)n1 1838521365 QBNTWEJOVUVJTC-UGSOOPFHSA-N 481.855 0.779 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203090 ZFDGQMYAELXZLQ-ZUEVXXBESA-N 487.326 0.347 50 20 JCGD CCNC(=S)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1839655185 JPNNIGCVXBAUES-SJORKVTESA-N 455.408 0.163 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CNC(=O)C3)C2)C1 1839744063 MQRVHCCUGJNWTE-JJFUZDRZSA-N 474.464 0.464 50 20 JCGD Cc1ccccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839943091 YFLNWPAVLSEBPV-DEOSSOPVSA-N 460.575 0.757 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)ccn3C)C2)C1 1839966249 ZDJSQRBEWCXCHY-BEFAXECRSA-N 456.337 0.629 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1 1840154569 ZQDJENSUVWQAIP-KUHUBIRLSA-N 472.329 0.935 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nn(C)c(C)c3Br)C2)C1 1840154590 ZYSPLLBJNSSTCQ-UGSOOPFHSA-N 493.786 0.815 50 20 JCGD Cc1cncc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c1 1840182657 PHWCMMOVRJEXQN-HSZRJFAPSA-N 461.563 0.152 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840186516 ORXQNEVGTSMACU-SFHVURJKSA-N 480.370 0.500 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1 1840796923 VFJXSGUXBAAOKA-HTAPYJJXSA-N 487.981 0.610 50 20 JCGD NC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1840921545 DUEGXNIMFMLUQX-JXFKEZNVSA-N 483.363 0.117 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CCNC(=O)c2ccc[nH]2)C1 1842015653 WFPLENWNIWXYNS-CVKSISIWSA-N 453.503 0.472 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)[C@@H]2C1 1843012372 IVRVMCXFWHDYQE-REPLKXPHSA-N 469.347 0.296 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1846117387 BFTYERUNQJIOCD-QGZVFWFLSA-N 484.557 0.759 50 20 JCGD Cn1c(=O)c2c(SCC(=O)NNC(=O)c3cccs3)nc(C(C)(C)C)nc2n(C)c1=O 15280685 DLJSUEICYSFWII-UHFFFAOYSA-N 462.557 0.940 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)cn1C 725880917 OPJCPLGEAFAAGU-UHFFFAOYSA-N 462.557 0.911 50 20 JCGD COc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1F 727499977 YXSWKUZMLGCHLB-UHFFFAOYSA-N 481.531 0.586 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=S)NCC1CCC1 727865866 CSXMEWWBBNBQJR-HNNXBMFYSA-N 456.590 0.524 50 20 JCGD N#Cc1cccc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)c1 728825906 VHBXKLJKMGRSMO-MRXNPFEDSA-N 454.464 0.957 50 20 JCGD Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cn1 728890298 KTHKMFVHQBAEPQ-UHFFFAOYSA-N 490.571 0.750 50 20 JCGD CCOC(=O)c1ccc(N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)nc1 728959299 JXHLJXODNLFTCR-UHFFFAOYSA-N 482.545 0.828 50 20 JCGD NC(=O)[C@H](NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(Br)cc1 729676588 ORRNBCPISSNZSD-QGZVFWFLSA-N 497.371 0.931 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)cc1OC 749352043 FGQFQBMZYLZAOO-UHFFFAOYSA-N 471.580 0.395 50 20 JCGD CSCC[C@@H](C(=O)NNC(=O)CNC(=O)c1cccs1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 751208626 GYLRYPDBRQEPLR-MJBXVCDLSA-N 466.585 0.922 50 20 JCGD Cc1noc2ncc(C(=O)NNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)cc12 879378205 KNRXHJUIQXASJB-UHFFFAOYSA-N 473.511 0.946 50 20 JCGD CCCCn1c(CCC(=O)NNC(C)=O)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 912691802 FBIKWIQUPZNOKR-UHFFFAOYSA-N 451.549 0.957 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2=NN(Cc3ccccc3)C(=O)CC2)c1 916108693 NGAKUYVFMDQENJ-UHFFFAOYSA-N 457.512 0.877 50 20 JCGD O=C(NNC(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1)c1ccc(-n2cnnn2)cc1 920049707 PJCXWUWTGQOVLE-UHFFFAOYSA-N 470.515 0.413 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)C[C@@H](C)O1 920738582 SYTWEWFKWLTKFU-CALCHBBNSA-N 466.604 0.881 50 20 JCGD CN(CCCOc1ccc(S(C)(=O)=O)cc1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 920837005 QMNFFBMEZRBHIB-UHFFFAOYSA-N 473.515 0.821 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)cc1 920851176 CDYIWQDLXJJHEQ-QIPHDZALSA-N 471.539 0.987 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)c1ccco1)C2 1778091499 IGDMDCVWWPEVDP-WFESGQPPSA-N 471.514 0.961 50 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1780969902 QCLPVPIFKNKIDX-DVECYGJZSA-N 473.574 0.754 50 20 JCGD N#Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(Cl)c1 1781967530 IVWFYSDYOCEVTQ-QFIPXVFZSA-N 453.691 0.649 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(N(C)C)cc3)CCO2)C1 1783936906 AFOMFDOUGGSUCH-DEOSSOPVSA-N 459.591 0.888 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)CSc1ccccc1[N+](=O)[O-])CCO2 1783937360 GUJFOJYFMWCYBK-OAQYLSRUSA-N 479.559 0.890 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783939217 BAXQCXKGVWYLLT-GAJHUEQPSA-N 483.610 0.883 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)CCc3cnccn3)C2)C1)NC(=O)NCc1ccccc1 1784559837 BTVBNYROIJDQIZ-VWLOTQADSA-N 495.584 0.585 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCNC4=O)[C@H]2C1 1786261200 JOCCKYRSLXRAIK-UPDUFCCMSA-N 458.346 0.456 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786982276 WBFSMQLDYSWLIH-XJABCFGWSA-N 465.315 0.232 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3c(=O)n(C)c4ccccc43)[C@H]2C1 1788141200 UJEWTYSHCDMLAY-FPXQBCRKSA-N 464.950 0.574 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CC(N)=O)C[C@@H]21 1789220737 IVOZEPBIRJTAPY-YWKPPDPDSA-N 476.486 0.625 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1N(C)C 1789819316 ZERAPMXFYQGZRM-BPXKWBHBSA-N 496.568 0.667 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cn2[nH]cnc(=O)c12 1789924747 USLIGEOJZRHWMO-GZCFXPHUSA-N 470.299 0.615 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc(F)c1[N+](=O)[O-] 1790134828 MUQSOYBJWAAQEL-FNHZYXHNSA-N 471.250 0.321 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Cn3ccnc3)[C@H]2C1 1791626031 SPOCZPJOEXFZCA-GFTQFONFSA-N 469.546 0.633 50 20 JCGD Cc1cn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)c(=O)nc1O 1792132146 NNKYANZPYYXWLS-JYJNAYRXSA-N 452.584 0.089 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@H]1C1CC1)NC(=O)NCc1ccccc1 1792851964 BAHKWIIOXUBJNA-HVJVJISESA-N 469.586 0.968 50 20 JCGD CC(C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)N1Cc2ccccc2C1=O 1792974824 DWOVERMJDHBSPD-DLRXZHIHSA-N 463.962 0.856 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3cccc([N+](=O)[O-])c3)CCC1)C2)c1cccc(B(O)O)c1 1795739966 WYQDPPGWYXCAKG-OPMZPASUSA-N 493.325 0.600 50 20 JCGD Cn1ncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1C(F)(F)F 1796188351 SOKYTDVOERAFDV-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD Cc1nnc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN(C)NC(=O)NCc2ccccc2)C3)o1 1796234525 RGKJKBWNPFYYBE-REPLKXPHSA-N 469.546 0.905 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc(Cl)c1)C2 1796439422 CBMMPRBPVXYGPI-WKOABOCDSA-N 459.894 0.467 50 20 JCGD CC(C)(C)n1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cn1 1797749745 MRXHHWBHRMSWFJ-JLVBRIDZSA-N 455.519 0.154 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797751672 NKEZYJLHIYUSCH-WGPDIRSBSA-N 453.499 0.893 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2 1798443007 MKGCJJSDYCDRSO-GCAMRICFSA-N 492.580 0.572 50 20 JCGD COCc1c[nH]c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)c1 1798509595 AMYOLJZWPDTIHH-JHDGKUDLSA-N 498.584 0.711 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn(C)c(C)c1Br 1798717049 YBPAZWHSFJQOEX-GFQSEFKGSA-N 463.760 0.948 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)nc1 1799097625 QTAWOYOZYDXRTF-BBIADKPPSA-N 496.568 0.640 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOCCNC(=O)OC(C)(C)C)C2 1800971117 QGEMCMPHWPPICZ-DFGXFYAUSA-N 477.986 0.761 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)C(C)(C)O 1802152344 XETNGHKFTFEULD-XVIXHAIJSA-N 451.923 0.775 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1804086720 ACYFTOAASJPLEG-HACGYAERSA-N 466.336 0.670 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1804373936 NJSCGGATJSAKBF-IYWMVGAKSA-N 469.347 0.535 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1806507634 IFYYZRQHQJLORR-UHFFFAOYSA-N 461.331 0.656 50 20 JCGD Cc1noc(N)c1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1807106453 MBJYCLVQZBEHCJ-KSSFIOAISA-N 464.486 0.592 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1807374794 JJYCKSJZEANBAU-BBMSBQBJSA-N 462.359 0.421 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)C#CC(=O)O)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807453063 MWQJMVGXFKZWJT-YKSBVNFPSA-N 492.536 0.522 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807997681 CVNIXVGUXVFQLW-QVKFZJNVSA-N 456.503 0.580 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c2ccccc21 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Cc1cc(NC(=O)CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)no1 1818093732 RLCTTXJHFKGLOL-KRWDZBQOSA-N 480.290 0.721 50 20 JCGD Cc1cc2nnc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)[nH]n3)c(C)n2n1 1818589159 IPAKFPRVAQZALE-GOSISDBHSA-N 488.317 0.764 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)N1CCN(C)CC1 1819403939 OHCDYPQWTGSUKA-DNVCBOLYSA-N 483.577 0.350 50 20 JCGD CNc1nsnc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1823741093 OEFNFPOFWJNHPS-QGZVFWFLSA-N 457.365 0.807 50 20 JCGD CC(=O)N[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)C(C)(C)C 1826083510 OOKXLHPKLFJIQX-FZKQIMNGSA-N 466.608 0.979 50 20 JCGD Cc1cc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)no1 1826638413 IBMOXFIVAMQYDH-LLVKDONJSA-N 455.500 0.907 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827049023 FYCALJCFCGRBPV-IBGZPJMESA-N 450.366 0.034 50 20 JCGD Cc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c(=O)[nH]c1C 1827055999 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NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)/C=C/c3cccnc3)CC2)CC1 1833858001 ZALWPAKLOWMJBG-ONEGZZNKSA-N 477.569 0.979 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834824686 GTNQLWPEQQPNTC-MGPUTAFESA-N 483.363 0.441 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1835596090 NODMTVAMLWDAGZ-NQKDMWHGSA-N 492.529 0.964 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835709480 QBQZSTSWJLBYEW-SWLSCSKDSA-N 464.380 0.956 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738336 XLFDCBMUSBKBNV-CYBMUJFWSA-N 481.395 0.654 50 20 JCGD NC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1 1835817505 FHTWNDOSEAXJHU-FRQCXROJSA-N 458.328 0.876 50 20 JCGD O=C(C#Cc1ccc(Cl)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926707 ZOVBAWUZESAFMH-XMMPIXPASA-N 482.729 0.142 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3Cl)C2)C1 1837459417 FPRQDYXISFJSHD-QFIPXVFZSA-N 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C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)N1C[C@H]2C[C@@H]2C1 1797636709 WDIFOULFKQULHG-NLAFLKBPSA-N 498.628 0.262 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cc1)C2 1797750530 FACJRAQRFMOCHS-OPMZPASUSA-N 494.552 0.039 50 20 JCGD COc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1OC 1798767919 OJYIVOMYRPZNNH-LOHQAQBBSA-N 484.513 0.436 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)[C@H](C)O3)C2 1800979069 RKCJKFDLIZSYJG-HMZURLEKSA-N 451.907 0.863 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O 1802150417 CZECJAUGRLJWFE-YIDVYQOGSA-N 477.986 0.494 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C(=O)c2ccco2)[C@H]1c1cccnc1 1804326820 GZTYWRSLJSQWDQ-DNVCBOLYSA-N 462.466 0.876 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)C[C@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1804347463 CSYSDINHRYZMDH-XTWPYSKKSA-N 452.309 0.469 50 20 JCGD CCS(=O)(=O)CC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808408204 HEWAFNBNFHQZLB-QGJUGNDFSA-N 488.570 0.656 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CS(=O)(=O)N2CCCC2)[C@H]1c1cccnc1 1808410960 DQOPRXOSRUSKBQ-JENIJYKNSA-N 472.995 0.767 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CN2CCN(C)CC2)[C@H]1c1cccnc1 1808416615 BUMUUCYKRBJNHI-ZXQDWRTKSA-N 494.600 0.469 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)CC2)C1 1809968991 KOZMKEURDOHCMC-KRWDZBQOSA-N 494.357 0.218 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2CCSCC2)[C@H]1c1cccnc1 1810293540 FSYYKKBURZDEOQ-UWJYYQICSA-N 483.598 0.449 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810542607 UQASIEMDYKYJSR-RXVVDRJESA-N 455.396 0.933 50 20 JCGD COc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1 1810809510 PMKJWPFIZVBWDY-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343977 AALNZRZYQKPEGW-CJNGLKHVSA-N 465.344 0.944 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc2ncnn2c1 1819395457 OTLUWGPRSKEKFU-HNNXBMFYSA-N 462.300 0.405 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401698 OIXMKROLCIHVHY-WBMJQRKESA-N 477.547 0.395 50 20 JCGD CSCC[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800322 NBRCNPSOEMQKNM-HZMBPMFUSA-N 464.573 0.481 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CNC(=O)C3)sc2C1 1825197741 DNNFHZZGNGRULK-ACLYYTTKSA-N 457.516 0.325 50 20 JCGD Cn1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cccc1=O 1827056424 UWZWIQQADHBCIY-HXUWFJFHSA-N 451.332 0.612 50 20 JCGD O=C(/C=C\C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)NC1CC1 1827057946 ODNYABZBKVPDDJ-YUQDSPFASA-N 453.348 0.435 50 20 JCGD NC(=O)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1829476798 YBNVVSIRGNOQNI-FQEVSTJZSA-N 486.356 0.911 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)C1 1830428787 MFZYVJXDUXZZJY-XMSQKQJNSA-N 483.924 0.758 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1830543958 JOLJUJOKZARDPA-AUUYWEPGSA-N 471.352 0.602 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733926 WZIOUWJDKNRHAM-HRAATJIYSA-N 453.923 0.298 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1 1830742371 ALSSOTHTLHEGNL-MRUHUIDDSA-N 477.986 0.857 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3C(=O)C=CC3=O)CC2)CC1 1833616166 WOOWFUMFYIEAFJ-KRWDZBQOSA-N 454.955 0.127 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1 1834543952 TWYFIWPUHHTLIN-HXUWFJFHSA-N 486.034 0.940 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834797552 XXHBCZXLXURCGZ-UHFFFAOYSA-N 493.373 0.219 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc2cnccc2n1 1835324070 GQSQMGAYPHFEHE-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD O=C1Nc2c(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)cccc2C1=O 1835621037 MJQIEVSCENLKPR-KRWDZBQOSA-N 462.934 0.606 50 20 JCGD O=C(CCc1ccsc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935716 NNSDAXGHKAVKSO-QFIPXVFZSA-N 458.345 0.131 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)CCO2 1836215743 MSLBQQPHTVJPQL-DOWNOZBLSA-N 489.997 0.831 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc12 1836915177 RKNZWIDIWMUOMJ-RUZDIDTESA-N 477.326 0.540 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)C1=O 1837140183 SKAZACBXOLPUDQ-IBGZPJMESA-N 456.282 0.695 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1 1837459538 ITSLAXWINFSMHT-XMMPIXPASA-N 479.493 0.815 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(C)n1 1837459682 WNSWYIATIDBKJX-QHCPKHFHSA-N 468.514 0.081 50 20 JCGD O=C(/C=N/N1CCCCC1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919085 CAHYRLBPOMVJQY-NLRVBDNBSA-N 470.379 0.450 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)no1 1837919428 QNVXELGFJAMOOS-UHFFFAOYSA-N 498.345 0.304 50 20 JCGD Cc1cnn(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1837920359 PAQJROCYKMSRIO-UHFFFAOYSA-N 454.336 0.184 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838501480 GYVCHHGSYKMQFP-WOJBJXKFSA-N 484.340 0.396 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)nn1 1838829527 CULNOMKQGCHVSE-LIRRHRJNSA-N 471.352 0.976 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(F)c1)CCO2 1839002454 ZEVXYMHHWQSBGZ-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839023238 YJBIAQFSTCDILH-JOCHJYFZSA-N 482.965 0.792 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ccoc3cn1)CCO2 1839487245 XPJRPGYGQMOYTG-JOCHJYFZSA-N 459.503 0.271 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839752735 RFZXIWJRCGINLZ-UZLBHIALSA-N 461.342 0.947 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3CCCS3(=O)=O)CCO2)C1 1839783911 OKCQSCSVWXRNRY-COXVUDFISA-N 457.376 0.256 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839787303 MSMHQRWCNJGCER-LPHOPBHVSA-N 459.858 0.333 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1840034478 NENBBFBPGSDQIG-ZKNHNOBHSA-N 472.380 0.627 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1 1840155342 YPXJFAQGHXSAIB-KKSFZXQISA-N 461.906 0.758 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840391022 QCAYPTPNKDTKKS-SBUREZEXSA-N 485.371 0.012 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)O2)C1 1841080054 QQGDZEJJZCWKMT-LJQANCHMSA-N 499.373 0.352 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=O)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841354466 CJGDTIXCVDYUOK-KBPBESRZSA-N 475.974 0.131 50 20 JCGD O=C(Cc1ccc(Br)cn1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010706 TUORFZPKDJTTSY-UHFFFAOYSA-N 458.121 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)SCC(=O)N3)C1 1843319476 HYKBNTGDHFZEDD-UHFFFAOYSA-N 466.523 0.860 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)NC1CC1 9889304 TVXCSMOVRJAFPX-KRWDZBQOSA-N 464.569 0.666 50 20 JCGD CN(C1CCCCC1)S(=O)(=O)N1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1 106045305 AFMOUBCUXRJOMI-UHFFFAOYSA-N 482.563 0.483 50 20 JCGD CCN(CC)C(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 726379267 KALIBRPJODSZRE-UHFFFAOYSA-N 454.549 0.507 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)cc1 729276014 VIRCJIQKNKOLDH-ZDUSSCGKSA-N 484.556 0.585 50 20 JCGD O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)COc1ccccc1O 730782594 RBIBKARLHOODPR-UHFFFAOYSA-N 479.511 0.838 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCNC(=O)OC(C)(C)C)nc2)CC1 749343172 JJCYRSPZSQKZKR-UHFFFAOYSA-N 457.557 0.169 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc(S(C)(=O)=O)c2)c1 903881796 ITJCZVFTLFJLOH-UHFFFAOYSA-N 489.597 0.744 50 20 JCGD COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 913391766 ACTKAWYEKMAACN-GOSISDBHSA-N 489.598 0.722 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1 915109322 CGQDRMJDVXKKSZ-QGZVFWFLSA-N 465.576 0.691 50 20 JCGD CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1 916518965 RTLSAPJNRRRIFF-UHFFFAOYSA-N 494.618 0.406 50 20 JCGD Cc1cc(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC(C)C)n(Cc3ccccc3)c2=O)n[nH]1 917392950 ZQYUVPPKNWQFSW-UHFFFAOYSA-N 478.513 0.557 50 20 JCGD C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)S(=O)(=O)c1ccc(F)cc1 917909202 QDRJIICYANKOSA-LBPRGKRZSA-N 457.505 0.699 50 20 JCGD COc1cc(-c2noc(CCC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)n2)cc(Cl)c1OC 919889073 VOMFWLNPCHJSDC-LLVKDONJSA-N 487.922 0.857 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1)N[C@H]1CCS(=O)(=O)C1 919889537 NXTDETNTALRXTL-HNNXBMFYSA-N 498.608 0.626 50 20 JCGD NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1 920020342 ROQBRJRBUWFBGN-VTGFLYEISA-N 450.451 0.980 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)COCc3ccccc3)CCO2)C1 1779031820 YPZXBDOXWIRTNN-HSZRJFAPSA-N 453.499 0.345 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)Cc1ccccc1)C2 1779375580 PVWAQKJVCRPWGC-DNRQZRRGSA-N 481.553 0.416 50 20 JCGD COC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780096616 BIFRIKHNUAXLPE-NRFANRHFSA-N 463.443 0.917 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)CNC3=O)CCO2)C1 1782864437 XNELKZPISHCNDR-CMBCZCRSSA-N 473.436 0.253 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2cc(C)c(O)nc2=O)C1 1783118856 SGYKOHJSZHWZHK-BXTJHSDWSA-N 456.927 0.025 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)=NO2)C1 1783452051 IVWGXKYJUISPRX-YWZLYKJASA-N 486.953 0.182 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(F)cc4)CC3)[C@H]2C1 1784982836 VNJKKNAASWTLPA-HSQYWUDLSA-N 466.318 0.831 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1785552008 VXPMKZNAKWVOQS-YVSHKSEASA-N 465.271 0.432 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1785701076 KJEZMKJODBJXPH-NRUKRLKBSA-N 460.339 0.932 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981660 DPGJKSUYRCEUCO-IHPCNDPISA-N 488.390 0.718 50 20 JCGD COc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786982268 VVOLZIPWEFLUDX-ZRCAFCQKSA-N 456.279 0.421 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3ON=C(c4ccccc4)O3)[C@H]2C1 1788521826 NEZNRLOWCIWPKK-DWKCODDLSA-N 473.530 0.074 50 20 JCGD Cc1nccn1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726667 LHFJUNLZUULOSZ-FKBYEOEOSA-N 497.600 0.517 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)[S@](=O)c1ccccc1 1790599959 HTPUAYLUMCWJQH-DIMDPJETSA-N 478.615 0.535 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)[C@H]3SC(=N)NC3=O)C[C@@H]21 1790962034 SZVCMLKYOAKKSG-LQSBQDLSSA-N 475.409 0.942 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)C[C@@H]21 1791249494 LFLVIQKWEAUESX-ATIWLJMLSA-N 489.997 0.856 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(C)c1 1792095910 SATXIJLXVOYDDN-NYVOZVTQSA-N 480.326 0.369 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C(=O)C1 1792308397 ITWKAFCSANGFLF-XSWJXKHESA-N 490.960 0.580 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](NC(=O)OC)c1ccccc1 1792803728 IXRWEVUYNBLLSR-FLXSYLCISA-N 453.923 0.927 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792975659 TVXOXNMBGYRHEV-PTIUUAQKSA-N 496.992 0.707 50 20 JCGD COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797750559 KVIVTPSZSOVVKW-VPTLXERWSA-N 453.499 0.140 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)nc1 1799347640 MZHUWGVJDVSZOD-RDBQEKCUSA-N 464.313 0.379 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1 1799865190 LEDOJLPEQJJQRF-FAQVEIGNSA-N 469.546 0.152 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@H](F)Cl)C3)C2 1800325362 RCTOJKBBMGNANM-FVFNWAJOSA-N 456.902 0.746 50 20 JCGD CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1803690365 NOKVNOXMTHCDTM-JKIFEVAISA-N 458.910 0.935 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1 1804817932 YVUPBHVUCOJWBW-KKSFZXQISA-N 467.530 0.268 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)C(=O)N(C)C)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1806944038 NQFCPDRSALCHTQ-RBBKRZOGSA-N 495.584 0.522 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372770 HQDBSGCVDNCDOT-GBXCKJPGSA-N 484.325 0.366 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1808590350 CTSRZXFVTYDABJ-PGRDOPGGSA-N 488.309 0.576 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1810120219 GARMAJOPPKWWHJ-BQRYGKNWSA-N 451.593 0.619 50 20 JCGD CCn1nccc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810298375 IALKMJMFUINOTB-UZLBHIALSA-N 462.514 0.930 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)C1 1814861100 HDJFRNAVWIXSEE-FRQCXROJSA-N 468.319 0.985 50 20 JCGD Cc1nn(C)c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1F 1815337314 RLATUDKRQFDCKM-CYBMUJFWSA-N 457.296 0.544 50 20 JCGD O=C(/C=N/N1CCCCC1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356728 NMIMIURQHYOSLL-OHHQFBAHSA-N 455.349 0.520 50 20 JCGD CN(C)c1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1 1815360161 ANDUKUAVHXZUKM-MRXNPFEDSA-N 465.344 0.824 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccn(C(F)F)n1)CC2)c1cccc(B(O)O)c1 1815360674 LXNHEIXKPUMSCQ-LBPRGKRZSA-N 461.259 0.954 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3ccncc13)CC2 1819796936 IVDITRBJNFUXBC-LLVKDONJSA-N 477.510 0.724 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](O)N3CCOCC3)sc2C1)[C@H](F)Br 1819891115 OJHHWXFGTNFPTN-FDLBOYPASA-N 451.318 0.396 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827049096 KLLBABSCYPNQOR-UZLBHIALSA-N 464.393 0.280 50 20 JCGD O=C(c1cc(O)nc(O)n1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059828 WXLBEUDZPYHDDU-SFHVURJKSA-N 454.292 0.115 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CNC(=N)N)CCN2C(=O)OCc2ccccc2)C1 1828974957 QXKXYBXBIVWUAC-VGSWGCGISA-N 494.980 0.175 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCCO1)CCO2 1829917656 VBYCKDRDYIOSOJ-LWIOAKLZSA-N 461.519 0.146 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3CS(C)(=O)=O)C2)C1 1830358572 PLAPPTMSHZXSLL-NRFANRHFSA-N 488.006 0.961 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1830575808 YSZWRIVUXMOZRJ-KPOBHBOGSA-N 498.404 0.565 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C(=O)NCc3ccccc3)CCO2)C1 1830679229 LOSWAMCGAQJEMK-MFYJYGFBSA-N 479.961 0.569 50 20 JCGD O=C(c1cn2cc(Cl)ccc2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728095 OYEFEJUILDVKAS-BEFAXECRSA-N 457.314 0.657 50 20 JCGD C=CC[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830738923 VKVIYEACSZWXSK-PNLZDCPESA-N 489.997 0.902 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3ccc4sccc4c3=O)CCO2)C1 1832895721 AMISATJUUZRWKE-IERDGZPVSA-N 483.974 0.773 50 20 JCGD O=C1COc2ccc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)cc2N1 1833310159 LSJQQKQEFHQGTB-GOSISDBHSA-N 464.950 0.802 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833310981 ZWDICQZIOIQXKH-ROUUACIJSA-N 491.029 0.697 50 20 JCGD COc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834178059 XJWDHPXVIVVZNP-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD Cc1nnc(CCC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1834797512 RKKOAXHWCQQOPD-UHFFFAOYSA-N 485.419 0.344 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3noc4c3CCCC4)CC2)CC1)c1ccc(B(O)O)cc1 1834797877 HDOPIZIWJOATBK-UHFFFAOYSA-N 480.374 0.732 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C#Cc3ccccc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797981 SJHKUHJAARHSED-UHFFFAOYSA-N 459.355 0.603 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)OCO4)CC2)CC1)c1cccc(B(O)O)c1 1834800179 WXWRVIHTEJUMTR-UHFFFAOYSA-N 479.342 0.594 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1cccc(F)c1)CCO2 1835028777 UIMFVIQYGZKXMF-QFIPXVFZSA-N 450.511 0.198 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C(=O)C3CC3)CC2)CC1 1835116468 QYIUYEDFDUPIJV-CVKSISIWSA-N 456.547 0.671 50 20 JCGD O=C(CCS(=O)(=O)c1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1835146736 ZZADHGLHQHFCBF-IEBWSBKVSA-N 462.927 0.841 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(F)nc3F)CC2)CC1 1835734578 LFMCOGNEDPPWNF-UHFFFAOYSA-N 487.511 0.857 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934062 LQYTYRXLQIHMCW-JYFHCDHNSA-N 494.353 0.141 50 20 JCGD Cc1occ(C(F)(F)F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836557134 GWSRTZYMHYOUFC-NRFANRHFSA-N 496.247 0.670 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(C)(C)C 1836799017 BEOSZDWYRDTHDO-QFIPXVFZSA-N 487.406 0.529 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4=O)CCO2)C1 1837140114 PKZMILWEOHWVTN-ODXCJYRJSA-N 480.315 0.675 50 20 JCGD C/C(=C\c1cccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460806 KXTPVRQMBKPOPG-PMILPSSXSA-N 480.525 0.254 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccc(OC)c3OC)CCO2)C1 1838841883 UTJQGRYCNPMSSL-JLTOFOAXSA-N 457.911 0.423 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839154925 CEQUYOSCCISDOI-UXPWSPDFSA-N 490.388 0.150 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1839155462 UQCCFAOEONJNTL-RTBURBONSA-N 491.328 0.449 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1 1839774865 WEQWSUJWKIVVCK-FXAWDEMLSA-N 460.955 0.630 50 20 JCGD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839912226 NAHRCJVLYZIGGC-QHYAIYAISA-N 456.348 0.263 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1 1840587516 XDAGYXKNRRVIPW-YRBPKABKSA-N 475.546 0.394 50 20 JCGD C[S@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1841230554 ABLIEVJPUQGIGC-PFBVRONTSA-N 466.000 0.451 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)[C@H](F)C1 1843010343 GESCHFKDFBXLDO-RTBURBONSA-N 489.353 0.779 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nc(O)n3c1CCCC3)C2 1843416132 CIMMQXJRRZDLML-AFUMVMLFSA-N 453.503 0.876 50 20 JCGD C[C@@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)N1CSCSC1 1844318441 OBEJQCJYDKADAZ-ZDUSSCGKSA-N 450.590 0.545 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)C[C@H]2C[C@H]21 1847573308 TWWDLMQNIDHQLH-CAEUUNHDSA-N 484.557 0.898 50 20 JCGD C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1 12800295 IQVDUBZZJHNYTF-UHFFFAOYSA-N 463.541 0.274 50 20 JCGD COc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 28808125 YZUXWXOJXUEUGH-UHFFFAOYSA-N 472.501 0.542 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3nc(-c4ccncc4)no3)c2)CC1 728073755 RBLOMBMTXTYQIQ-UHFFFAOYSA-N 471.499 0.741 50 20 JCGD CN(C)S(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=O)c1ccc(Cl)cc1 728705393 WHQSBBQEXCSHSA-UHFFFAOYSA-N 452.876 0.959 50 20 JCGD C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc2Cl)C1 729276952 OYWQQJLARBPMET-VXGBXAGGSA-N 480.996 0.459 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN(C)S(=O)(=O)c2ccc(C)c(C)c2)cc1OC 904225078 RBFLBMMIZSEKBY-UHFFFAOYSA-N 493.538 0.946 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cnn3cccnc13)N(S(C)(=O)=O)CC2 913476746 UQANMQABEXEXBD-INIZCTEOSA-N 488.526 0.457 50 20 JCGD O=C(NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)NNc1ccc(-n2cccn2)nn1 916650070 ZHAHAHSFBKLEAL-MRXNPFEDSA-N 472.531 0.946 50 20 JCGD COc1cc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)ccc1OCCO 918227930 BZKMNXBWDJBCLA-UHFFFAOYSA-N 494.574 0.224 50 20 JCGD COc1ccc(CC(=O)NNC(=O)c2ccc(C)cc2O)cc1S(=O)(=O)N1CCOCC1 918340888 GFLPKIPLBQUECR-UHFFFAOYSA-N 463.512 0.734 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)CC(F)(F)F 918365216 WVRBPJPSCHOBOM-RSPDNQDQSA-N 471.479 0.480 50 20 JCGD CCS(=O)(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1 919649681 DAQPCVQFHFFLSI-CQSZACIVSA-N 457.505 0.070 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778094732 MGXYIVZZAWHSJF-ONPIMXJTSA-N 488.589 0.939 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)[C@]3(F)CCCCC3(F)F)C2)C1 1778218409 CXTAMMSXCGWRPB-VQTJNVASSA-N 454.254 0.728 50 20 JCGD CCOc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029454 SFQDHFCPSFMKQU-JOCHJYFZSA-N 454.487 0.236 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)CC(=O)N3)C2 1779372223 CTLUZSRRHJFBQW-CJFMBICVSA-N 492.536 0.621 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ncccc3C(F)(F)F)C2)C1 1779708301 WSFYCZSADTTXHE-FQEVSTJZSA-N 463.221 0.538 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1)C(=O)C(=O)O 1783022943 RIELPRDBYCJEGV-KKSFZXQISA-N 496.358 0.366 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3C(=O)c4ccccc4C3=O)[C@H]2C1 1785064497 KHPMBJDHOBTKQG-QZHFEQFPSA-N 477.945 0.906 50 20 JCGD Cc1nc2ccccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1787848372 OMVICAJYFZAZFU-IHPCNDPISA-N 462.315 0.230 50 20 JCGD COc1cc(C)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1789996310 MYGJEHRMZLISGM-HSQYWUDLSA-N 452.316 0.591 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1 1790694369 LMHBAIFGSJBZEJ-OKKAQWFQSA-N 492.479 0.916 50 20 JCGD C[C@H]1Oc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]4C3)cc2NC1=O 1791290861 PZDUEZPNJZMFOF-FKKBTLCVSA-N 487.557 0.372 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4cccc(F)c34)C[C@@H]21 1791293762 IDRMRJNWAASKMJ-ZQIUZPCESA-N 460.510 0.668 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)ccc1F 1791945070 STETZTFLUHXNBR-MDKPJZGXSA-N 456.279 0.421 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CN(C(=O)OC(C)(C)C)CCO3)[C@H]2C1 1792343931 NBROMTCJDAVYIB-IECFSIQFSA-N 489.997 0.856 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1CS(C)(=O)=O)C2 1792870113 GAKHLUJGFRYYFV-ZJOBFFGXSA-N 488.404 0.860 50 20 JCGD O=C(Cc1cc([N+](=O)[O-])ccc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796189848 IDEYMSASMJUTAP-BCDXTJNWSA-N 455.251 0.908 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1CNc3ccccc3O1)C2 1796442147 TUNXPLCNQSUCMX-CYFBGRTHSA-N 494.552 0.973 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(C)cc1)C2 1796445670 HLOMPGNNSRIDEQ-TWKZMHJBSA-N 465.510 0.901 50 20 JCGD Cc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)n1 1797748588 KKPVSMKSUISAIV-VPTLXERWSA-N 452.515 0.225 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(C)n[nH]c1C 1799416806 UWFWBJLBITUEMQ-IHBLFXCCSA-N 455.519 0.293 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(-c2cccnc2)cc1 1799430435 KCFATBSIXNYIKF-ACHVPNTGSA-N 471.322 0.945 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800907912 WHHJJEYVZYIARO-VPTLXERWSA-N 485.327 0.270 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)/C=N/O[C@H]2CCCCO2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362913 XHJRUGBWBJDIBE-BOJAEMNUSA-N 480.330 0.610 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1807373916 DJKOICXNENKTCG-KNQAVFIVSA-N 477.330 0.238 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(Cl)nn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376186 UDOQDCHSZJKTHA-JXFKEZNVSA-N 465.706 0.838 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)[C@@H]1c1cccnc1 1807744557 XKCMYRCRCJHCEK-FDGPYGQJSA-N 484.601 0.861 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)N1CCN(C)CC1 1807864923 FZWNBLJDDXTAPA-JUXOCIIHSA-N 494.600 0.036 50 20 JCGD C#CCO[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810295673 VCDZCNUYKMRASA-WRWLIDTKSA-N 450.499 0.438 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n(C)n1 1810923017 BZFIGMALNQRUTK-AVRDEDQJSA-N 461.331 0.691 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C(=O)CNC(N)=O)[C@H]1c1cccnc1 1811359332 LYSKTBLSZVAXBE-QRWLVFNGSA-N 484.469 0.903 50 20 JCGD COC(=O)C12CC(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)(C1)C2 1812836054 HONKDAXPUGVQFO-REVQRJLHSA-N 477.326 0.424 50 20 JCGD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)N1C[C@H]2C[C@H]2C1 1815356359 FJBAGUCVDLEORA-UTXMOHQDSA-N 454.361 0.389 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1816985819 CFMUACRLKVSVOA-HIFRSBDPSA-N 471.373 0.075 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1 1817479951 XEPSZFABLFYKPV-IBGZPJMESA-N 461.287 0.808 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3nc4ccccc4n(C)c3=O)sc2C1 1818380687 PTBNWZVVSGQJSK-ZDUSSCGKSA-N 497.581 0.989 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3ON=C(c4ccccc4)O3)sc2C1)c1cccc(B(O)O)c1 1819586976 YWNXRJFGZHLYTQ-AOMKIAJQSA-N 492.322 0.783 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(-n4ccnc4)ccn3)sc2C1)c1cccc(B(O)O)c1 1821687292 PKVIJQRMQUEYPM-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD NC(=O)c1nccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1 1823006374 DXPIJRXSPBUDQF-KBUNVGBDSA-N 457.285 0.948 50 20 JCGD CN1CCN(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1828442743 BFLDTHPDEGZWFJ-NRFANRHFSA-N 471.606 0.166 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@@]2(C1)CN(C(=O)C1CC1)CCN2C(=O)OCc1ccccc1 1829443735 NEUSTTHIOOGJPW-AREMUKBSSA-N 491.353 0.842 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CC(F)(F)C1)CCO2 1829988339 NYWOICPOJWOMBY-UMFTVLFGSA-N 467.473 0.622 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1830540512 QNPXAOPHJRPWJI-BZNIZROVSA-N 460.285 0.419 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)C1CC1 1830719539 FTAWNVLKVNVVCK-IIBYNOLFSA-N 475.970 0.442 50 20 JCGD O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2 1832500224 RMFQHYRBIGCKMJ-JTDSTZFVSA-N 473.295 0.973 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3C(N)=O)CCO2)C1 1833305033 MWTBVEBDVRYREW-BFUOFWGJSA-N 469.336 0.282 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnsn3)CCO2)C1 1833522997 LBENQGFJSJVJME-ORAYPTAESA-N 489.982 0.740 50 20 JCGD CC[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)N(CC)CC 1833537872 AYQFAUADESTNMS-QHCPKHFHSA-N 472.439 0.672 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnn4ccncc34)CC2)CC1 1835404825 GEOMMMQPXMAHIY-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cs1 1835736969 CTUXWPRSNVPUTK-UHFFFAOYSA-N 471.587 0.949 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3Cl)C2)C1 1835939708 YHENJCLUZLXGQD-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3nccnc3C(N)=O)CC2)CC1 1836050774 JYLWAQFWGGQMRH-HNNXBMFYSA-N 481.395 0.934 50 20 JCGD O=C1CC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)=NN1 1837366401 UKYRPGCMMMQYGO-IIBYNOLFSA-N 493.358 0.325 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837456041 AZDBNHYARFVSSR-QHCPKHFHSA-N 485.545 0.020 50 20 JCGD COCc1oncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919466 VDDDMYUMKCWBSU-UHFFFAOYSA-N 471.319 0.427 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921302 WOJWJKNOVXMMBM-QGZVFWFLSA-N 473.379 0.283 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1Cl)CCO2 1838866596 BFSOZRFBAQGHME-NRFANRHFSA-N 452.939 0.783 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)C2)C1 1839143245 PTGIXTMPDAXOJH-UZUQRXQVSA-N 493.992 0.495 50 20 JCGD CNC(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839801482 MOIUDFUPBXPZHP-UTKZUKDTSA-N 482.375 0.585 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccnc3OC)C2)C1 1839962788 QVEBSJFMKQPTPF-UGSOOPFHSA-N 457.325 0.729 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C)o3)CCO2)C1 1840507131 DYAYUBZVIWNJON-VAHWYXDJSA-N 471.514 0.721 50 20 JCGD O=C(NCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1ccccc1 1840800096 GZGBGHZHHOWXQV-YLJYHZDGSA-N 486.338 0.953 50 20 JCGD Cc1cc(CC(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)nn1C 1841458117 SSEGZZPTQPFIKS-UHFFFAOYSA-N 467.574 0.821 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccnc1OCC1CC1)C2 1844263651 BOVNFEHYDFPHTR-UHFFFAOYSA-N 450.499 1.000 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CN2C(=O)C3(CCOCC3)c3ccccc32)C1 1845021269 YJDMKRGXZBXWIL-UHFFFAOYSA-N 497.596 0.658 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)C(C)(C)NCCC#N)C2)NC(=O)NCc1ccccc1 1845038836 ZFYCDGWHNOEUKR-UHFFFAOYSA-N 469.590 0.818 50 20 JCGD Cc1nccnc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039079 AQGBIWQHAWWESU-UHFFFAOYSA-N 451.531 0.948 50 20 JCGD O=C1CN(CC(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)C(=O)N1 1845940364 LPXKAYVLJPZGIQ-HNNXBMFYSA-N 463.332 0.748 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)C[C@@H]2C1 1846104979 AKEQXVDZTREWSM-IQGLISFBSA-N 483.374 0.831 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CCCNC(N)=O)NC(=O)OC(C)(C)C)C2 1846365770 UWXXTKKVPVQKEW-HUUCEWRRSA-N 490.001 0.785 50 20 JCGD Cc1nnc(NNC(=O)c2cc(S(=O)(=O)NC[C@H]3CCCO3)ccc2Br)nc1O 21127951 GATLPWDTJPEUJN-SNVBAGLBSA-N 487.336 0.862 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)cc1OC 104664179 RFBZVQISCVUBAQ-UHFFFAOYSA-N 492.554 0.866 50 20 JCGD CN1CCC(N2CCC(NC(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)CC2)CC1 747987939 XADJZTTXGPNZRK-UHFFFAOYSA-N 492.646 0.974 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(N3CCCS3(=O)=O)cc2)n1 762960430 ITUYEDSRXAXPAB-UHFFFAOYSA-N 452.514 0.538 50 20 JCGD O=C(COC(=O)CCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cccc([N+](=O)[O-])c1 792896663 DRJPHILKZAURRF-UHFFFAOYSA-N 454.395 0.975 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)N(C)C3=O)c1 861446330 GLFGGFYMWUMHJN-UHFFFAOYSA-N 494.551 0.566 50 20 JCGD CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)C(=O)NC2CC2)ccc1Br 915064051 JTDNHHXTNOSIPZ-UHFFFAOYSA-N 461.338 0.566 50 20 JCGD COc1ccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 915921903 OGEQCEIVRRKEMC-UHFFFAOYSA-N 478.527 0.626 50 20 JCGD COC(=O)c1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 916158566 ZDGYZXJXZISWFG-UHFFFAOYSA-N 476.511 0.283 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc1 916391617 HZFDJRRPABXHKT-MRXNPFEDSA-N 483.525 0.955 50 20 JCGD COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 917719380 FEYCMYYZRXSRMV-UHFFFAOYSA-N 471.513 0.112 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 919688908 JILGCDOVLKECNA-INIZCTEOSA-N 460.578 0.292 50 20 JCGD CC(C)(C)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 920212328 BPVXQHCQHKNSKC-CQSZACIVSA-N 460.578 0.170 50 20 JCGD Cc1ccc(C)c(OCC(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2N2CCOCC2)c1 920223287 IARBSACIIQIZBS-UHFFFAOYSA-N 462.528 0.627 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCC1=O)C2 1778091601 YAGTVBKSZJMJKO-QZICUBQQSA-N 472.546 0.257 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1)N1C[C@@H]2C[C@H]2C1 1778863289 ZBLQCZJODNKZPR-OJZVVMIASA-N 498.628 0.503 50 20 JCGD Cc1cncc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779028909 POESQLLQNLVNGZ-HSZRJFAPSA-N 452.515 0.465 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1779034877 VXPGGCSAWIZARG-GMKGHPLGSA-N 456.528 0.607 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1779382110 GSIBMBSEZHTTPQ-HXUWFJFHSA-N 488.413 0.909 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)N2CCOCC2)C1 1779415484 KENXTCIEBBZGIN-YCEFEEMOSA-N 452.379 0.387 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)C[C@](C)(O)CC(=O)O)CCO2)C1 1780098329 JYHYFAIIRWBIKE-FCHUYYIVSA-N 493.469 0.579 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccn1C)CCO2)NC(=O)NCc1ccccc1 1780969956 PKIHCEWEBQCOMX-XMMPIXPASA-N 468.558 0.815 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)cn1 1780970454 YHAIXMZLEUCIDV-RUZDIDTESA-N 496.568 0.880 50 20 JCGD Cc1ncc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)s1 1782510358 LPWHOYSOMAQAEM-DYESRHJHSA-N 451.593 0.881 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(S(C)(=O)=O)CC3)CCO2)C1 1783349884 VGAUBOJINITBMA-CRAIPNDOSA-N 480.425 0.661 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncccc1C(F)(F)F)CCO2 1783934898 JZRITKSNZSHXST-LJQANCHMSA-N 457.453 0.917 50 20 JCGD O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C[C@@H]21 1786407168 JELKIAXMWIYYFS-YDHLFZDLSA-N 471.308 0.521 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C[C@@H]21)c1ccc(B(O)O)cc1 1786979627 FFTQQFUQQCDEFR-MDKPJZGXSA-N 452.272 0.002 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1787468214 HZMHAYZQECIKNB-QMHWVQJVSA-N 463.959 0.106 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ncccc4n3)[C@H]2C1 1788015555 WNZAPXAZUVNFMV-BRZMCFHBSA-N 478.513 0.457 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCO3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726885 ZCBAWOLPHWUKLN-TUFLPTIASA-N 473.574 0.491 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21)[C@H](F)Br 1789922794 TYIDPVQKWMNGMA-TZANDKBRSA-N 487.326 0.663 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3NC(=O)C4)[C@H]2C1 1790446479 ZGQXOYOROWNGCK-JJJWMERFSA-N 492.536 0.909 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)[C@H](O)C1 1792452289 PYCOSZYCAKTHAS-AYCBFJCHSA-N 463.934 0.728 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn1C)NC(=O)NCc1ccccc1 1794608821 PYZXFFUKPNSNNQ-HATOLVCRSA-N 468.558 0.575 50 20 JCGD Nc1c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)sc2nccnc12 1796158587 VEKPFAAFFCCNDU-QDMKHBRRSA-N 451.317 0.519 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)C1 1796192870 VKDXTASSXXBXFQ-BCDXTJNWSA-N 475.326 0.577 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796369981 GKCVFTHZFALNAD-ITGHMWBKSA-N 465.906 0.567 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800902111 ATFCMEWLCJLGFC-BPKGMFCQSA-N 459.971 0.869 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=COCC1)NC(=O)NCc1ccccc1 1801546957 WMLBNCNMQQVQAW-CEQLMSFQSA-N 457.531 0.226 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCC(=O)NC2)[C@@H]1c1cccnc1 1802613071 QYTXSAKIDPMVSH-RYNZGHHISA-N 479.541 0.748 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364919 UWQRSNWPIXZGJL-YADARESESA-N 484.325 0.526 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365869 ZXMIUAZIRSCPCP-PGRDOPGGSA-N 467.331 0.813 50 20 JCGD NC[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccccc1 1807366034 XKBADCGBEGQULD-NHTMILBNSA-N 472.354 0.824 50 20 JCGD CN1CCCn2nc(C(=O)N3CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)cc2C1 1813074588 SXFLVLFZUGYWPG-DVECYGJZSA-N 496.616 0.806 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)/C=C/c2cnccn2)[C@@H]1c1cccnc1 1813487533 QSBLNOJIHMUURB-UEFYJELNSA-N 451.531 0.964 50 20 JCGD CN1N=C(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CCC1=O 1815622021 VJKFEQVHUICLBD-INIZCTEOSA-N 467.490 0.322 50 20 JCGD Cn1ccc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n1 1817558650 CMNSCUHFKKOIPQ-QGZVFWFLSA-N 451.491 0.690 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819402051 KPYOMGGPTKOHFU-FYCOFBDGSA-N 455.475 0.833 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCNC(=O)C2)[nH]n1 1819404420 JZUIKEPROMCDSD-LRDDRELGSA-N 454.491 0.240 50 20 JCGD CN1CCC[C@@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)C1 1819798101 WBAOZWUQLLRLMD-CHWSQXEVSA-N 457.560 0.709 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1820991715 MLAVTZAUOZNUHG-LJQANCHMSA-N 450.308 0.978 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1 1822416797 PZADSDNTEFOPED-LBPRGKRZSA-N 461.445 0.453 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CC2 1826088867 QYJUQFCWZUTRFH-KFWWJZLASA-N 476.603 0.829 50 20 JCGD Cc1c(Cl)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830135156 VVFKGWIMUXPWJY-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)ccc1F)CCO2 1830188308 GMLYAVCBNLTFRH-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725731 RJFXWPSEUBKDPT-JTSKRJEESA-N 478.933 0.556 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CC1 1830737719 GTWINJSZNAAYRZ-HTAPYJJXSA-N 487.981 0.610 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830738031 KHDXJPOSOPTIQJ-YWZLYKJASA-N 463.959 0.347 50 20 JCGD Cc1cc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)c1 1831173929 BAJWSGGYSPKMDH-VWLOTQADSA-N 490.601 0.820 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1831201660 GJVHSUSRKRJQTN-WBVHZDCISA-N 452.321 0.440 50 20 JCGD COc1nccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1833502203 JWZSZXPBKOXFLS-FZKQIMNGSA-N 457.325 0.586 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccncc1)CCO2)NC(=O)NCc1ccccc1 1834017901 FQGPFAHRBJBDCR-VWLOTQADSA-N 496.568 0.498 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(O)n3)CC2)CC1 1835737008 GPRMWUMJXZEBTO-UHFFFAOYSA-N 467.530 0.285 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCCC3(F)F)C2)C1 1835927844 YQRVYENCZHBDRN-WIYYLYMNSA-N 466.290 0.262 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1836640492 KSUBXGZMCYNFFH-CKJXQJPGSA-N 475.970 0.300 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)N1C[C@H]3C[C@H]3C1)CCO2 1837289789 WWKZIUOXBXCEFV-SAGLZJIZSA-N 458.397 0.957 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC3CCCC3)C2)C1 1837456922 PVJDPNACAILFJM-QHCPKHFHSA-N 459.547 0.726 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1 1837459449 PLCBKOHWADGXJQ-RUZDIDTESA-N 490.520 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1 1837460340 BVZXDTMRRRFODL-HSZRJFAPSA-N 489.479 0.276 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837630268 NJSWKPSTDFJBCB-DYVFJYSZSA-N 459.272 0.167 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1837713270 RPLGAVPGHVMLTD-JOCHJYFZSA-N 476.606 0.977 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1837715275 GTONQAUXYWZXFW-NRFANRHFSA-N 475.578 0.011 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc(O)n1 1837919414 OEXJUAUKUOOVTK-UHFFFAOYSA-N 467.331 0.701 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H](O)Cc3ccccc3)CC2)CC1 1837920193 QUXSARCCEDILAT-XMMPIXPASA-N 480.370 0.582 50 20 JCGD Cn1nc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c2c1CCC2 1837920418 WQXUPGJGNKBVGF-UHFFFAOYSA-N 480.374 0.515 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3ccnn3)CC2)CC1 1838103202 OHRVAXIYYSIAMG-MOROIOLQSA-N 484.561 0.972 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1839145991 SNZZTLDSGDKJFX-MDOVXXIYSA-N 453.927 0.069 50 20 JCGD O=C1NCc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc21 1839200677 PFCSTOGPPDNCPP-KXBFYZLASA-N 470.295 0.691 50 20 JCGD CC(=O)NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802001 JQFMRLUYXDWVOY-UGKGYDQZSA-N 496.402 0.975 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1839966645 LQGPKOUZACZDDH-BEFAXECRSA-N 471.352 0.745 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3C1)CCO2 1839991161 KQSFDSJKDNKKHB-ATIYNZHBSA-N 478.354 0.242 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nn(C)c4c3CCC4)C2)C1 1840032869 MMIXQZPHSYVEOE-ORAYPTAESA-N 455.353 0.762 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1 1840154457 XECWLAHDGFDIET-ACJLOTCBSA-N 455.924 0.410 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1 1840156048 MPNPXAHDTBGJMK-IFOZNXLVSA-N 477.945 0.607 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1840314880 RMPUIGAPDFNCDO-SANMLTNESA-N 495.385 0.135 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)ccc(F)c1F 1840703638 NMZKXYNSMTVZAS-HSZRJFAPSA-N 474.269 0.337 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C[C@H]2C[C@H]21 1841361490 USQLVYLKGQZTKB-BHIYHBOVSA-N 469.347 0.581 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CNC(=O)c2cccnc2)C1)NC(=O)NCc1ccccc1 1841970090 OFBQXCHUOWSDMA-UHFFFAOYSA-N 493.568 0.361 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)C2 1844264338 ILCJVXHLXOJHQB-NRFANRHFSA-N 450.455 0.237 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CC4(CCCN4C(=O)[C@@H](F)Br)C3)n2)CCCN1 1845216870 QFYNXCBHPHBBSL-MRXNPFEDSA-N 468.327 0.915 50 20 JCGD C=C1C[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)N(C(=O)OC(C)(C)C)C1 1846449033 GXOIASYXNHXLGQ-IBGZPJMESA-N 469.347 0.749 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cccc(B(O)O)c3)CC2=O)c1 1847213623 KUSIWYHCFXSIQX-HSQYWUDLSA-N 477.326 0.244 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1848099489 OBNWHOXYZLAXKW-OTRWWLKZSA-N 494.980 0.929 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1Cl 16785603 SCOQKOAUXXVFIH-LBPRGKRZSA-N 451.954 0.566 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)N[C@@H](C)c1nc(C)no1)N(S(C)(=O)=O)CC2 726277620 CTRDOFREGOOPPY-NHYWBVRUSA-N 496.546 0.736 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)NNC(=O)[C@H]1COc2ccccc2O1 728323904 MNHFMMNZNZYOSQ-MRXNPFEDSA-N 479.467 0.208 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2C[C@@H](O)CN2C(=O)Cc2ccccc2F)n1 728727541 IKSGKZRDXXWBEY-ZBFHGGJFSA-N 478.502 0.028 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN(C)C(=O)c2ccc(Br)o2)n1 728731728 DULQXGRPFGCSGW-UHFFFAOYSA-N 473.305 0.812 50 20 JCGD C[C@@H](NC(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C)C(=O)N1CCS(=O)(=O)CC1 729249034 QBVZHPOEOKOUBK-OAHLLOKOSA-N 473.555 0.419 50 20 JCGD CC(C)(C)OC(=O)[C@H]1CC(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)=NN1c1ccccc1 729341806 TTWKBKYSNIPYQL-XJKSGUPXSA-N 465.532 0.481 50 20 JCGD NS(=O)(=O)c1cnn(CCC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)c1 749942250 UOUXYZKEPADNSC-NRFANRHFSA-N 482.566 0.695 50 20 JCGD CON(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1 763346740 RYZXPDBJIMJRFG-UHFFFAOYSA-N 456.502 0.180 50 20 JCGD Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)CN3CCCC3=O)c12 789857231 BGKRAGGRFXPNIU-CQSZACIVSA-N 474.543 0.360 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)cc1C 916561726 AQZGPXJUHURNDG-UHFFFAOYSA-N 478.502 0.863 50 20 JCGD CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 919883959 FJXBGVYGHNQVAE-HNNXBMFYSA-N 466.541 0.643 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c1 920024348 JSAYSXQNAJAPNF-UZRURVBFSA-N 484.534 0.654 50 20 JCGD COC(=O)C12CCC(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)(CC1)CC2 1779032398 QFYLMHOOEAFYSQ-DDJHWDJXSA-N 499.568 0.642 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779294719 LHKUKLSQUGCACV-YWZLYKJASA-N 459.616 0.553 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc(O)[nH]3)C2)C1 1779640306 WPCPMBRCCRFESJ-HXPMCKFVSA-N 457.915 0.691 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccn1 1782637758 SIKOKVHBHVLDJE-XVWGUNQUSA-N 451.332 0.693 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c([N+](=O)[O-])c1 1783935481 UYHIXFOHBDPLHO-JOCHJYFZSA-N 477.518 0.349 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783939333 CWFHJWNOBALHMX-HXOBKFHXSA-N 459.547 0.008 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783943384 HZBLBQHEZYNPJG-KRWDZBQOSA-N 450.344 0.873 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3ccc(C(=O)OC)cc3)C2)C1 1785721989 GEDBUXHHUQBOTN-DYESRHJHSA-N 454.907 0.936 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981898 FHTOCWSDYCLVCM-QSFXBCCZSA-N 472.734 0.936 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2ncccc2c1 1793618247 KAIKXOVTPHYZLI-FEJSZKPUSA-N 474.521 0.679 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794112395 TYCZQXGCIDGDTB-DCMJDACFSA-N 473.357 0.819 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3ccccc3c1)C2)c1cccc(B(O)O)c1 1795737502 OVGIIWRRYQHRGB-BRTYFSMRSA-N 458.323 0.966 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cnccc3c1)C2 1797750463 APBUOXHDHCAQKL-RMFSNUHRSA-N 460.494 0.750 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1[C@H]2c3ccccc3S[C@H]21 1797765307 VCRSRQZSOGSQSR-CSXWMVMESA-N 464.352 0.458 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cncc(C(F)(F)F)c1 1798250310 IQJJEYYTUHFFIM-JLVBRIDZSA-N 463.221 0.297 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC(=O)N1)C2 1798522078 AYNFMLPHHXWIIK-UESRRSCYSA-N 460.443 0.002 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1CCCC1)C2)NC(=O)NCc1ccccc1 1799099145 QGWCJJMORQMFBD-RUMRUAAYSA-N 486.617 0.408 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)c21 1799119110 BAOUIBIMTYVEOR-BTTYYORXSA-N 463.498 0.843 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCC(=O)NC1)C2)NC(=O)NCc1ccccc1 1799866179 YLICAILGGHXOQD-YSTOQKLRSA-N 470.574 0.497 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3cc(OC)ncn3)CC1)C2 1800970789 JVDSEWKKDSGCME-CLWJZODNSA-N 481.981 0.545 50 20 JCGD CCn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c2ccccc21 1801013333 PSOLXTOVWBLGNV-VPTLXERWSA-N 456.547 0.632 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2C)[C@@H]1c1cccnc1 1805317423 YFAURSOPWPKFFS-JTSKRJEESA-N 454.531 0.473 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1 1806042083 BKTZQDRTTMJRIV-HNNXBMFYSA-N 465.576 0.211 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CNC(=O)CNC(=N)N)[C@H]1c1cccnc1 1807059329 ZSBGHALKFSHTIF-MGPUTAFESA-N 483.485 0.718 50 20 JCGD CC(C)(NCCC#N)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807146280 XJLDZXVLARKXGA-PZJWPPBQSA-N 463.347 0.363 50 20 JCGD O=C1CCc2ccc(C(=O)N3CC[C@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)nc2N1 1807364344 UFUVHPIVGXKFBY-AUSIDOKSSA-N 499.336 0.675 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1808291320 HCGMWNMJURWIOT-NGOJXBLDSA-N 456.330 0.922 50 20 JCGD CN(CC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)C(=O)c1ccccc1 1809968170 SKWYLAXNDNFHLA-UHFFFAOYSA-N 477.370 0.983 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1 1810149606 ZTFAQABAFWZNQE-XMLBAGAUSA-N 492.544 0.555 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810294362 JQYVLIRRBUEBPO-UIFIKXQLSA-N 465.558 0.884 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc(Cl)nn1 1810681869 WVWLIBKEHTZVRL-UZLBHIALSA-N 465.706 0.838 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ncon2)[C@H]1c1cccnc1 1811176309 OKDWYPQBLIBOCG-BDGUZBFISA-N 450.459 0.918 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1812366387 SSNCYKDCKLZGDR-SIXWZSSISA-N 484.513 0.961 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813091094 LDFSXQOSEWNMLO-IHPCNDPISA-N 457.361 0.195 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2[nH]nc3ncccc23)[nH]n1)c1ccc(B(O)O)cc1 1817471470 OPKUYZKPACSYIZ-QGZVFWFLSA-N 459.275 0.981 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cccnn3n2)[nH]n1)c1cccc(B(O)O)c1 1817476363 BZTADMUZQXBWRV-IBGZPJMESA-N 459.275 0.752 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1823576000 WQSQWACFLODFNG-BKAYVGFPSA-N 494.338 0.819 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)NC(=O)OC(C)(C)C)CC2 1826088888 RCJARVUMXCVLPY-DIFFPNOSSA-N 484.579 0.271 50 20 JCGD N=C(N)SCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1826880354 ZKGMAZLFLRCTMJ-KRWDZBQOSA-N 461.592 0.935 50 20 JCGD O=C(c1cc(O)n[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551470 PNYAOAMMJCLIEA-VGOFRKELSA-N 491.932 0.781 50 20 JCGD CNC(=O)CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1 1828578792 ALWKDXDLXNQLMV-MBSDFSHPSA-N 494.976 0.828 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1830358678 QMYOJQAGXWQFOH-RCDICMHDSA-N 482.965 0.714 50 20 JCGD O=C(CN(CCO)CCO)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1 1830381498 BOFXOEDEGKIGQC-WBVHZDCISA-N 452.365 0.583 50 20 JCGD O=C(c1cnc(-c2ccccn2)nc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724082 CUMCCPJCKSDBQG-LAUBAEHRSA-N 461.906 0.208 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c1 1830738296 NHRZTGZKGNFXHV-QRSYKNFZSA-N 456.898 0.904 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1831864989 JLAGGQGPXPZKFZ-WMZHIEFXSA-N 460.336 0.216 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2 1832148664 CAUNFYHXLPNQGT-DFBGVHRSSA-N 461.275 0.787 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1 1832590952 QRTUWHYRMIQWRW-UTKZUKDTSA-N 472.007 0.816 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1832887271 FTZKSFKLPMYZGW-HSZRJFAPSA-N 487.582 0.758 50 20 JCGD O=C(c1cccc(OCC(F)(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833425492 SQFRSWQYAFRPLS-KDOFPFPSSA-N 481.855 0.692 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1 1834423864 MREWOWTZRVYQTJ-SFHVURJKSA-N 490.395 0.838 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCc1ccc3c(c1)OCO3)CCO2 1835182515 YTKKLGKHQSBHAQ-XMMPIXPASA-N 490.557 0.177 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnc4ncccn34)CC2)CC1 1835385938 BYFQRLPTANJPEE-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4ccc(Cl)cc4[nH]3)C2)C1 1835933570 BZXVRWVMNWKEDB-XMMPIXPASA-N 497.744 0.885 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1 1835939430 QHOBUOSUBPYDMB-VWLOTQADSA-N 482.342 0.376 50 20 JCGD COc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1C 1837460504 GYPOMNMTPWCAPS-XMMPIXPASA-N 483.525 0.386 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1837582326 SNBCUYYPLMKVTP-INIZCTEOSA-N 467.954 0.493 50 20 JCGD CCc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1837722004 KDNWLDLIUMJOBN-NRFANRHFSA-N 474.543 0.088 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)CN3CCCC3=O)CC2)CC1 1837807852 VRQRFGFQTLNPRD-YZSQISJMSA-N 486.573 0.741 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)C3CCC(O)CC3)CC2)CC1 1837922033 CPUUOXSXHGUPOY-UHFFFAOYSA-N 458.364 0.530 50 20 JCGD O=C(c1ncccc1Br)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838073678 JLKGFBZODMIHFT-GUYCJALGSA-N 462.728 0.514 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cc(=O)nc3sccn13)CCO2 1838414513 WZLICWJOJRUFIO-SFHVURJKSA-N 485.360 0.611 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc[nH]n3)C2)C1 1838528218 LVXTVAQUBDFQGU-FQEVSTJZSA-N 474.430 0.022 50 20 JCGD COc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1OC 1838841031 FQRRXLJNGWAGGC-YJBOKZPZSA-N 476.299 0.859 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1 1838903499 XONKIILLBHWXDO-DEOSSOPVSA-N 467.526 0.686 50 20 JCGD O=C1Cc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc2N1 1839200421 HSCHHDLIFWJRPF-VQIMIIECSA-N 470.295 0.942 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c3c(nn1C)CCC3)CCO2 1839582534 DYHDGDMDGOPNAH-NHVVDLMHSA-N 497.556 0.113 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1839718683 IJGYTIIGBBVGHD-LIRRHRJNSA-N 456.883 0.230 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(C(=O)OC)s3)C2)C1 1840154215 PHMMHBJZJTZMAM-QRWLVFNGSA-N 474.963 0.787 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185233 NVIZMSNOILUZTQ-XMMPIXPASA-N 499.572 0.019 50 20 JCGD Cc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1 1840672331 MUIZXSZDFILFFJ-VWLOTQADSA-N 481.553 0.994 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C#N)(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CC1 1845137367 NQTHWVIXUPRQTD-UHFFFAOYSA-N 496.373 0.724 50 20 JCGD COc1ccc(CCC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c(OC)c1 1845928596 LWCXASBCDYTTCW-UHFFFAOYSA-N 452.316 0.833 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(Br)nc1F 1848285156 KKCMSVKNGMRAKC-GJZGRUSLSA-N 462.084 0.792 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1)C1=COCCO1 21971309 XJBBGIPZADZIIX-UHFFFAOYSA-N 486.550 0.842 50 20 JCGD COc1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1OC 22695332 JNYHHUWYYKNDIC-UHFFFAOYSA-N 463.512 0.728 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Cl)cc1 726276570 WLYFJZAFPUKOMF-KRWDZBQOSA-N 494.957 0.968 50 20 JCGD CCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728336428 YXDDLZJWFXCMFI-KRWDZBQOSA-N 463.468 0.592 50 20 JCGD C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNC(=O)C(=O)N3CCCC3)cc2)C1 748462039 SJDJKWMALBPHEK-OAHLLOKOSA-N 451.549 0.560 50 20 JCGD O=C(COC(=O)c1ccc(=O)n(Cc2ccccc2)n1)NNC(=O)[C@H]1COc2ccccc2O1 847184487 CRWDZZVYZPYVEJ-LJQANCHMSA-N 464.434 0.436 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1)c1csc(N2CCOCC2)n1 915063782 MAIIDIDEHJPMFL-HNNXBMFYSA-N 479.584 0.842 50 20 JCGD CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)S(=O)(=O)c1cccnc1 915261391 MUNJAKLPBRSWJD-UHFFFAOYSA-N 495.583 0.338 50 20 JCGD COc1ccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc1 916391583 FEKKMMUZAYIGKP-UHFFFAOYSA-N 455.471 0.177 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc1C 916391868 KKVCBPBEOCACHP-UHFFFAOYSA-N 466.498 0.345 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@H]1CCN2CCC[C@@H]2C1 916572535 AVJXUCJNYXXVQH-DLBZAZTESA-N 451.549 0.278 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1 916648976 GHQYGEQDJJDISO-UHFFFAOYSA-N 466.516 0.773 50 20 JCGD CCC(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 917528288 ARHUXLGUUGEWFU-INIZCTEOSA-N 452.533 0.117 50 20 JCGD C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 919883957 FJGVJWMUZVIMKR-UXLLHSPISA-N 466.560 0.986 50 20 JCGD Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1 1115992489 ZPPHATWTKISHMV-UHFFFAOYSA-N 452.500 0.756 50 20 JCGD CCc1ccnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1777778354 MUVDDRVEWDRWLA-ZJSXRUAMSA-N 451.332 0.765 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3OCCO4)C2)C1 1777836699 BZUOCHNUZPPRPT-HSZRJFAPSA-N 467.482 0.214 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1 1778412147 RUDDTBJADTZOMN-MNVTYAKESA-N 464.486 0.535 50 20 JCGD Cc1cc(C)n2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)c2n1 1778555852 HVRKGNQDLOCSSI-PXDATVDWSA-N 491.357 0.467 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1 1779028376 KFJWNXHEBUDENZ-NRFANRHFSA-N 458.906 0.420 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)cn3)C2)C1 1779422639 ZJNXIAQKBHSLMB-HXUWFJFHSA-N 474.120 0.281 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(Br)CC3)C2)C1 1781344324 ZWTFLDPEKSVWGJ-ZFJBLLOBSA-N 466.336 0.878 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1781514671 HKXMGQRMTLAJDK-WTBBCNCBSA-N 477.518 0.374 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1781985400 NYQVFRNLDBPPIZ-JOCHJYFZSA-N 486.460 0.798 50 20 JCGD C[C@H](Cc1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782593211 GMUNXEBFRKVVSP-NYQDVAGCSA-N 454.332 0.966 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(CO)c(F)c2)C1 1783074553 JSEFTEBSSYQSMF-HYBUGGRVSA-N 485.516 0.758 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1 1783495100 QVPSXYBDAZNZPZ-YWWLGCSWSA-N 490.520 0.039 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COCCOCCOCc3ccccc3)C[C@@H]21)[C@@H](O)CCl 1784093679 DJNYXNRYELGOFO-CMOCDZPBSA-N 499.004 0.816 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1785608919 FKRAXXLCLWSFEI-LAPQFRIASA-N 460.959 0.602 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C[C@@H]21)c1cccc(B(O)O)c1 1786984180 OJCPZGOUFKSAQT-QRTARXTBSA-N 465.237 0.620 50 20 JCGD Cc1ccccc1OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984311 BUSFHWBAUOQNGG-VCOUNFBDSA-N 452.316 0.347 50 20 JCGD Cc1nn[nH]c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1787183766 WRQHEIZPPHDMMI-AJNGGQMLSA-N 470.958 0.839 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788145115 ODVUUBGXXKZIJU-UHFFFAOYSA-N 463.259 0.919 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccc(F)c34)C[C@@H]21 1788609749 FYVBUNZEQQRNJV-IXDGSTSKSA-N 481.488 0.379 50 20 JCGD Cc1ccc(O)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610168 NKHOJRYUCLIEIQ-DCPHZVHLSA-N 453.499 0.606 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(C)(=O)=O)C[C@@H]21 1789222310 RAFDUMQHBQOCOE-OWQGQXMQSA-N 483.499 0.158 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1791071092 ITMKRCVUXVAPRI-GAMODTGLSA-N 471.982 0.965 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2 1792874430 PGOTUSPVPPITDK-LFYQSXPISA-N 492.411 0.883 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc(O)nc(O)c2C1 1794111370 MQHJVEIVANLTAW-NAYUARGSSA-N 469.336 0.366 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)C1 1795117263 WDXPZDRJRNIVBR-FKEXNYPISA-N 490.395 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC[C@@H]1CNc2ccccc2C1 1795649271 TVBIHSQOJPUUES-DOCQIZIDSA-N 492.580 0.953 50 20 JCGD CC(C)COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)ccn1 1796460364 RLVLKZMKPDWSDX-HATOLVCRSA-N 467.331 0.313 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)ccc21 1796982810 FJDJGEYKKIPLRX-VZAMPYOESA-N 469.311 0.771 50 20 JCGD Cn1cnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1C(F)(F)F 1797074977 JVUPGNMZVIWKOQ-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD Cc1cc2nnc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)c(C)n2n1 1797440504 WWMVNWICDXHRKD-QDMKHBRRSA-N 463.502 0.305 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(-c3ccccc3)n1)C2 1797752992 PZQHLUOSDVWCGL-VPTLXERWSA-N 475.509 0.388 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2Sc3ccccc3[C@@H]21 1797769995 HPAKUMKUDBKWJS-AVTOCCDISA-N 458.584 0.837 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)n1 1797909701 CXFVPVKRHSIOHA-HGKCTWBKSA-N 450.612 0.728 50 20 JCGD 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Cc1noc(N)c1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819795836 URIHTERDXGINSV-VIFPVBQESA-N 456.488 0.560 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)[nH]n1 1822414670 XSVKLPIXCWDAHF-FUHWJXTLSA-N 456.551 0.740 50 20 JCGD CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCN2C(=O)OCc1ccccc1 1829000393 HKEOIYWPAMVZPY-XMMPIXPASA-N 465.315 0.452 50 20 JCGD O=C(Cn1cnnn1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1 1829013769 BJCMMAOURNQFLO-YLJYHZDGSA-N 479.900 0.660 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1829101778 ARAQQGFIWRZDNZ-MRXNPFEDSA-N 461.599 0.897 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)C(C)(C)C)CCO2 1830620947 UGPQSYOLKZQYTF-PONJGIIJSA-N 492.013 0.982 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(=O)c1ccc(Cl)cc1)CCO2 1830690000 SSIGUYYNATVGKL-QFIPXVFZSA-N 480.949 0.352 50 20 JCGD Cn1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1C(F)(F)F 1833324302 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490.586 0.322 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1cc(F)ccc1[N+](=O)[O-])C2 1844265583 QYCFZFAVJMPXEA-UHFFFAOYSA-N 456.434 0.792 50 20 JCGD COCCn1nccc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038771 RNUYKTOPMOQMIH-UHFFFAOYSA-N 483.573 0.693 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(Br)c[nH]3)c2)CC1 24122445 CQYKTKNCFLOGSB-UHFFFAOYSA-N 498.359 0.705 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2)CCN1 726862068 BEKZTWWBTUFXPD-UHFFFAOYSA-N 493.567 0.005 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C 728381926 QWWVDZJQAIBDIX-BMFZPTHFSA-N 487.600 0.748 50 20 JCGD C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1=O 728845636 NPTGAMPDNBHYGM-QFIPXVFZSA-N 451.487 0.308 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)O[C@H](C)C(=O)N2CCNC2=O)cc1 729621639 CGDVRJVXQWJUCG-DSQDWWTGSA-N 480.481 0.825 50 20 JCGD Cn1nc(SCC(=O)NN=C2CCc3cc(Br)ccc3C2)c(=O)n(C)c1=O 730433173 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NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2 1779029883 ZROAGIDTZJJYBC-GBXCKJPGSA-N 478.509 0.322 50 20 JCGD C[C@@H]1CCc2c(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)n[nH]c21 1779030297 NVEPDPZQROURTN-DMZKTXOQSA-N 453.503 0.215 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780937102 DSFPMBSXOMETAP-RBUKOAKNSA-N 475.398 0.958 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)CCO2)NC(=O)NCc1ccccc1 1780968894 IRHQEMZFBGSYDV-RLIDHQHUSA-N 471.558 0.055 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1 1782217107 ARGBGEXILUOSOC-JOCHJYFZSA-N 468.706 0.653 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784084304 PQVSDBDNYAYWJN-KSWRQPAISA-N 475.970 0.202 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1784102250 ITZXPKFJMXRDEY-OWSLCNJRSA-N 483.610 0.500 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)C(F)(F)Cl)C2)C1)NC(=O)NCc1ccccc1 1784175544 UGKUBDIIWKLAPC-IBGZPJMESA-N 473.908 0.994 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1 1784252574 IQOSYMUIGHRDRD-DENIHFKCSA-N 458.707 0.197 50 20 JCGD COc1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1784265980 WJPPHVCSXFCMBR-ZJOUEHCJSA-N 460.575 0.981 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1 1784927132 QIEZTPJUYJZSTQ-OJLHXUGZSA-N 466.498 0.363 50 20 JCGD CCc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1Cl 1785705810 NMKRNZCYDAVYNY-ZVZYQTTQSA-N 474.754 0.223 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc[nH]3)[C@H]2C1)NC(=O)NCc1ccccc1 1785998564 DKLREALQXQZZKW-BJLQDIEVSA-N 469.546 0.349 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786404761 MUPTTYOLIDYDHL-AJNGGQMLSA-N 478.384 0.637 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(c4ccccc4)CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978698 LYCMQLFICUPBSY-TUSQITKMSA-N 491.397 0.876 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H]3c3ccc(F)cc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978713 MVKYSVNXMSOOLW-YPWFZXRJSA-N 466.318 0.903 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984935 BEKQKAOOVSDENK-BUKVSMQUSA-N 496.329 0.248 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](COC(C)=O)OC(C)=O)[C@H]2C1 1788640490 SAHAOSQGYGTQNT-WOYTXXSLSA-N 477.352 0.634 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1csc(C(F)(F)F)n1 1789020798 JITIIXVMVAQVAD-NOLJZWGESA-N 483.277 0.749 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)nc4cccnn34)[C@H]2C1 1789198135 JSJKOFPWNXNFSR-FCMVICDYSA-N 468.341 0.919 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789382817 FZAFMTZUMAHSAD-JLMWRMLUSA-N 468.363 0.613 50 20 JCGD COc1cccc(OC)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789471072 GGHXKLJKWPVHHH-MDKPJZGXSA-N 468.315 0.291 50 20 JCGD COc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1OC 1790157807 AUVKARCWEWKPIF-MPGHIAIKSA-N 480.537 0.809 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COCCO)C[C@@H]21)[C@H](Br)Cc1ccccc1 1790780512 ZWDAIYHZPKTVSL-OKYOBFRVSA-N 469.376 0.981 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)C[C@@H]21 1791287937 FCJLEAXFJRXRQB-ULQDDVLXSA-N 483.610 0.642 50 20 JCGD O=C(CCc1cnc2ccccc2c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1792821894 ATBKKBMFAQCQOU-GQEURGSBSA-N 473.338 0.751 50 20 JCGD COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c(F)c1 1794450951 JSVHYSRTPGLCAW-GHJDPZQESA-N 472.477 0.567 50 20 JCGD COc1cccc(Cl)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736863 LQMCFGQZNOSHEX-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD Cc1nn[nH]c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1796442755 BJSWVBGDSNEPKI-BCDXTJNWSA-N 454.535 0.711 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1797971921 VNHNZDNNDNFUKV-YHDCXSKOSA-N 496.402 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cccs1)C2 1798440835 YCACKZHPXUSUPT-BTTYYORXSA-N 456.528 0.428 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1798736991 QYWJASMMZHIWDD-YVWYUNDQSA-N 469.546 0.542 50 20 JCGD C[C@H](NC=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1799292876 LXPYVHNICKDFQO-JFMONLCZSA-N 452.349 0.717 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)C1CCN(c2ccc(F)cn2)CC1 1800290161 JHFHKGKNIIDKOS-BBIADKPPSA-N 496.348 0.020 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1800642511 MIWISTYFGCVODT-HLPPOEQASA-N 485.404 0.655 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)C2 1800759882 NHRGUITZKCZWNW-IATJYDTKSA-N 490.395 0.587 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O 1802187632 DUNGYHLUBGIQEJ-RCJHGTSTSA-N 486.997 0.673 50 20 JCGD CC(=O)NC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803594276 UACVSKYDJIKXFQ-LPHOPBHVSA-N 467.530 0.314 50 20 JCGD C[C@](O)(C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(F)(F)F 1803991299 YDTGTVPDRHQRQN-SYNHAJSKSA-N 465.237 0.394 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@H](CNC(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)(C1)C2 1807373355 CKHYYVNIDJKHTM-HAPLULISSA-N 477.326 0.424 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1 1807878511 PODZLMVJFJSXQF-RNQOJCNYSA-N 451.999 0.977 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1 1808110163 PYSPLWNNTZXOIV-FOIQADDNSA-N 485.508 0.985 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H]1Cc2ccccc2CN1 1808238676 JMTFGPAMWWGWAO-ZKMPZPQNSA-N 484.365 0.796 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810121485 LAOVDHPQIWIKGC-KHZGNEAMSA-N 457.361 0.240 50 20 JCGD O=C1Cc2cccc(C(=O)NC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)c2N1 1812208724 MCYHEEVBKXWKGI-CYFREDJKSA-N 484.321 0.889 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1 1813071625 VBFFRJYJWXQPOQ-KBXCAEBGSA-N 458.479 0.406 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=N/O[C@@H]2CCCCO2)[C@H]1c1cccnc1 1813074715 WAIYHNJDKIELPM-SEVCIJKJSA-N 474.562 0.989 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3cn[nH]c3cn1)CC2)c1cccc(B(O)O)c1 1815356341 CWDJRXZXHUSJJM-AWEZNQCLSA-N 462.300 0.634 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)[nH]n1)c1cccc(B(O)O)c1 1817473517 YGYJQRATZLPZRI-QGZVFWFLSA-N 464.247 0.197 50 20 JCGD Cc1c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)cn2[nH]cnc(=O)c12 1821224543 DHFJWGQJZKVRME-LBPRGKRZSA-N 486.558 0.386 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccccc3C(N)=O)sc2C1 1823447202 HPSTWVCAUCTJSA-NSHDSACASA-N 479.522 0.780 50 20 JCGD O=C(Cc1ccc(O)cn1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1827051666 OUBDRGXZIOMEFX-HNNXBMFYSA-N 452.301 0.392 50 20 JCGD CC[C@H](C)[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1831513351 VSMNOJIFAQBCMB-UYGSHGSRSA-N 493.513 0.997 50 20 JCGD COCCOCCOCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1831722632 DKAXRHKYEIKYAT-QHCPKHFHSA-N 490.406 0.669 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1OC 1832094774 MJWFNAPSZAINFH-HTAPYJJXSA-N 470.950 0.693 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CN(C)C(=O)C(=O)O)CC2)CC1 1833264226 AZQJPEGLLFSIHG-ZDUSSCGKSA-N 475.384 0.132 50 20 JCGD CN(C)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834015598 HJTPULMHVDTNKR-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C)cn1)CCO2 1834375009 FUODYNLUEOTFPY-OINMWHHXSA-N 468.514 0.594 50 20 JCGD N[C@@H](CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccnc1 1834797904 JTDSCPBARKIVPL-QHCPKHFHSA-N 479.390 0.037 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834824874 OGMPGFXQCABQNM-SUMWQHHRSA-N 451.314 0.789 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1835035406 UEBPTWBAQFOBSY-HSZRJFAPSA-N 462.547 0.067 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)Cc3cscn3)CC2)CC1 1835049856 JXRZAIHIFVPIAH-MSOLQXFVSA-N 458.028 0.838 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(F)c1 1835931194 IEAGEIGQNFGNLF-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(C)n1 1835933546 BKEGDICJQWUTGF-RUZDIDTESA-N 481.358 0.081 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1cccs1 1835933855 HPJAPMKJJGHSPF-KSFYIVLOSA-N 458.345 0.302 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1 1836414605 SZIHOUCYOHLLCJ-OAHLLOKOSA-N 456.378 0.683 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2c1 1836925242 LZPXCWPOIDMELY-XMMPIXPASA-N 487.557 0.620 50 20 JCGD O=C(CCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)N1CCCC1 1837065241 KQQZJPODLILTRA-UHFFFAOYSA-N 485.390 0.381 50 20 JCGD CC(C)c1csc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837456349 GVJSJXHAAKBOLN-JOCHJYFZSA-N 488.570 0.649 50 20 JCGD Cc1cnn(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1837919452 SZSOXBLDGKLEDT-UHFFFAOYSA-N 454.336 0.184 50 20 JCGD O=C(c1cncc(O)c1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921553 MJRAKPAOHJNZKH-UHFFFAOYSA-N 453.304 0.393 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n(C)n1 1838475447 LODYVYFWEJASBR-UHFFFAOYSA-N 462.595 0.968 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839200460 IFVNDHYXAKWTBJ-DAYGRLMNSA-N 459.316 0.098 50 20 JCGD O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201938 NZELCILMHQSKJJ-AUTRQRHGSA-N 450.074 0.824 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc2c[nH]nc12 1839511849 WFMNKAHKUATYEI-XMMPIXPASA-N 493.524 0.254 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)c2n1 1839626471 BVYBDENZNAEANZ-RUZDIDTESA-N 492.341 0.015 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2 1839634693 VWEGRTRULZHLFH-NQIIRXRSSA-N 479.375 0.994 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1840082007 UQWOYARJVZDYNA-JOCHJYFZSA-N 495.013 0.404 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccnc(OC)c3)C2)C1 1840150055 DYUKMIBOWJIYLG-LAUBAEHRSA-N 455.939 0.733 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(-c4ccccn4)nc3)C2)C1 1840150293 ISPQAWZXFZSNCZ-HTAPYJJXSA-N 475.933 0.862 50 20 JCGD CN1CCCn2nc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2C1 1840189912 SUHKWJJPFXXAPB-LJQANCHMSA-N 460.362 0.592 50 20 JCGD COc1cc(C)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840678628 AYCHYMRBWILXKH-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1cccnc1 1841470445 TTZGEKAZYHLUOG-FQEVSTJZSA-N 494.357 0.844 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844279918 GMINDLLQQMSTJF-SFHVURJKSA-N 480.573 0.827 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@]23C(=O)Nc2ccccc23)C1 1846153214 FLNLQRPSNPBSGD-OSPHWJPCSA-N 460.494 0.412 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC(=O)N(C2CCCC2)C1 1848040144 FWJCBXCXWDHCAS-JVPBZIDWSA-N 454.531 0.292 50 20 JCGD COc1ccc(Cn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cccc(B(O)O)c3)cn2)cc1 1848159605 AIDPFIUUEXJMBR-ZEQRLZLVSA-N 488.353 0.678 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)Cn2cc(C(F)(F)F)ccc2=O)cc1OC 104552346 ATHGMRNRPCBHCQ-UHFFFAOYSA-N 457.361 0.889 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNC(=O)c2cc(F)cc(F)c2)cc1 108930471 DGQXRDHQWUCJRJ-UHFFFAOYSA-N 454.455 0.471 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2C[C@H](O)CN2C(=O)Cc2ccccc2F)n1 728727539 IKSGKZRDXXWBEY-GOEBONIOSA-N 478.502 0.028 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cc2ccccn2)o1 729395838 IWMDLKNWGRTRDT-CQSZACIVSA-N 450.473 0.395 50 20 JCGD CN(C)c1ccnc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 749714929 ANZKISQAMOAWAG-UHFFFAOYSA-N 461.544 0.562 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O 751207086 ZGCVYLVDISEVNB-CYBMUJFWSA-N 492.535 0.263 50 20 JCGD CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)nn2)CC1 751294464 GDVIARVXXSTKNG-UHFFFAOYSA-N 482.505 0.901 50 20 JCGD Cn1cc(/C=C(/C#N)C(=O)Nc2cccc(S(=O)(=O)N3CCCCC3)c2)c(=O)n(C)c1=O 844152988 URIKCSNGEHEZMJ-PTNGSMBKSA-N 457.512 0.804 50 20 JCGD Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)c1C 906486290 IECXISQFXMSBMG-MRXNPFEDSA-N 474.539 0.652 50 20 JCGD COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccncc2)c1 912768830 LGXWDVLZJXTZKL-UHFFFAOYSA-N 457.306 0.844 50 20 JCGD CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2csc(N3CCOCC3)n2)c1 916123484 KCSSTUIQPUIIIM-UHFFFAOYSA-N 470.602 0.861 50 20 JCGD CN1CCN(c2cc(CNC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)ccn2)CC1 916390106 KZFIORLFOOXWAM-UHFFFAOYSA-N 480.617 0.876 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1c[nH]cc1C)c(=O)n2Cc1ccccc1 916739709 SJJWFMZQOKPISZ-UHFFFAOYSA-N 479.497 0.152 50 20 JCGD Cc1ccc(-c2cc(C(=O)NNC(=O)C3=NN([C@H]4CCS(=O)(=O)C4)C(=O)CC3)n[nH]2)cc1 917175508 BPZJRHYKPGVMLQ-AWEZNQCLSA-N 458.500 0.312 50 20 JCGD COc1cc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1OCCO 918228550 LHILKOQQZRRLKO-UHFFFAOYSA-N 480.543 0.526 50 20 JCGD CCS(=O)(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1 919645291 LSGMKPICAMGDQD-GFCCVEGCSA-N 461.924 0.715 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCC=CO3)C2)C1)NC(=O)NCc1ccccc1 1778992372 RNYQDAVMUQSKIZ-YKSBVNFPSA-N 471.558 0.855 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029717 XNNBUHMKQWBPPO-QMHKHESXSA-N 467.530 0.134 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2 1779030648 GCVWHDCGLHTHFJ-PGRDOPGGSA-N 472.933 0.482 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780095219 KQCJGTDLGZKZFW-FPTDNZKUSA-N 476.486 0.878 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780770472 OWDHOTNBQVGDFA-VPWBDBDCSA-N 457.362 0.872 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)Cc3n[nH]c4cc(Cl)ccc34)C2)C1 1780945548 POAWYQOMCUXAHV-QFIPXVFZSA-N 476.965 0.962 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)c1ccco1)CCO2)NC(=O)NCc1ccccc1 1780969497 MOGJUJLQTMQRQI-XUZZJYLKSA-N 485.541 0.489 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@]34C[C@@H](CO3)N(C(=O)OC(C)(C)C)C4)C2)C1 1781063446 UKNWORIKLBCXSR-FRMGNDQPSA-N 487.981 0.849 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ncccc13)C2 1782211954 IZUBUDJTURSPOE-XMSQKQJNSA-N 457.535 0.230 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1783020102 RJDWXICHIFDLOH-YLJYHZDGSA-N 458.964 0.452 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1)CCO2 1783882246 WWGMKJPEXUXRAO-ONGXBYRLSA-N 475.970 0.754 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21 1784513500 GKMKILMGVULVEC-MRLBHPIUSA-N 453.399 0.678 50 20 JCGD COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1OC 1784846550 NVXARWJADXQAIP-IPJJNNNSSA-N 490.601 0.989 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1785102901 HXRZKSRVAAVLKV-HSZRJFAPSA-N 451.288 0.082 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1785321146 PGQBGIXWRRZZLV-KSMMKXTCSA-N 466.000 0.672 50 20 JCGD CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1788090772 ACSXORXLTGGXRY-KFGODFMUSA-N 489.997 0.592 50 20 JCGD Cc1nc(F)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789061915 YXHSGSKJLPDHHS-KKXDTOCCSA-N 456.478 0.435 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1NC(C)=O 1789277355 TYHWZAAHTJYWPC-LEDOBFOHSA-N 495.341 0.241 50 20 JCGD O=C(Cc1c[nH]c2ccccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789747501 KJKHPQXJMUIJHO-HYVJGQCMSA-N 461.327 0.684 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21)[C@H](F)Br 1789922449 GTKVQVGQRFRDHU-COPCRZHJSA-N 479.328 0.122 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc2ccsc2[nH]1 1790372988 KAAHWDXRQNLPOZ-IEZWGBDMSA-N 453.329 0.816 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnn(C)c3)[C@H]2C1)NC(=O)NCc1ccccc1 1791673583 QBGXAQAHNGQNHR-FKBYEOEOSA-N 497.600 0.289 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1 1796191871 IMNFWQZWMNGXCF-GGPHIMKMSA-N 466.303 0.906 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798440457 SQZNYWSXEYXVGW-KRXQYRFLSA-N 490.561 0.477 50 20 JCGD Cc1c[nH]cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097162 FWNLLYWXASOFHK-HATOLVCRSA-N 468.558 0.873 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2 1799363865 KSCLZCNHGBHHOA-RCJHGTSTSA-N 473.643 0.703 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CC(=O)OC)NC(=O)OC(C)(C)C 1800802030 ZRRAEWWGFRWTRD-PFFSRIRZSA-N 491.969 0.286 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)no1)C2 1801011909 SFCCPFATXCZNJT-FAQVEIGNSA-N 455.515 0.918 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1801157401 JSRBHAWCIWDKNG-YMSVYLFOSA-N 459.927 0.102 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1(O)CCC1 1802462219 MDVIEZVXMUYEMO-BSIFCXSSSA-N 451.332 0.632 50 20 JCGD CCCNC(=O)CCC(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1 1805878127 AUOADDXCGSMKMH-UHFFFAOYSA-N 458.563 0.836 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807360904 MBVOGXBQDMZVPR-XTQVGHSUSA-N 473.342 0.977 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)n1ccccc1=O 1807362157 URUGQGOODIPWAC-MONBJTKQSA-N 474.326 0.504 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362810 NOWKHFOSDZWAEQ-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C(=O)NCC(C)C)[C@H]1c1cccnc1 1808417531 LBMULNVPRUBHCM-KDNBOHCBSA-N 481.557 0.994 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1808590348 CTSRZXFVTYDABJ-AVRDEDQJSA-N 488.309 0.576 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cn1 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C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1830540442 QANFYUXKPCVNBK-RDTXWAMCSA-N 462.341 0.316 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2NC1=O 1830732879 WYCKQCLNWLOGQZ-UYTHQXMGSA-N 467.906 0.076 50 20 JCGD COc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834498513 JSNGASOSJDWOHG-UHFFFAOYSA-N 479.386 0.803 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc2nccn12 1834798829 CQVVQJJNOQAQEG-UHFFFAOYSA-N 490.373 0.217 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1835930209 BZDAYSWAPLDQSZ-FQEVSTJZSA-N 481.236 0.097 50 20 JCGD O=C(c1ccc(OCC2CC2)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940814 BFXAXJSYMJGFKJ-AREMUKBSSA-N 494.353 0.539 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836776825 PXAPDWLQXYPKGC-QVKFZJNVSA-N 467.954 0.494 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(C)n1C 1837460264 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C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(N4CCOCC4)n3)C2)C1 1840033069 RTSCMWQGEYRRGJ-IIBYNOLFSA-N 497.390 0.772 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1F 1840182450 DBTYGBYTKIGQPB-QFIPXVFZSA-N 466.510 0.277 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1 1840184301 ZBKAJZZASDVAOO-GOSISDBHSA-N 464.485 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1840184792 BVYAPPJKCRMZIM-MSOLQXFVSA-N 453.367 0.052 50 20 JCGD COc1ccc(COCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1840252998 MDAYUYXNPOLBDW-RXVVDRJESA-N 456.923 0.268 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840913770 NTNNWJXWFGGTGX-ACTFIFLWSA-N 489.997 0.736 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H](N)c2ccccn2)C1)NC(=O)NCc1ccccc1 1842931118 STERQRUSHCWGHU-NRFANRHFSA-N 465.558 0.631 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)[C@H]2C1 1843012483 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CCCC(=O)N[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1779251576 MYPLHCFPMKNGBR-OHAJKSNRSA-N 460.535 0.255 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780937105 DSFPMBSXOMETAP-RTBURBONSA-N 475.398 0.958 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc2ccnn12 1781225226 ZLIWTCIWAMJVDL-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD COc1ccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1783778361 RBCZCGYTRUQNAM-HSQYWUDLSA-N 468.315 0.047 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783946706 GAPVXZXUZQGNHO-KZULUSFZSA-N 454.351 0.896 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN(C)C(C)=O)[C@H]2C1 1784934885 QLEUFGOHIDNOJH-LRQRDZAKSA-N 490.513 0.982 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccccc3OC(F)F)C2)C1 1785143874 FHPSDQZJNDPHLL-QFIPXVFZSA-N 460.242 0.725 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCOc3ccccc3)[C@H]2C1 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NWTNFEVZFAKRAM-VWFIUDSGSA-N 477.945 0.445 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1)c1cccc(B(O)O)c1 1801415228 JVMKGVMCEIZKPW-DMRZNYOFSA-N 476.264 0.775 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CN(C(=O)OC(C)(C)C)C1 1802061963 QFNWBLAALGGURZ-UPHUGPLXSA-N 481.594 0.206 50 20 JCGD CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1802549234 OLJQKGBMTLZTIB-VDGAXYAQSA-N 467.530 0.314 50 20 JCGD O=C(Cc1cnc2ccccn12)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1803099208 NHXBFTUKAZWZLN-NBGIEHNGSA-N 483.337 0.971 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1SC(=N)NC1=O 1803139632 RWGHLOHWLWIVHB-YADOHIMWSA-N 453.952 0.490 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(O)n2)[C@H]1c1cccnc1 1805674676 FZGRTIBDMKHZIH-MGPUTAFESA-N 461.482 0.814 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2cnc3ccccn23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359427 ITMNMAFRAWNLND-NBGIEHNGSA-N 483.337 0.971 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)/C=N/O[C@H]2CCCCO2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374027 GBEKVHNJFIVEKW-BOJAEMNUSA-N 480.330 0.610 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)[C@@H]2C=CCN2)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807454684 WITNETYWIOOSDM-AOHZBQACSA-N 491.596 0.962 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CNC(=O)Cn2cnnn2)[C@@H]1c1cccnc1 1807611492 SRYMCAUDTHVFKL-KKSFZXQISA-N 494.468 0.921 50 20 JCGD COCCn1nccc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808635408 IMPSTKMDEAPUHO-KNQAVFIVSA-N 477.330 0.238 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1)[C@H](O)CCl 1814874940 JLDUQSQKOXOCBZ-TZMCWYRMSA-N 452.855 0.772 50 20 JCGD CC(=O)c1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n[nH]1 1815337048 JKTCGBMUIMJGST-CYBMUJFWSA-N 453.289 0.288 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ccc(F)cn3n1)CC2)c1ccc(B(O)O)cc1 1815348727 XQIYCNPJOJWGIU-CQSZACIVSA-N 480.290 0.544 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1)c1cccc(B(O)O)c1 1816942331 RHQRSSCOVZXMSY-CQSZACIVSA-N 462.300 0.405 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(=O)N(C)C)n[nH]1)NC(=O)NCc1ccccc1 1817174100 VHEOWTXUVFBWMC-GOSISDBHSA-N 484.561 0.836 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)n1ccccc1=O 1817476071 DQKRCRCCYRFVFI-BEFAXECRSA-N 463.303 0.818 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccnnc2O)[nH]n1 1819403526 REKFUXTXEPPXOL-HNNXBMFYSA-N 451.447 0.524 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)n1ccnn1 1819404011 RYJNUDAQQGPONH-WBMJQRKESA-N 452.479 0.567 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797941 PGAPKPADIDKUKK-GHMZBOCLSA-N 457.516 0.058 50 20 JCGD CC(=O)N1CCN(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Br)sc3C2)CC1 1823007808 PNDBNXPDNSNNFZ-XHDPSFHLSA-N 476.372 0.910 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN)CCN2C(=O)OCc2ccccc2)C1 1828961290 NEOGPQBKETTYRT-UTKZUKDTSA-N 452.939 0.651 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)CCO2 1830418617 KXAOBQATBQFBEI-HWBMXIPRSA-N 482.317 0.379 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1 1830543479 SPVFDBVZTVYZIT-UGSOOPFHSA-N 457.325 0.586 50 20 JCGD O=C(NC1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1)OCc1ccccc1 1830730768 DPDQRYGHWUKXOR-GCJKJVERSA-N 495.960 0.502 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)NS(=O)(=O)CC)CCO2 1831317740 LDDXPDITHPDFGU-RVKKMQEKSA-N 453.989 0.178 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1832544992 XKGMZQBOLUFKFU-VLMPBXDWSA-N 487.981 0.512 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(=O)n3C)CCO2)C1 1833869511 KIUMNNWVJGMAKI-IFXJQAMLSA-N 456.337 0.486 50 20 JCGD C[C@H](Cn1cccn1)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1833889058 HZXNJYPXOMDYEE-GOSISDBHSA-N 461.611 0.464 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797799 HQKRYDUBBWFJID-LJQANCHMSA-N 493.417 0.557 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4nn[nH]c4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834799036 LMXLCUKTULOGCP-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD Cc1ncc(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1834801353 AJRSNFGDZDEOBJ-UHFFFAOYSA-N 470.404 0.559 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CC(F)(F)F)CC2)CC1 1835736721 FFCHQFMPYBIZBB-UHFFFAOYSA-N 456.469 0.823 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1836875228 FLSKIUWIEPXDMP-INIZCTEOSA-N 474.624 0.039 50 20 JCGD O=C1COc2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCBr)C4)C3)cc2N1 1836990769 GIVXCOSGEKTPHJ-HXUWFJFHSA-N 482.331 0.873 50 20 JCGD COc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nn1C 1837919269 VZYPUNXDBMVWNT-UHFFFAOYSA-N 470.335 0.035 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1cccc(Cl)c1 1839043406 WZSJJCVGXFVHDY-DBXWQHBBSA-N 488.368 0.573 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1839151925 IIGFAIBCQKFXID-FFZOFVMBSA-N 459.374 0.644 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3ccnn3c1)CCO2 1839570118 UJMOGGQVCXVABT-FXZATJRASA-N 493.524 0.538 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)N3CCCC3)C2)C1 1840030823 XKSTVUZFQPTFBE-HNAYVOBHSA-N 460.369 0.629 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccc3)C2)C1 1840156778 TUCYSLLBGGDDJZ-SGXKBVARSA-N 467.950 0.515 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CC#N)cc3)C2)C1 1840185141 KMHMKRRSAXPJJY-HSZRJFAPSA-N 457.531 0.196 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840187064 JKSJMAOYHNZJRQ-QHCPKHFHSA-N 475.546 0.088 50 20 JCGD Cc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(C)c1 1840672072 MDTJDFLBOHTYNT-RUZDIDTESA-N 466.343 0.675 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1Cc3ccccc3C1)CCO2 1840943619 MWEKKLSVUUWMKL-VWLOTQADSA-N 479.537 0.170 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2(NC(=O)OCc3ccccc3)CC2)C1 1843928074 XBIMJTHRDSTHFO-UHFFFAOYSA-N 492.536 0.961 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2ccc3nncn3c2)C1)NC(=O)NCc1ccccc1 1844088151 KGKANUAZTOIFNA-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1 15639532 BLYWGUUWPKCVRT-IIAWOOMASA-N 487.600 0.558 50 20 JCGD CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1 15639618 AWLZWKVDYQIBFN-OAHLLOKOSA-N 457.574 0.836 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)OC)c2)cc(OC)c1OC 21189832 LYCKQABQFVGFJY-UHFFFAOYSA-N 453.473 0.969 50 20 JCGD O=C(CCn1nnc2ccccc2c1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 21783737 GFJWSCYYEHDJPU-UHFFFAOYSA-N 470.511 0.427 50 20 JCGD COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1C 107612872 UMKAXGOZWHKQIN-UHFFFAOYSA-N 466.516 0.760 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)Cc1cnn(C)c1)N(S(C)(=O)=O)CC2 725881159 QTSDXFTVPOHHBW-INIZCTEOSA-N 465.532 0.076 50 20 JCGD CC(C)NS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1F 728323177 VSZBHXYVYGEXJN-QGZVFWFLSA-N 495.485 0.657 50 20 JCGD Cc1c(C)c(C)c(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(C)c1C 732307541 JMPYCNAWMZDLTE-MRXNPFEDSA-N 459.590 0.479 50 20 JCGD CCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 745735342 ZFNVUXKSDIUOHM-UHFFFAOYSA-N 481.552 0.576 50 20 JCGD O=C(NNC(=O)N1CCOCC1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1 745988184 ULVVFGOZJTWXCZ-LLVKDONJSA-N 481.394 0.984 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@@H]1CCN(CC(F)(F)F)C1 747310501 PHGFNCCMGXNEHQ-CQSZACIVSA-N 479.481 0.288 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C 748245986 BQHZSWHWAPNCNH-ZBFHGGJFSA-N 466.560 0.936 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl 789857500 VOIKBYFXGOSIQE-UHFFFAOYSA-N 479.342 0.398 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)noc2C)C1 825643581 FEFDZNMGNYEQJX-OAHLLOKOSA-N 465.532 0.960 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c1 913148743 AZCSAIBVNBUOSB-UHFFFAOYSA-N 493.567 0.328 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cc[n+]([O-])cc1)N(S(C)(=O)=O)CC2 913161259 GLBOJJYJIZKOGU-INIZCTEOSA-N 464.500 0.047 50 20 JCGD COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2=O)c(OC)c1 915077544 XIJZSDCPOCUKGF-AWEZNQCLSA-N 461.496 0.921 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)cc1 915357359 ARLUGTPGKPTYPD-UHFFFAOYSA-N 485.522 0.034 50 20 JCGD O=C(NC[C@@H]1CC1(Cl)Cl)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915909711 ZOVMETYLPHLVNV-LBPRGKRZSA-N 451.332 0.845 50 20 JCGD O=C(NCCS(=O)(=O)c1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 918229487 FLGDJJCLULHGKY-UHFFFAOYSA-N 480.568 0.889 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)N2CCOCC2)C1 1779415483 KENXTCIEBBZGIN-TWKWOARYSA-N 452.379 0.387 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCNC3=O)C2 1781900337 OBFATOIOCKHOCF-OWDMVUQNSA-N 482.379 0.928 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782213606 YXMJHCZFARQSFK-RGZWJVDOSA-N 488.589 0.087 50 20 JCGD Cc1cc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)no1 1782465105 KMOPXNYRLHRAFO-XMSQKQJNSA-N 456.503 0.352 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccc(F)cc3)C2)C1 1783598151 XRWZNRVZRFWDAB-HSZRJFAPSA-N 455.490 0.901 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1783616172 RJLCIBPMCNZFFP-LDNFRZNASA-N 490.395 0.970 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Cl)cc1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1783723031 MNAPATOHIBQHLU-APWZRJJASA-N 494.397 0.438 50 20 JCGD COc1ccccc1OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1783775705 IFFFELVWDSEIJC-JLMWRMLUSA-N 468.315 0.047 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)CCO2)C1 1783868603 IXLPOEURZLIXNN-XNGFIGEISA-N 467.950 0.250 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)CCO2 1783880446 INSJXNIYVAEWGF-BXTJHSDWSA-N 463.959 0.346 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1[N+](=O)[O-] 1783934258 BXNQHMPQNGKEPZ-QFIPXVFZSA-N 461.519 0.649 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)C1 1784093885 ITWWSROZSMWKFD-KSWRQPAISA-N 471.982 0.823 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C2)C1 1785154323 DXPITIQMEXONBO-XMMPIXPASA-N 475.509 0.833 50 20 JCGD COc1ccc(OC)c(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1786655873 YCWNAYHXRTZAIG-APTRMMRNSA-N 496.369 0.610 50 20 JCGD CCC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)n1cccc1 1786979802 IHNFPKHGOPWUFC-QESAQDPVSA-N 453.348 0.803 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1788639193 INXDVASLBFTTSS-YYFQZIEXSA-N 467.288 0.151 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1 1789221811 GYGPMNZQRGNFOY-MLZJRGSSSA-N 488.497 0.804 50 20 JCGD CO[C@H](C)[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)N(C)C(=O)OC(C)(C)C 1789786593 LCEGSHJDFIKLIS-YLALRLGGSA-N 492.013 0.836 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21 1789858828 REEVQSUWVWMCBZ-QYOZUGBQSA-N 452.939 0.990 50 20 JCGD CC(=O)N[C@@](C)(C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccccc1F 1789966269 HYCTXJFNCZUFBN-VJPUMCBESA-N 469.941 0.756 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NNC(=O)C3)C[C@@H]21 1790693831 COOVADSONLBMPL-NCRFIVEOSA-N 457.437 0.727 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792983006 XYBLXGIWZIIJJQ-QEOTZNIISA-N 461.987 0.973 50 20 JCGD COc1ccc([C@H]2C[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1793299988 WVPPVWYTJUYRAB-HLSZOSTASA-N 464.327 0.382 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(OC(F)F)cc1Cl 1794403270 QGSSAISQLYNBAI-DPIQGUFMSA-N 489.907 0.913 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3cccnc3)cc1)C2)c1cccc(B(O)O)c1 1795739987 ZLTHSEVTHRYMPB-ACHVPNTGSA-N 471.322 0.945 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1nc(C)no1 1795816678 VQTSAVZPGFOAPD-VTEUUUEMSA-N 473.442 0.657 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1796450572 KRJTUUWLTVTCBF-RKOFLFEYSA-N 474.986 0.575 50 20 JCGD Cc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748451 CHYDLWGOTIDWJV-VPTLXERWSA-N 452.515 0.225 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1797894200 FONXVWQMOVIOSZ-UHDSXZAQSA-N 484.985 0.636 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2[nH]cnc(=O)c2c1C 1798466371 BXOUNDGQXQJCSU-NEBZKDRISA-N 466.336 0.708 50 20 JCGD CN1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)CC1 1799095414 SEYDPAXLWNFXJE-IUTQVRIDSA-N 486.617 0.264 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H](O)c1cccc(Br)c1 1799098814 HYIYMYWIGQRCFV-IPQWEPCOSA-N 461.740 0.672 50 20 JCGD CN(C)CC[C@](Cc1ccccc1)(C(=O)O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1800292739 JURACIAAEJQIDT-YBZAYSDLSA-N 496.004 0.441 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC 1800983177 QGEOBNHFJCUTPI-JKJDWNRSSA-N 491.969 0.286 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1CCN(C(=O)OC(C)(C)C)C1 1801140247 UONWWVSEVTWJKC-QSNWEANLSA-N 495.621 0.596 50 20 JCGD Cc1[nH]nc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1805117738 DNAQURNUJZHNCI-JXFKEZNVSA-N 451.267 0.565 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361517 IOMYIDFZFULYPF-NZQKXSOJSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364368 FDPWVIUTURPJJC-XODARUQUSA-N 451.332 0.632 50 20 JCGD CCn1nc(C)cc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807370849 LNDZZGWWECVUOO-UGKGYDQZSA-N 461.331 0.920 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(Cl)nn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376197 UDOQDCHSZJKTHA-UZLBHIALSA-N 465.706 0.838 50 20 JCGD Cc1cnn(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1 1807664849 HYGKNHIQAPUVHA-DYESRHJHSA-N 462.514 0.605 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1808291627 OHJCZHHAGQCKNL-AZOIQLNYSA-N 456.330 0.876 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1 1808413451 AWBWAICMNCEVIK-XMCMKKQQSA-N 464.486 0.964 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810299591 SMZXTNLCIIXKSS-YONMQOAISA-N 466.498 0.519 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1 1810637842 DXULSNLAHLASIM-AUUYWEPGSA-N 458.479 0.406 50 20 JCGD CN1CCCn2nc(C(=O)N3CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3c3cccnc3)cc2C1 1813074810 SXFLVLFZUGYWPG-NTKDMRAZSA-N 496.616 0.806 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3)sc2C1)NC(=O)NCc1ccccc1 1814055678 AREGTOYATLQGRB-WBVHZDCISA-N 499.597 0.680 50 20 JCGD CC(=O)Nc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)o1 1815356693 LRSBFQUZJCKTHA-AWEZNQCLSA-N 468.300 0.914 50 20 JCGD C[C@@](O)(C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(F)(F)F 1817469848 FLMZBJHTNPNPKI-KBXCAEBGSA-N 454.214 0.709 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n1 1817471375 XDQCZVPJRHCSRS-LJQANCHMSA-N 450.308 0.909 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc2n(n1)CCCO2 1819087842 XBHKCFKIKSSWSW-SFHVURJKSA-N 464.291 0.688 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)[nH]n1 1822410216 BWCXNFYDSWUYKY-OAHLLOKOSA-N 459.507 0.090 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)n1cnnn1 1828925927 VWJQVFMCQJPYIE-KDOFPFPSSA-N 455.523 0.166 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1830544505 ZUEKOEHSLYMKPZ-AUUYWEPGSA-N 471.352 0.767 50 20 JCGD O=C(c1ncn(-c2cccc(F)c2)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833352041 KWSKIUIMTQHDNC-OXJNMPFZSA-N 467.885 0.076 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1 1833826773 WLRUADUKLFIWAF-UGSOOPFHSA-N 457.325 0.856 50 20 JCGD Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)ccc1F 1833960610 UDFGVSWOERMWNH-UHFFFAOYSA-N 468.338 0.708 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccn(C)n3)CCO2)C1 1834248193 POVIURDCPAVZKZ-JOCHJYFZSA-N 487.469 0.637 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cncs1)CCO2 1834464278 ZUZVOLRRDOBWFQ-RXULLKCLSA-N 460.516 0.347 50 20 JCGD CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n(C)n1 1834798437 VRVXOOUTNXNTCT-UHFFFAOYSA-N 467.379 0.161 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834821743 WNYIAYBIJSGCKP-QFBILLFUSA-N 455.353 0.193 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CNc1ccc(F)cc1)CCO2 1835585598 WWZFSXRIFKRTKT-QFIPXVFZSA-N 465.526 0.067 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3nccc4nc[nH]c34)CC2)CC1 1835736705 DIRPSLKNXFYFER-UHFFFAOYSA-N 491.556 0.455 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H]4Sc5ccccc5[C@H]43)C2)C1 1835930716 VWBLVXZGIPPJGT-VRIJDZSUSA-N 494.378 0.324 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1 1837712051 CLNCBIMZPFKVMC-IBGZPJMESA-N 456.547 0.704 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1OC 1838931957 UGRQWCBYYMTKBZ-XMMPIXPASA-N 499.524 0.086 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199322 NFFDWFUZVPVNSQ-XEZPLFJOSA-N 465.345 0.160 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1839928540 HOAVDNRFWARPIC-UQBPGWFLSA-N 466.343 0.630 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3NC(C)=O)CCO2)C1 1840724682 FIMHMTXVVNJXTL-LAUBAEHRSA-N 453.923 0.969 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1841762006 UJFQAVUENPPJMT-UHFFFAOYSA-N 460.535 0.805 50 20 JCGD O=C(c1cc(=O)c(OCc2ccccc2)c[nH]1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013454 KJQCDXZEZJOPID-UHFFFAOYSA-N 487.321 0.765 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2cccnc2)c1 46900263 IGUGFROVMFDWTN-UHFFFAOYSA-N 483.572 0.194 50 20 JCGD O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1 725906168 WUYCJYKQVIAGGH-DHSIGJKJSA-N 481.914 0.451 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCS(=O)(=O)C3CCCC3)cc2)CC1 728215613 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CS(C)(=O)=O)C2 1778091889 WWPFPHNQKHOIIK-VMTKKPBESA-N 495.602 0.315 50 20 JCGD Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(-n2nccn2)c1 1780243065 ZYJDEPWYQNKAIF-XMMPIXPASA-N 490.524 0.332 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780919610 CJMAJGDELKHMMK-VWLOTQADSA-N 492.341 0.346 50 20 JCGD COCC1(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)CC1 1780969730 NYJTUEPOEXBJLE-DEOSSOPVSA-N 473.574 0.589 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1781230575 VULGKAFERHAQHJ-RBUKOAKNSA-N 458.346 0.696 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c2ccccc21 1781329620 IBRMTSATLBJWCH-VQIMIIECSA-N 469.311 0.860 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783023485 WSACRMQLDLFZJB-IPJJNNNSSA-N 496.402 0.974 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935733 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O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793700097 WWKWQPJRKDMVHN-OPMZPASUSA-N 467.287 0.111 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1 1795741049 XTCRGXPJNVDRLS-VPTLXERWSA-N 485.733 0.495 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2 1796439443 DYECKOBFCAOVDW-XIFNJIBBSA-N 468.352 0.741 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1cc(C)on1 1798509233 LEZMDRFOVYDIDZ-MVRRYPJTSA-N 469.502 0.485 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)[C@@H](O)C1 1799198039 RGPNBEOVYNLUAP-NDKCEZKHSA-N 466.362 0.608 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2C)[C@@H]1c1cccnc1 1805317425 YFAURSOPWPKFFS-VGSWGCGISA-N 454.531 0.473 50 20 JCGD N[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccccn1 1807161958 DFVNPLTUDFNFDH-YUXAGFNASA-N 459.315 0.176 50 20 JCGD 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C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1 1830546263 RCFAITMOKHQFRK-JLTOFOAXSA-N 468.348 0.887 50 20 JCGD CCOc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cnc2c1cnn2C 1830723804 QHFZOBVSTPXAFY-KKSFZXQISA-N 481.937 0.037 50 20 JCGD COc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(OC)c1OC 1830724791 CJCRICIZBSADDG-ZHRRBRCNSA-N 486.949 0.311 50 20 JCGD Cn1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)cn1 1832549716 ZSMBGXMGHHVWAK-HRAATJIYSA-N 485.969 0.622 50 20 JCGD O=C(NCCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)c1ccccc1 1833313875 ZBRXGONSALCKBN-HXUWFJFHSA-N 464.994 0.978 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n1 1833338599 USXCISGWYPJZLT-MAUKXSAKSA-N 473.299 0.801 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3C(=O)OC(C)C)CCO2)C1 1833394141 OOZPIEWHLDERCX-HTAPYJJXSA-N 483.949 0.971 50 20 JCGD CC(=O)N[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(C)(C)C 1833402033 DDTLPSAYLDPAES-JOCHJYFZSA-N 486.422 0.102 50 20 JCGD CCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834276145 XBNAOCJJIOGJGU-UHFFFAOYSA-N 453.352 0.082 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1834973311 PSOBNYHGHPYNFC-CQSZACIVSA-N 495.382 0.171 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnc4ncccn34)CC2)CC1 1835388450 XBSKRIHCUFCUJA-UHFFFAOYSA-N 470.578 0.288 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1 1835641959 JZKHLFMJDUWIDG-CXAGYDPISA-N 477.400 0.654 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)N1C[C@@H]2C[C@H]2C1 1835737965 OTBZLPHNRZGSJJ-SQNIBIBYSA-N 483.617 0.211 50 20 JCGD CCOC(CC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)OCC 1835738246 OWOKBKIGUGKTSH-UHFFFAOYSA-N 490.605 0.660 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CN)c1ccccc1)CCO2 1835811708 MMRSDVBNQQQIGE-AHSBOQOBSA-N 496.568 0.319 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](NC(C)C)C(C)C)CCO2 1835898403 SQRWXTYYLQUNQJ-JZPOVRCKSA-N 490.605 0.599 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C)c1 1835932127 PBZRFLADPARTHA-VWLOTQADSA-N 482.342 0.376 50 20 JCGD Cc1ccc(OCCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835933787 DICPOLDRCRYKPI-VWLOTQADSA-N 482.342 0.214 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cccnc3[nH]1)CCO2 1837005995 RQPCMZAWTOLDKW-BATDETSNSA-N 493.524 0.767 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cccnc3[nH]1)CCO2 1837005996 RQPCMZAWTOLDKW-SWOYFSSUSA-N 493.524 0.767 50 20 JCGD Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)on1 1837093327 HHNMWBMVKWBYHD-UHFFFAOYSA-N 455.320 0.518 50 20 JCGD Cc1ccsc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457095 VRFAZDUXEMDADL-OAQYLSRUSA-N 459.528 0.439 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)/C=C\C(=O)NC3CC3)CC2)CC1 1838101516 UBKWMCNLYIVVSB-YCKZGXLISA-N 498.584 0.954 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cnc4ncccn34)CC2)CC1 1838242026 DQRFBHKLXVJKDK-UHFFFAOYSA-N 471.562 0.715 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(-c4ccncn4)noc3C)CCO2)C1 1838492000 BHEJUOODJBNEOE-BTYIYWSLSA-N 479.921 0.764 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCO3)C2)C1 1838528184 KEJIQAMBNNDGOM-SIKLNZKXSA-N 477.470 0.769 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(O)[nH]3)C2)C1 1838528378 UJNYQLSZCLPBQC-NRFANRHFSA-N 489.441 0.333 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1 1839477158 ZQKCPGOKYPZOMV-UZLBHIALSA-N 492.953 0.553 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnn3c1OCCC3)CCO2 1839518418 WJZQUJGAEPUTHM-FQEVSTJZSA-N 452.584 0.587 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840033179 XADPBEWZKVPPOD-CRKGLEMHSA-N 484.351 0.360 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1 1840033438 FGJPMNLBWORWCK-SUNYJGFJSA-N 456.341 0.517 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1 1840153680 XLJKMFYSFOKEKL-LIRRHRJNSA-N 463.865 0.567 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184155 AFWRHLDCOOPQEJ-XMMPIXPASA-N 484.557 0.381 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1F 1840185545 TVGUXMMOOLUYFH-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840301087 CITAVGYYLMNKIZ-CYFREDJKSA-N 460.575 0.695 50 20 JCGD O=C(c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841354715 QNTBEEUSQZSCBU-KRWDZBQOSA-N 471.963 0.124 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CN2C(=O)COc3ccc(Cl)cc32)C1 1841855790 YBSIEFHRQZQVRV-UHFFFAOYSA-N 483.717 0.262 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014921 PZSMGQJTTSQHID-MZNJEOGPSA-N 469.347 0.440 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 1845577384 TUDMTIVFUFYSAC-UHFFFAOYSA-N 464.442 0.600 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)C2CCN(c3ccc(F)cn3)CC2)C1 1845829625 DCQCSGZEMAIRDF-UHFFFAOYSA-N 466.322 0.634 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCC2(CN(C(=O)OC(C)(C)C)C2)O1 1847289116 XVSHMDNYFSZKGW-OKZBNKHCSA-N 493.605 0.730 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1848214662 PPVHRMNVBXAIHG-AUVRISJYSA-N 481.513 0.329 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(N2CCOCC2)nc1 14232077 PUZGBLLYZBNTLB-UHFFFAOYSA-N 475.527 0.014 50 20 JCGD CC(C)CCn1nc(C(=O)NNC(=S)NCCNS(C)(=O)=O)c2ccccc2c1=O 727067944 VQHWLXDEAJMJPT-UHFFFAOYSA-N 454.578 0.101 50 20 JCGD CN(C)S(=O)(=O)N1CCN(C(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1 728955736 BDCNWYKAHSABKB-UHFFFAOYSA-N 468.761 0.881 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2)cn1C 747635701 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Cc1ccc(C)c(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1783288902 LLLFDEZPPUEZKC-DEOSSOPVSA-N 451.527 0.988 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1783353609 XVXADEMKLJYSIM-IFXJQAMLSA-N 466.336 0.948 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN3CCN(C(=O)OC(C)(C)C)CC3)CCO2)C1 1783884105 PRADSGRKOCQTEN-VGSWGCGISA-N 489.013 0.623 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)CCO2 1783933462 JYJOWGVRJVMENL-QFIPXVFZSA-N 469.583 0.493 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(c4ccccn4)CC3)C[C@@H]21)[C@@H](O)CCl 1784093353 XMJQORPPKSGZLP-VJANTYMQSA-N 450.967 0.877 50 20 JCGD CCOC(=O)N(CC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)Cc1ccco1 1784306587 UQUMVNNSISXLKU-QHCPKHFHSA-N 493.561 0.441 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1 1784848581 SDCLLTKGYWVFDI-BQXPFJCYSA-N 457.955 0.841 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 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C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1 1839623434 ZIKYDIBLXMTOMV-BFUOFWGJSA-N 484.326 0.969 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccc(F)cn34)C2)C1 1840154819 HKJWRCCHNSTVFW-FOIQADDNSA-N 454.886 0.797 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2 1840258896 QUFQHVXPLQNJGU-NLFFAJNJSA-N 479.537 0.485 50 20 JCGD CCOC(=O)N(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)Cc1ccco1 1840340491 NKPLDVJVMGCUAA-DYESRHJHSA-N 487.937 0.294 50 20 JCGD O=C([C@@H]1C[C@H](O)CCN1C(=O)OCc1ccccc1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841351552 UQJNCRNRUXHCSR-QYZOEREBSA-N 479.961 0.952 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1 15762862 PDQUJCCMQUXXMV-LLVKDONJSA-N 469.317 0.861 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1OC 28717814 YCEDBHUDEUANLG-UHFFFAOYSA-N 475.321 0.924 50 20 JCGD NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1 726862657 ZKAUANNIKSJVAH-UHFFFAOYSA-N 495.583 0.368 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O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@H]1CCCN(c2cc(NC3CC3)ncn2)C1 1799055614 RMUPIKXTFWYTCR-FRBLJADDSA-N 493.008 0.457 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1CCCN(c2cc(NC3CC3)ncn2)C1 1799055619 RMUPIKXTFWYTCR-QQSMOKJMSA-N 493.008 0.457 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS(=O)(=O)N1CCCC1)C2 1799275560 XWNBAGLQNCKNKG-IARIHHJXSA-N 456.392 0.238 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(OC)cc1[N+](=O)[O-] 1799404264 KJSGVCXJRVRQFG-QHHYFVSCSA-N 455.895 0.989 50 20 JCGD COc1cc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(F)c1 1799590250 AFUOTHOUWAHWGQ-VTEUUUEMSA-N 460.242 0.170 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c(=O)cn1)C2)[C@H](Br)Cc1ccccc1 1800436028 JAHMSJZDPLTNBE-YYAJDYIMSA-N 475.343 0.979 50 20 JCGD CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1800825213 WLYAUVZSLBAHSF-NMQXAITKSA-N 463.934 0.871 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1800944775 CGNBFBUEZKCKNC-AICCOOGYSA-N 499.989 0.438 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@]12C(=O)Nc1ccccc12 1801929672 DLXRDOLUWKGSCZ-WHGMGBLPSA-N 453.543 0.908 50 20 JCGD CNc1nsnc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1802481560 XCWMRLRWCZSWNU-KSSFIOAISA-N 460.564 0.667 50 20 JCGD CN1CCC(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1802641659 AXYSDXCWCZRKJQ-XUZZJYLKSA-N 464.375 0.813 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1803587524 HDZLUEMXMQRYPL-WRWLIDTKSA-N 467.592 0.141 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n(C)n1 1804923346 AVCGNUPTUKQWBS-DYESRHJHSA-N 463.303 0.137 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)C1 1805506302 LZKOTMHXZPOKRU-RTBURBONSA-N 456.348 0.801 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360350 AKMSDCIBKMQKCH-IIBYNOLFSA-N 462.271 0.201 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CCCC3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370459 FIJAAQFTSSCBSV-MBSDFSHPSA-N 473.342 0.997 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CCC4(CCCN(C(=O)c5cccc(B(O)O)c5)C4)CC3)ccc21 1809978783 QYHIOYYLKANOFG-UHFFFAOYSA-N 490.369 0.715 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(C)C 1810099660 FNOFOFZFTYTDLG-FCEUIQTBSA-N 467.331 0.669 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1 1810298574 JAKAWJIEBSADKM-IFXJQAMLSA-N 490.480 0.202 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1 1810301984 FGKAJXKVBXLMPA-FZKQIMNGSA-N 450.459 0.142 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303503 TZKHNUPTRPTQBV-OXFYSEKESA-N 477.529 0.328 50 20 JCGD CC(C)N(C)CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810308111 JEDMZXGUAWVWMH-UTKZUKDTSA-N 453.547 0.740 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nc3ccc(F)cn3n2)[C@H]1c1cccnc1 1812291367 AAWUYDVEGQJKCG-IIBYNOLFSA-N 482.520 0.956 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2CCN(C)CC2)[C@H]1c1cccnc1 1813032006 UFALCPOHDXPFFA-ZJOUEHCJSA-N 451.999 0.979 50 20 JCGD C/C(=C/C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(=O)O 1814097133 KVQRJASDHWJXFJ-ZHESJHETSA-N 452.471 0.431 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3c(c1)CNC3=O)CC2)c1ccc(B(O)O)cc1 1815344352 VFDJSZQZFYTDDM-INIZCTEOSA-N 476.323 0.606 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1817303191 YGTAWERUMNFXQD-CMPLNLGQSA-N 459.532 0.234 50 20 JCGD COC(=O)C12CC(C(=O)N3CCCC[C@H]3c3cc(NC(=O)c4ccc(B(O)O)cc4)n[nH]3)(C1)C2 1817474248 BKHDTWXUFYZNAO-YTZBPGPESA-N 466.303 0.739 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCNC4=O)sc2C1 1818916071 HKMZRFSHHLCHHY-GHMZBOCLSA-N 466.951 0.953 50 20 JCGD CC(=O)O[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(C)C 1819248177 XVSBVBHYXLKSGD-ICSRJNTNSA-N 456.308 0.983 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)C(=O)Nc3cccnc3)sc2C1 1820047848 KYAWMXYTTKMGSG-LLVKDONJSA-N 480.510 0.401 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)CC1 1825492340 WQWQVOIRYRFLAB-LJQANCHMSA-N 453.304 0.313 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827054901 MSGYJHUMPRPORZ-HXUWFJFHSA-N 451.332 0.821 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CC[C@H](N)C(N)=O)CC1 1827680847 IXKNEZMCUWBCPC-GCOGVYCUSA-N 473.578 0.333 50 20 JCGD CN1CCN(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1 1828925669 OUTLYJLQUPGVLV-JOCHJYFZSA-N 485.633 0.556 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cccnn3n2)CC1 1829565833 UJJRNONXKWCTDR-JOCHJYFZSA-N 461.331 0.956 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2)CC1 1830720293 WNPTXEAEDOFSAY-NZQKXSOJSA-N 480.993 0.108 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)C1 1830882704 WUNDDUJCBNUUSO-XOBRGWDASA-N 496.388 0.882 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1831644184 QKTQJPKKDMCZFH-UZLBHIALSA-N 473.979 0.963 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccnc3OC)CCO2)C1 1833004661 KDJMEAKEASETEG-UWJYYQICSA-N 455.939 0.733 50 20 JCGD Cc1nn(C)c(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1F 1834028122 COAWSPFXTQFWNR-UHFFFAOYSA-N 471.342 0.046 50 20 JCGD Cc1cccc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1834148623 JMVPURQIARYGKU-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CN3CCNC3=N)CC2)CC1 1834703381 RZDRWNVUULTQKE-AWEZNQCLSA-N 457.417 0.429 50 20 JCGD Cc1cnc2c(C(=O)N3CCOC[C@]4(CN(C(=O)CCBr)CCO4)C3)cnn2c1 1834822965 AYAZLNFUJORHLZ-IBGZPJMESA-N 466.336 0.893 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)cco3)CC2)CC1 1835736702 CYYPCHGTDSUHAM-UHFFFAOYSA-N 468.514 0.137 50 20 JCGD O=C(c1cccc(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939214 HMBHDBHIFKQWPD-QFIPXVFZSA-N 458.707 0.404 50 20 JCGD N#Cc1cccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1836258368 BIUGWRDLFRPNPZ-UHFFFAOYSA-N 460.343 0.737 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc2c[nH]nc12 1837459623 MDGKIVMNCDFLGH-XMMPIXPASA-N 493.524 0.254 50 20 JCGD Cc1nnc(CC(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)s1 1837953224 SXOCQULNGJUAPG-UHFFFAOYSA-N 466.608 0.761 50 20 JCGD Cn1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(C(F)(F)F)n1 1837957904 RVJAIOYIHCWPRO-WBMJQRKESA-N 454.833 0.109 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1839155460 UQCCFAOEONJNTL-OALUTQOASA-N 491.328 0.449 50 20 JCGD O=C([C@@H]1CC(c2ccccc2)=NN1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839636707 PGJQQNSERFEAPY-ABSDTBQOSA-N 483.338 0.900 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)ccn1 1840154088 LFWKPIBLVHQDGH-KKSFZXQISA-N 469.922 0.582 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1840156179 ORQDNMNNBSRWHV-XMSQKQJNSA-N 466.966 0.094 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(Cl)s3)C2)C1 1840182960 XUUXVOMJDLFVCH-FQEVSTJZSA-N 472.995 0.773 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc43)C2)C1 1840185328 OOHMMGKCCJLBQA-GBXCKJPGSA-N 458.559 0.546 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011862 CVMDJDIGDRFLNT-UHFFFAOYSA-N 460.299 0.866 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1845938705 AVZLMGNXNKGUAC-UHFFFAOYSA-N 470.356 0.220 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c1)C(=O)NC1CC1 9889741 ONTKGXZPFRNPNW-UHFFFAOYSA-N 489.529 0.376 50 20 JCGD CSCC[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 14701748 ZDYPMONTFRLIGJ-LBPRGKRZSA-N 453.546 0.885 50 20 JCGD CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1 20901164 ZSMVGLCWPCIEGB-UHFFFAOYSA-N 472.589 0.294 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cc(Cl)ccc3O)CC2)cn1C 109617176 WFWXMSBFMJOILY-UHFFFAOYSA-N 455.924 0.949 50 20 JCGD O=C(COC(=O)CCNC(=O)c1[nH]nc2ccccc12)NNC(=O)[C@H]1COc2ccccc2O1 110927492 XRNVGJZBWUXNIS-QGZVFWFLSA-N 467.438 0.213 50 20 JCGD CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CNC(=O)c1ccco1 725741398 QLBKRWMFFVSBGZ-CQSZACIVSA-N 461.500 0.454 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNC(=O)c2cccn2C)c([N+](=O)[O-])c1 726541211 SZOMBDXIBNKNFL-UHFFFAOYSA-N 453.477 0.804 50 20 JCGD Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)c1 729275323 NFCBDZQPPFJFHI-ZDUSSCGKSA-N 454.530 0.495 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2cccc3cccnc23)c1 747472663 ZYJUWWYAZMIMHA-UHFFFAOYSA-N 455.496 0.676 50 20 JCGD O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)c1cncc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c1 748358973 YGTYNIDWDNSHFS-SFTDATJTSA-N 487.472 0.611 50 20 JCGD O=C(NCc1ccnc(-n2ccnc2)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 749197796 JLSXUIVPIOONPO-UHFFFAOYSA-N 485.526 0.432 50 20 JCGD CCc1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1S(=O)(=O)N1CCOCC1 914437931 RHSNUYKFOHOYQK-KRWDZBQOSA-N 459.590 0.376 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cc2)CCN1 914666074 HBDCTVZRSMAPPW-UHFFFAOYSA-N 494.913 0.079 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@H](NS(C)(=O)=O)C1 918777417 ITTXUFOYYCTMAP-YPMHNXCESA-N 463.354 0.971 50 20 JCGD O=C(NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N[C@H]1CCS(=O)(=O)C1 919885515 LFVIHLZQWUERIG-LBPRGKRZSA-N 464.953 0.256 50 20 JCGD Cc1noc(C)c1CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 920279059 ARCFXWOODNVDDU-UHFFFAOYSA-N 465.532 0.776 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)n(-c2cccc(=O)n2C)n1 1777714705 DYBVHSDVWNGIGI-YZZKKUAISA-N 491.976 0.607 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1778256599 NRWOEVFYRIYXSI-XMMPIXPASA-N 480.525 0.330 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(F)c1 1778289155 RTTJPQDFULNZGV-XMMPIXPASA-N 485.516 0.909 50 20 JCGD COc1nc(C)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1779850931 HUNSXAGVRHQFOO-WZONZLPQSA-N 461.563 0.899 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccn1 1780321800 IJOODUXFXHWCNH-HSZRJFAPSA-N 482.497 0.014 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[nH]n1)C2)NC(=O)NCc1ccccc1 1780558944 MCJQDRVYWNTXRW-HYBUGGRVSA-N 483.573 0.883 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780937095 DSFPMBSXOMETAP-MOPGFXCFSA-N 475.398 0.958 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)N1C[C@H]2C[C@H]2C1 1780967944 FHPQZEPTGBESNE-VABHDBBGSA-N 498.628 0.503 50 20 JCGD Cc1oncc1C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969556 HVXPSYZFHNLKKW-QHCPKHFHSA-N 470.530 0.773 50 20 JCGD C=CCO[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 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CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1831139337 QOJMHCFJXYYLBS-KKSFZXQISA-N 473.954 0.220 50 20 JCGD O=C(CCN1C(=O)c2ccccc2C1=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1832534700 KSUQCDGLWVGXRF-UWJYYQICSA-N 467.881 0.664 50 20 JCGD CC(C)N(C)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551388 MBQXXWLWNZKIHH-HTAPYJJXSA-N 491.029 0.915 50 20 JCGD O=C(CCc1ccc(F)nc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833793520 SYEWYJULSHKNIA-UHFFFAOYSA-N 482.365 0.719 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3ccn(C)n3)CC2)CC1 1834216382 MMAQWZWXDHUGJN-WGOQTCKBSA-N 468.562 0.739 50 20 JCGD Cc1ccc2oc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2n1 1836267530 XDXQNSGVHWIEKP-HSZRJFAPSA-N 473.530 0.579 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3ncsc13)CCO2 1837076215 RPYDCDBKWZPWKB-JOCHJYFZSA-N 475.571 0.739 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)CCO2 1837472134 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CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840082745 MYHCBOHERZXVRC-RZTYQLBFSA-N 487.981 0.442 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2 1840156915 YAKIIRZWQYWMAR-HYFFOGBASA-N 487.981 0.613 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840187752 UOGMZJLRRAAIMN-YPKZHZFPSA-N 460.318 0.381 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840945696 BIRGAIGTMSEIST-GXYOHSSGSA-N 493.960 0.390 50 20 JCGD O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011763 QGNKYDOGESZQCD-UHFFFAOYSA-N 457.295 0.454 50 20 JCGD CCn1c(-n2nc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)cc2C)cccc1=O 1843133934 ACRUJOXIBOULEO-UHFFFAOYSA-N 483.573 0.552 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)C(=O)Nc2cccnc2)C1)NC(=O)NCc1ccccc1 1844342166 SVTXDFBTGNMOOM-UHFFFAOYSA-N 479.541 0.570 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCC(=O)N2CCOCC2)cc1 11532046 IBYJCGIWWSOCGM-SFQUDFHCSA-N 467.482 0.743 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1 18946254 YQWLYKYAXUSNKU-ZDUSSCGKSA-N 462.619 0.778 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)c1 28196126 OLGDWFILVXOUEH-UHFFFAOYSA-N 496.611 0.884 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)NC1CCCCC1 725989388 NCHDWZWWVPLFHH-MRXNPFEDSA-N 460.578 0.431 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNS(=O)(=O)c3ccn(C)n3)c2)cc1 727350228 VDGDLMNHVROUTR-UHFFFAOYSA-N 465.513 0.853 50 20 JCGD CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)NNC(=O)c2cnn[nH]2)c1 729456494 OUXUZVHFRIMMSQ-UHFFFAOYSA-N 485.954 0.460 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)n1 761816866 JGJRFUYARNBLAM-OAHLLOKOSA-N 496.567 0.456 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1 810557476 QXMNTPTXERPYFG-OAHLLOKOSA-N 483.593 0.691 50 20 JCGD CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 811877418 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NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ncccc3C(F)(F)F)C2)C1 1779710504 HRVXOIDRKYJPTI-FQEVSTJZSA-N 478.431 0.856 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC#N)C2)NC(=O)NCc1ccccc1 1780558699 FJULMBDISNJTRV-AUSIDOKSSA-N 456.547 0.760 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1 1780712068 JDBYAYMTXULVMF-QGWWYQLQSA-N 452.379 0.888 50 20 JCGD CC(=O)C[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968565 NVFIATJKRVBMQO-KOSHJBKYSA-N 473.574 0.778 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781334594 PZHZBCDIRWCVQL-QJNYJZHLSA-N 494.358 0.877 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2ccnn2c1 1781345216 RAXIATIHLBZNBZ-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c([N+](=O)[O-])c1 1782088071 MXAMNNOLDPHUHW-JOCHJYFZSA-N 491.501 0.198 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)C1 1783865205 XEZCBAKUOUYRHN-CKNGIIGNSA-N 473.530 0.108 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C(F)(F)F)o1 1783934648 JNWRUSKFSNXZBP-GOSISDBHSA-N 461.441 0.818 50 20 JCGD CSc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1784216593 PAMQDNZIJBFVJY-QHCPKHFHSA-N 454.357 0.775 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCN3C(=O)OC(C)(C)C)[C@H]2C1 1784823643 NYWLZRQZDJPDBV-XSLAGTTESA-N 481.594 0.349 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccnc3)[C@H]2C1 1787096371 VWDLAKVRQNPRRY-QARUKCAUSA-N 452.515 0.738 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3cc4n(n3)CCNC4=O)cc2)CCC1 1787573784 WTQQIRGKLCPMNL-UHFFFAOYSA-N 488.508 0.687 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1788091886 AKQYYCMEYVPYCJ-SOMFZHDCSA-N 489.997 0.184 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(S(C)(=O)=O)CC3)[C@H]2C1 1788109221 DISOCZYSPWFKEG-IWCQGFGOSA-N 494.452 0.669 50 20 JCGD COc1cccc(OC)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789473997 QPFFCRKTZLTVIS-VHFSOBRXSA-N 483.525 0.609 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCC3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724633 FJWCWMGYHMZUPU-FKBYEOEOSA-N 486.617 0.408 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789921805 XKWIUPVVSVTKPI-YTFOTSKYSA-N 496.374 0.932 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC[C@H](O)CC3)[C@H]2C1 1791403242 SPKLCHVTYJACHL-LHLXRYJCSA-N 459.547 0.651 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC 1793602270 SKZWOZSCCVKXPT-IFTGGNMHSA-N 477.986 0.758 50 20 JCGD O=Cc1ccccc1-c1cncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1 1795740540 GGCIQJNIAJEHCJ-BRTYFSMRSA-N 499.332 0.758 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)nc1C)C2 1796441426 IEBKWQRGDUXJQQ-RVQRMFQJSA-N 456.478 0.866 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Oc1ccccn1)C2 1796445701 HWSUQTDEVYULRW-PCZSQWGKSA-N 468.514 0.573 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)NCC(C)C 1796465409 WCZKVULWIDGQNH-CCWDJLKJSA-N 476.486 0.496 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc(Br)n1 1796691928 QVIKYCFBYWXGBN-QHBPRCKVSA-N 474.381 0.482 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c1 1799346988 CHGCXCPOIUDDPF-XCCSTKFXSA-N 464.313 0.379 50 20 JCGD COC(=O)CCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801073606 PQPNNJWFRFUWFW-YVWYUNDQSA-N 461.519 0.012 50 20 JCGD CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1802900441 YXICRPZBGGHYPZ-BBRMVZONSA-N 458.910 0.792 50 20 JCGD 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1830727057 ZXBJXYUCMBSTFP-OZIGNCPNSA-N 452.935 0.855 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1 1831982757 PQFDBFOXCAFSBB-DZTFFZQKSA-N 482.541 0.665 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1cccc([N+](=O)[O-])c1)CCO2 1832177005 DGKGITCIIVMYTB-QHCPKHFHSA-N 491.545 0.357 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2 1832367193 OOWYWNLXPFDRNZ-HSZRJFAPSA-N 476.549 0.687 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C(=O)O)ncn3)CC2)CC1 1833967995 CQFJYJFSVSHWOX-HNNXBMFYSA-N 453.927 0.614 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cc(=O)n2[nH]cnc2n1 1834797187 FYHXRMODVOUMBB-OAHLLOKOSA-N 484.330 0.293 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1834798551 JYOJKPNZHJPLRQ-UHFFFAOYSA-N 494.357 0.047 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)no1 1834821172 ACEZWYIQZPSUAV-GOSISDBHSA-N 473.324 0.553 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCCO3)CC2)CC1 1835734714 QNNAFHDTMOMDFV-HXUWFJFHSA-N 458.563 0.439 50 20 JCGD Cc1[nH]ccc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737948 NZFZTLKRPOERQU-UHFFFAOYSA-N 453.547 0.821 50 20 JCGD CC(C)Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835932122 OVSYRJHTPYXEON-AREMUKBSSA-N 480.370 0.949 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836859378 XQYDNTWJKYZJTQ-INIZCTEOSA-N 457.531 0.336 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)cc2s1 1837459605 LMRKEZMNVJKUJS-QHCPKHFHSA-N 498.565 0.920 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(O)n3)CC2)CC1 1837472204 NLURXQANDWGDFU-UHFFFAOYSA-N 468.514 0.712 50 20 JCGD CC(=O)NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528424 WPMOTWVLMXQUGP-JOCHJYFZSA-N 492.485 0.116 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838813611 TXQZZEFUGBHQLW-QHCPKHFHSA-N 478.594 0.469 50 20 JCGD CNc1nsnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839149743 QSGRJUVESHGWRN-HZPDHXFCSA-N 452.364 0.886 50 20 JCGD CN1CCC(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)CC1 1839197511 ZQKCMJAPIHXNQR-FUHWJXTLSA-N 450.349 0.865 50 20 JCGD CC[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1839210978 INDCHTSEKOJIBE-ZOCZFRKYSA-N 477.986 0.736 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839670179 UODVLQVPHCFXSN-MSOLQXFVSA-N 463.318 0.254 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCCC(F)(F)F)C2)C1 1840182674 PPBDQRRSGMWIJV-SFHVURJKSA-N 452.474 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4occc34)C2)C1 1840184027 OBAPGXZEAVMZAL-QFIPXVFZSA-N 459.503 0.271 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4ccccc34)C2)C1 1840184398 JWCIHXXMUJLTIB-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1840185830 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CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)c2)CC1 770389922 FLCAUQQXZZUWJV-UHFFFAOYSA-N 488.522 0.385 50 20 JCGD O=C(COC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)NNC(=O)[C@H]1COc2ccccc2O1 849194815 ZNAQMXHVYRPBBC-GOSISDBHSA-N 467.394 0.925 50 20 JCGD CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1F 914749188 GFSIZEXYVHEIBD-UHFFFAOYSA-N 471.536 0.880 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(C(=O)N3CCOCC3)cc2)cc1C 915187181 ORGHTHWQGNEATJ-UHFFFAOYSA-N 460.512 0.724 50 20 JCGD CCNC(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 916392473 YDNSFDUFHMRNPR-UHFFFAOYSA-N 489.554 0.601 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1c[nH]nc1C)N(S(C)(=O)=O)CC2 916578847 YEGNPIOLMFUQJU-MRXNPFEDSA-N 480.547 0.515 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C1=NO[C@@H](c2ccccc2)C1 917496044 JDWGLEKWPZWYBA-LJQANCHMSA-N 458.496 0.986 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1O 917720173 DLRNABSSIGHVNX-UHFFFAOYSA-N 471.513 0.117 50 20 JCGD O=C(NCc1ccc(N2CCC(O)CC2)c(F)c1)NNC(=O)c1ccc(-n2cnnn2)cc1 918220307 WNMSUKVPVOOLDC-UHFFFAOYSA-N 454.466 0.907 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1OC 920738483 PRYLBJPZRXCHBE-GJZGRUSLSA-N 472.564 0.019 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)NCc1ccco1 920858303 LCPMUNGULZZRJA-OAHLLOKOSA-N 492.963 0.545 50 20 JCGD O=C(NCc1ccc(C(=O)N2CCOCC2)cc1)NNC(=O)C1CCN(c2ncccn2)CC1 1326427727 BOGHVHSVFIVVAM-UHFFFAOYSA-N 467.530 0.696 50 20 JCGD COc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1779029591 ZIERNPWXWIMBNO-HSZRJFAPSA-N 468.514 0.165 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1 1779032875 ZNVXRFWHQBQTKO-QHCPKHFHSA-N 453.499 0.759 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cn1 1779371292 MJSXBEFVABAWPS-WZONZLPQSA-N 468.514 0.530 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc3c(c1)CCO3)C2 1779375742 SJTPQXLZODPSOZ-ATIYNZHBSA-N 493.564 0.990 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc([N+](=O)[O-])[nH]1 1780233016 HHHPEOQXISUVQX-DYESRHJHSA-N 456.264 0.044 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@]3(C)CCCN3)C2)C1)NC(=O)NCc1ccccc1 1781145620 LGAXJBOJWFPXJZ-RPWUZVMVSA-N 472.590 0.305 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1781179641 YZUOOXJRYJUPHY-RUZDIDTESA-N 477.301 0.740 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3c2CCC3)C1 1781282749 HUDIDCSLWKFIOC-AUSIDOKSSA-N 467.530 0.269 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781331139 LODFJBAKSTVICH-CKQWILCBSA-N 458.288 0.641 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)[S@@](=O)c1ccccc1 1782688580 YHPYBNLDDJRPMH-DWIBEDJPSA-N 464.588 0.386 50 20 JCGD COC(=O)N(CC(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)Cc1ccccc1 1783690545 HLEBFAZJAIELBU-XMMPIXPASA-N 489.573 0.458 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784093649 CYRQIZYSTHEQSN-SIRPWMCASA-N 459.971 0.965 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)[C@@H]1CCc2nc(O)nc(O)c2C1 1785332248 LBLSOKGVHWPSAD-IHOMSZDFSA-N 459.330 0.776 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1 1785714109 NCDBRYCAUQYLAQ-JOCHJYFZSA-N 488.545 0.186 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn(C)c3)[C@H]2C1)NC(=O)NCc1ccccc1 1785860956 JLUABXBZXBXHKQ-FKBYEOEOSA-N 482.585 0.965 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1F 1786982173 PWVHGLBKSNFKME-MDKPJZGXSA-N 456.279 0.421 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1787513145 AQJBEMMVXJNMNT-QSGXVVIFSA-N 489.013 0.965 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(F)c(F)c4)CC3)[C@H]2C1 1789703890 RSRHGUPSMZRMFF-BPXKWBHBSA-N 484.308 0.970 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccccc3C(N)=O)[C@H]2C1 1790127677 CZSGPFWLUDYWFF-ZMEUDLNSSA-N 480.525 0.513 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)[C@H]2C1 1790176716 CZYZMVUHUXZQAK-HYFYGGESSA-N 464.357 0.593 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(-c2cc[nH]n2)cc1 1790187435 IDGDRBHKDIDWCM-RRPUWOKSSA-N 474.326 0.664 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792980928 AYBOGBIOPGBHJG-NNXHMXCWSA-N 459.971 0.965 50 20 JCGD C[C@@H](Sc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793233437 FJZFPELWGSEVHD-LAVAIGHBSA-N 454.357 0.750 50 20 JCGD Cc1cccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793531912 RHODICBKFNCEFG-JHDGKUDLSA-N 480.569 0.939 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])C2)c1cccc(B(O)O)c1 1795737616 BHHODSBPJFEJHG-VPTLXERWSA-N 487.705 0.374 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)n1 1796355695 SMXJTGJYFZOBHS-KSPBDQMDSA-N 487.425 0.238 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C)C2 1800971227 QRTMOEMWPIEVPX-KUHBDSFDSA-N 473.954 0.408 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(c1)NC(=O)CS3)C2 1800979716 WPEIJLGNPKABNM-OQMKEHIESA-N 454.936 0.583 50 20 JCGD CCC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1803690367 NOKVNOXMTHCDTM-KEYYUXOJSA-N 458.910 0.935 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365843 ZGOGNVNYRKZZHE-SIKLNZKXSA-N 477.330 0.238 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3c(c2)CNC3=O)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375993 RAODPDARMXYZOC-AUSIDOKSSA-N 484.321 0.638 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1 1808110164 PYSPLWNNTZXOIV-MGPUTAFESA-N 485.508 0.985 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCN2CCOCC2)[C@H]1c1cccnc1 1808415302 UZTADZUZVKEGBO-XLAYELQVSA-N 495.584 0.944 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2c(c1)CNC2=O 1810038035 WRFWAXDEHKUBNA-AUSIDOKSSA-N 484.321 0.638 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1 1810301708 AIKYKFMWBGVZIJ-FZKQIMNGSA-N 479.457 0.345 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1 1810302957 ONIHMOWMVAFQKW-IIBYNOLFSA-N 485.508 0.756 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303062 OZQOKZHDUCDYLM-ZXUOCUECSA-N 453.547 0.773 50 20 JCGD Cn1cc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1810310591 XWTFFHYPCJDQOB-UWJYYQICSA-N 462.514 0.376 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1814132309 UDUGBJQFDATARF-IPJJNNNSSA-N 460.579 0.765 50 20 JCGD CC(=O)N[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(C)(C)C 1815056526 CGEFUMARVLJYIN-UYAOXDASSA-N 469.351 0.946 50 20 JCGD Cn1cccc1C(=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347868 UJQKHXYNFVGESE-AWEZNQCLSA-N 452.301 0.270 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)N1CCN(C)CC1 1817472743 VRULMZKEZIYRNZ-UZLBHIALSA-N 468.367 0.031 50 20 JCGD Cc1nnc(CC(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)s1 1826085405 RHCQPPCXBGHEQE-LLVKDONJSA-N 451.578 0.831 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)CC2 1826088877 QYJUQFCWZUTRFH-RRFJBIMHSA-N 476.603 0.829 50 20 JCGD O=C(CCCn1ccnc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826684278 HNISNPNQNZOJDX-INIZCTEOSA-N 453.333 0.726 50 20 JCGD O=C(c1nc2ncccn2n1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053030 SXYORSCBSKIYDJ-IBGZPJMESA-N 462.319 0.351 50 20 JCGD Cn1ccc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)n1 1827138195 AHNOKHBWQOXMJO-HXUWFJFHSA-N 453.547 0.895 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830732084 UHTZDVNNHRXNCE-NRVIRDBHSA-N 489.997 0.546 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)no3)CCO2)C1 1832567134 FVVQQEDJZPATLD-ZHNJOBQTSA-N 472.502 0.116 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn(C)c3C(F)(F)F)CCO2)C1 1833329582 FUTBNWKQVGQDJP-DYVFJYSZSA-N 468.860 0.763 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1833452076 VFKKVQVGOXGZBM-SWLSCSKDSA-N 485.420 0.576 50 20 JCGD CCc1oncc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1834517836 UPTZSHSBDLMCNR-IBUSPFOHSA-N 472.502 0.441 50 20 JCGD Cc1ccc(OCC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834801046 KDDMCLRTJRDFEB-UHFFFAOYSA-N 479.386 0.939 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccn2cncc12 1835614918 XZKZWZWGPYNTNH-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(C)(C)C)CCO2)C1 1835617266 YIRVHXAUNSVHPG-HSZRJFAPSA-N 492.529 0.978 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cc(Cl)n3)C2)C1 1835931726 ZCNYSHLBWODSND-NRFANRHFSA-N 494.140 0.452 50 20 JCGD CC(C)[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835934224 QJEYQTLRNVOMSX-JYFHCDHNSA-N 480.370 0.876 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc4nscc34)C2)C1 1835939628 WBLYQDVGGXMHOR-HSZRJFAPSA-N 481.339 0.360 50 20 JCGD CN(CC(=O)N1CCC(N2CCC(NC(=O)c3ncon3)CC2)CC1)NC(=O)NCc1ccccc1 1836046346 FDSYRDALMNISTJ-UHFFFAOYSA-N 498.588 0.601 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3c[nH]c(=O)cn3)CC2)CC1 1836138704 YIOPWJILNOSGQK-RWPZCVJISA-N 482.545 0.089 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1 1836873943 GWSXJOCLUITIPF-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1837379787 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COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C(=O)OC)cc3[N+](=O)[O-])CCO2)C1 1839461918 DAAOBAMWVAVXHY-HRAATJIYSA-N 499.904 0.705 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(O)nc3O)C2)C1 1839964415 QTMYGYFLEWCELN-SJKOYZFVSA-N 459.297 0.131 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)Nc3c(C)cccc3C)C2)C1 1840154798 GZBMLWLTQURFPL-VGSWGCGISA-N 467.950 0.952 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840738122 PMTOMXHVHZXYBD-JOCHJYFZSA-N 482.965 0.792 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@H]3C[C@@H]3N2C(=O)OC(C)(C)C)C1 1841361014 UBKPFVSJUVFVEQ-ULQDDVLXSA-N 463.579 0.961 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1843427563 UXERGJDSXQFRFQ-KRWDZBQOSA-N 458.563 0.403 50 20 JCGD O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)[C@H](O)N2CCOCC2)C1 1844297653 ZYRIEEYMHWOFAD-MJGOQNOKSA-N 466.376 0.847 50 20 JCGD COc1cc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc(C(F)(F)F)n1 1844684027 GUOYHMZGUJEIGK-UHFFFAOYSA-N 463.221 0.920 50 20 JCGD O=C(CNCP(=O)(O)O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1 1845940679 DILVBITYJSAJER-OAHLLOKOSA-N 474.292 0.921 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H]2C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846157680 HFPRWJGYBSRMAR-NTKDMRAZSA-N 483.374 0.831 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1 1846386415 JAIBUMLKIVJHCW-LJQANCHMSA-N 461.538 0.449 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847562851 BXDSXMYSINAYAT-AJNGGQMLSA-N 481.999 0.116 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)c1 24257138 NOXBOFHUULOUDP-UHFFFAOYSA-N 482.540 0.671 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)cn1C 109590167 XRXDNRNGAVAPRG-UHFFFAOYSA-N 473.353 0.681 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3ccc(S(N)(=O)=O)cc3)cc2)CC1 728214067 WVJQKQRIHVAPMS-UHFFFAOYSA-N 481.600 0.346 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728985211 BGYDWKHEMKTCPI-UHFFFAOYSA-N 489.558 0.167 50 20 JCGD COc1cc(C=NNC(=O)Cc2cc(O)nc(S)n2)ccc1OCC(=O)N1CCOCC1 730587037 UUDUHTOJSJXFRL-UHFFFAOYSA-N 461.500 0.410 50 20 JCGD N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)COc3ccccc3O)CC2)cc1 730778449 HZOHKDNTHCBKST-UHFFFAOYSA-N 458.496 0.891 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1 746386457 UQJLYSLRLXQAKM-GJZGRUSLSA-N 483.363 0.545 50 20 JCGD CN(CC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 747900638 TVMQCSWXGMCQCS-FGZHOGPDSA-N 470.595 0.880 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C\c1cccnc1)c(=O)n2Cc1ccccc1 901393341 OVGFXNVNXNPSBL-KHPPLWFESA-N 473.493 0.684 50 20 JCGD O=C(COC(=O)c1ccc(=O)n(-c2ccccc2)n1)NNC(=O)[C@@H]1COc2ccccc2O1 914593341 MEJOUYHBNYWDCP-SFHVURJKSA-N 450.407 0.377 50 20 JCGD C[C@H](CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)Cn1cccn1 919778912 NEXKOIZYFVISOO-QGZVFWFLSA-N 478.575 0.503 50 20 JCGD CS(=O)(=O)NCCC(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1 920412306 XWTMENQCSHSWCJ-UHFFFAOYSA-N 487.626 0.870 50 20 JCGD Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 1248418150 JDJSORSUJAOZRL-MRXNPFEDSA-N 467.573 0.874 50 20 JCGD C=CCNC(=S)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Br 1317719479 SUAMJCNUENQXLJ-CYBMUJFWSA-N 477.406 0.664 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2c[nH]nc2c1 1777881684 PAFZZSGVNKBBCW-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Nc1cnccn1)C2 1778091371 XOYFARFTQNBGSU-BXSJSQBUSA-N 496.572 0.925 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccncc1C(F)(F)F)CCO2 1779030807 XPYCMKSRHXYHDT-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccnc(Br)c3)C2)C1 1779399460 DPIQQCRHLXABAD-FQEVSTJZSA-N 474.120 0.281 50 20 JCGD O=C(c1n[nH]cc1I)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2 1779544745 SWXFGNOWZJJIMW-GWCFXTLKSA-N 456.643 0.992 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3[nH]nc4c(Cl)cccc34)C2)C1 1780941914 CLWZBHDZZMRYIP-JOCHJYFZSA-N 476.965 0.962 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CCc3cnc[nH]3)CCO2)C1)NC(=O)NCc1ccccc1 1780969782 OMYYEAAAIMIAJN-DEOSSOPVSA-N 483.573 0.518 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnn2cccc(F)c12 1781425519 UJMCTOHREPMEID-HYBUGGRVSA-N 480.305 0.595 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCNC3=O)C2 1781900333 OBFATOIOCKHOCF-GQWAEJPESA-N 482.379 0.928 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214996 OJRGTGCFGWRCSA-DRSNIGMVSA-N 461.567 0.164 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)C(F)(F)F)C1 1782236163 FCZXTSOOBHWVLY-UEKVPHQBSA-N 458.275 0.962 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCc3nc[nH]c3C2)C1 1782457202 VLQKZMABLCVTJP-PFTWBPNJSA-N 481.557 0.341 50 20 JCGD COc1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1F 1782676535 HHKKKMFKJLFOOG-RCZVLFRGSA-N 484.333 0.884 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(Br)ccc1O)CCO2 1783935418 RPXQMJYHCVEMDY-HXUWFJFHSA-N 483.363 0.971 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1F 1786978734 OWNCDWQAZZJKSI-MDKPJZGXSA-N 456.279 0.421 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981969 IPLJDENABILTKI-KNBMTAEXSA-N 472.734 0.936 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4O3)C[C@@H]21)c1ccc(B(O)O)cc1 1786983505 MQDYALHEKKDYGD-HMNCIZAVSA-N 464.327 0.354 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@@H]43)C[C@@H]21)c1cccc(B(O)O)c1 1786983927 GJUDVJWTLCRUGH-FOOHHUQRSA-N 478.379 0.848 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)C1 1787506508 AYEQSSTVNARWOH-HVNKAIIDSA-N 487.557 0.689 50 20 JCGD CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1C 1788610935 BGHZXPWAQQHPQB-FNHZYXHNSA-N 455.519 0.117 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791292425 QQLFALRDJTXJIC-OKYOBFRVSA-N 493.605 0.256 50 20 JCGD C[C@H](Cc1ccco1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791679395 LWOIRZXWIGRAEZ-QBTDHISASA-N 455.515 0.750 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCc3cccnc3)[C@H]2C1 1791725780 OLGYEHFFCZLTQY-YYWHXJBOSA-N 466.542 0.696 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1793244119 TZPREQAXDCDVSX-LFYQSXPISA-N 474.986 0.623 50 20 JCGD CCn1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n1 1794880859 BYHSUFOMDIGPSJ-HATOLVCRSA-N 483.573 0.452 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSC(=N)N 1795503404 JMBLLHVYVLLJLB-OPDFLTKYSA-N 463.988 0.335 50 20 JCGD Cc1ccc(NCCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(C)c1 1795734156 GMNJYHSPRJHENQ-IRJINJETSA-N 465.359 0.689 50 20 JCGD Cc1snc2sc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)cc12 1795739023 QEIQYMOMTXSCJQ-ZSBFGKGUSA-N 471.369 0.863 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn[nH]c3c1)C2 1796443754 GRIOQCUHJDUAPS-UYNJTKMTSA-N 464.486 0.295 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ncccc2n1 1797041249 JUNAMKKSMMPTLC-RVQRMFQJSA-N 464.486 0.067 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/O[C@@H]1CCCCO1 1797811176 KAURNFVUNPGLTB-CREDXGTQSA-N 474.518 0.239 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1799382965 SHLAFJRTFVGTCU-MVJTYMMSSA-N 454.923 0.197 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCOC1=O)C2)NC(=O)NCc1ccccc1 1799865607 DFEQQPYIDPVNNO-REPLKXPHSA-N 472.546 0.423 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NNC(=O)C1)C2 1800333605 AQTVLESOKFZVNK-ODLYAQKHSA-N 486.326 0.822 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCOCCOCCOC 1800848474 FMWDMEQNIVRQKP-ZMMAXQRCSA-N 450.960 0.290 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 1801049811 GORCELYLMYKGEE-MKOKDDGESA-N 490.395 0.731 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)N(C)C)[C@H]1c1cccnc1 1802676613 HKNHYWIXPMIEBV-TYXIVBLQSA-N 482.545 0.493 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2C(=O)C=CC2=O)cc1 1803883738 KATRNJURGNFXSV-GGPHIMKMSA-N 467.526 0.741 50 20 JCGD COc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1805208886 QVJRONBGOUTYCA-XMSQKQJNSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CN2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365533 XMIDOEKLFMNYDQ-VJTSUQJLSA-N 484.365 0.796 50 20 JCGD COCc1c[nH]c(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1807373521 BJSRWNOGKWYYQG-DENIHFKCSA-N 462.315 0.869 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(-n3ccnc3)ccn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376614 WOYIVUNWZPWJGD-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1 1807878512 PODZLMVJFJSXQF-RSPOEFSDSA-N 451.999 0.977 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1808250184 IOGYWNJKDSRXHK-JENIJYKNSA-N 456.996 0.835 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCCO2)[C@H]1c1cccnc1 1810295407 SQEBRACLUSQZQH-DBVUQKKJSA-N 452.515 0.969 50 20 JCGD Cc1nccn1CC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810306094 SRERJRYSXZQOAV-LAUBAEHRSA-N 462.514 0.605 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1 1810354644 UFDUJLOFFAPHHW-QFUCXCTJSA-N 450.612 0.590 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1 1810564336 ISSWDTVXSSDTNB-VGWMRTNUSA-N 459.316 0.929 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1812864758 KNGJMEKZZBGZHO-RBOXIYTFSA-N 452.309 0.423 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CC2)c1ccc(B(O)O)cc1 1815343950 YSSQRGRCDREQJJ-DJIMGWMZSA-N 482.371 0.450 50 20 JCGD CCn1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1C 1815361111 XUTLSCSSQNQLBF-OAHLLOKOSA-N 453.333 0.887 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817281576 HIULPLJSGKJPIB-RWIVRHQRSA-N 471.543 0.880 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3cccnc23)[nH]n1)c1ccc(B(O)O)cc1 1817471827 PVUDTRLYBVDVBX-SFHVURJKSA-N 459.275 0.752 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472473 UEBHNPBMPOVDFA-KBXCAEBGSA-N 455.324 0.700 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccnc3c2OCO3)[nH]n1)c1cccc(B(O)O)c1 1817477029 WECJEFUFYMNYKN-KRWDZBQOSA-N 463.259 0.833 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nc[nH]c1[N+](=O)[O-] 1818075757 NIOBRCLKNKDZSF-AWEZNQCLSA-N 453.224 0.341 50 20 JCGD COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n(C)n1 1819401956 YDTXAUQXZISHMZ-HNNXBMFYSA-N 467.490 0.770 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C(=O)Nc2cccnc2)n[nH]1 1819531020 PQIWPECKMCQHMQ-INIZCTEOSA-N 456.507 0.809 50 20 JCGD C[C@H](Cn1cncn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819538329 NGPNYUNRSPKSJI-RDTXWAMCSA-N 451.296 0.323 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822416277 ZMDMHXIXKMONMD-UKRRQHHQSA-N 450.544 0.482 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1827640313 URXCLHSYNXCGFO-XZOQPEGZSA-N 464.375 0.565 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)CC1 1827643822 MAMVRQFJCBJBHF-SFTDATJTSA-N 458.607 0.944 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)nc1)CCO2 1829509599 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CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1C 1834801283 VTTOAFLSNKDPQD-UHFFFAOYSA-N 467.379 0.161 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)ccn3C)CC2)CC1 1835117643 HHPVPHJLZQOZML-OGLMXYFKSA-N 495.584 0.705 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cc(F)ccc4[nH]3)CCO2)C1 1836805269 RHCSRAJYJZMNDN-DEOSSOPVSA-N 496.499 0.689 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1 1837658862 DCXXNKZTMISBOL-DNVCBOLYSA-N 489.342 0.434 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C3CCOCC3)CC2)CC1 1837753388 GFIQDMUZBSTHHZ-UHFFFAOYSA-N 459.547 0.724 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncon3)CCO2)C1 1838319743 KBMAXIZXSTVBNO-FQEVSTJZSA-N 475.414 0.287 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cccnn3n1)CCO2 1838422860 QROGUFGDAGQECS-SFHVURJKSA-N 452.309 0.584 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nccnc3C(N)=O)CC2)CC1 1838510439 WZCHJEDUFYXFKL-HNNXBMFYSA-N 453.927 0.442 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839156587 VHQISLMSELYRAB-IIBYNOLFSA-N 453.923 0.298 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199320 NFFDWFUZVPVNSQ-HEHGZKQESA-N 465.345 0.160 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1F 1839320886 VWVBOASBEGCCSL-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(F)(F)C(=O)O)C2)C1 1839964562 VTJOTGIQTDXACQ-IAQYHMDHSA-N 457.268 0.726 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1840031140 GJYWKUDWIKUTAT-LIRRHRJNSA-N 471.352 0.374 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1840032571 CMGVXYXKPFVYJG-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)C1 1840154545 ZCCAXUYUYUQUGU-GSHUGGBRSA-N 489.997 0.954 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(=C/c3ccco3)NC(C)=O)C2)C1 1840155213 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CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1 1841352332 JHYIDSZNRDHIIN-FXUDXRNXSA-N 457.955 0.814 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)Cc2cncnc2)C1)NC(=O)NCc1ccccc1 1842097580 OVBLBIHLNQIQNK-UHFFFAOYSA-N 451.531 0.569 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1847025719 OYXPSLYIWUZUFX-UHFFFAOYSA-N 457.336 0.440 50 20 JCGD O=C(Cn1cnc2cc(Br)ccc2c1=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847556860 QSPDAVSOSJNSRS-HRCADAONSA-N 483.750 0.961 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 725873286 WKQALSUEPDHRHH-UHFFFAOYSA-N 491.595 0.714 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728890101 WFVZLXJNYQFBQP-GOSISDBHSA-N 492.627 0.941 50 20 JCGD CC[C@H](OC)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 743751101 FBWGADYIVSOHOS-KRWDZBQOSA-N 470.530 0.636 50 20 JCGD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2)[nH]1 915191221 BGJKIPIAAUBXNQ-UHFFFAOYSA-N 452.423 0.727 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)NC)s2)c2ccccc2c1=O 916232689 LLPTUVKNOXBHER-UHFFFAOYSA-N 464.529 0.530 50 20 JCGD O=C(NNS(=O)(=O)c1cccc2c1COC2=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 918728133 ZSHSINKSSRXHME-UHFFFAOYSA-N 481.508 0.001 50 20 JCGD C#CCN1CCC(C(=O)NNC(=O)C[C@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)CC1 919964005 CYFDALPRGLWHRV-IBGZPJMESA-N 492.598 0.445 50 20 JCGD COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)cc1OC 933545354 VVTVFASMTFFHMN-INIZCTEOSA-N 493.520 0.803 50 20 JCGD CN(C)N(C(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1)[C@@H]1CCS(=O)(=O)C1 1317759757 ZYYFIJWUYYIAIA-CQSZACIVSA-N 464.997 0.628 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778057509 ZAPAVAQSTJCJDE-LRTDBIEQSA-N 474.905 0.268 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCS1(=O)=O)C2)[C@@H](F)Br 1780776867 LTMUBAGGLTUTOU-VPWBDBDCSA-N 455.346 0.768 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2nccn2)C1 1780821108 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LCTAGOYDJZYHDA-BWJYWGHISA-N 459.595 0.690 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)CC2)CC1)c1ccc(B(O)O)cc1 1834798850 FDTBJJRHQMZFHT-NJYVYQBISA-N 455.389 0.427 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C(F)F)CCO2)C1 1834909134 KSIQDFDIPVKKIF-KPZWWZAWSA-N 455.886 0.840 50 20 JCGD CN(C)C(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1835436345 WVUSVBORNRHATB-UWJYYQICSA-N 482.375 0.537 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1 1835645195 YBEYSDXTILGZRU-APWZRJJASA-N 467.394 0.859 50 20 JCGD Cc1cc(Cl)ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835925921 AUPXGZHLVXTCKD-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1836533368 RUWRVJYIWLIMMC-SCQWWOTGSA-N 473.578 0.217 50 20 JCGD Cc1nc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)s1 1837456069 BOODNPSMYYEDKW-QFIPXVFZSA-N 488.570 0.071 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CC3)C2)C1 1837457180 ZHKXWHJGUQYHEE-XMMPIXPASA-N 479.537 0.487 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 1838569051 QDEWDVMXYRNNLB-GCJKJVERSA-N 468.934 0.923 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3C[C@@H]3F)C2)C1)NC(=O)NCc1ccccc1 1839054092 GQIBNYGFXIDXSY-YDHSSHFGSA-N 477.537 0.147 50 20 JCGD C[C@H](S)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054106 HDSDBQQABLKJRX-HTAPYJJXSA-N 479.603 0.107 50 20 JCGD O=C(Cc1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839070300 GQWNDIWSICAVKZ-VWLOTQADSA-N 477.326 0.160 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1 1839275214 PMKHHVUMCCBBON-LIRRHRJNSA-N 457.867 0.624 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839518608 UTXHZYFEXQLMRE-MOPGFXCFSA-N 461.346 0.972 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(Cl)cc3)CC1)CCO2 1839785979 DYVOWLGPTLWJIC-XMMPIXPASA-N 498.772 0.822 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1840033040 RAHDHDFYDQYCCL-QKKBWIMNSA-N 495.374 0.730 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)C[C@](C)(O)CC(=O)O)C2 1841925236 BRAOMRZOMYNKTA-DJJJIMSYSA-N 461.943 0.938 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012067 ZQJKRXVCRPWNKW-UHFFFAOYSA-N 452.707 0.956 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2ON=C(c3ccccc3)O2)C1 1844197425 AFJQAZBRYIWAEK-NRFANRHFSA-N 450.455 0.237 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)ccc1[N+](=O)[O-] 1844265513 KYTILKXLEFUKAT-UHFFFAOYSA-N 454.443 0.733 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O2)C1 1846149766 IXJLRVAJBRJYMD-KURKYZTESA-N 493.605 0.587 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc1 10471355 ULYQZLKXMSMVIK-UHFFFAOYSA-N 480.568 0.617 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1 16786177 PDWUUAFQSUQZAN-YJJOXIQCSA-N 455.558 0.281 50 20 JCGD COc1cc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1OC 23143847 QMJUTRDFGSUBKQ-UHFFFAOYSA-N 499.567 0.656 50 20 JCGD CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 24291360 AHLAWDWULPEZTC-KRWDZBQOSA-N 456.528 0.969 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)c1 105569242 VIOPLPJZPHRMSW-MRXNPFEDSA-N 463.438 0.272 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2scnc2C)o1 729453308 PPSVMUOGYDLVKM-LLVKDONJSA-N 456.502 0.836 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1)C(=O)NC1CC1 743746100 JWZJPOOGEKCCJU-JTQLQIEISA-N 479.378 0.480 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1)[C@@H]1Cc2ccccc2O1 748331924 YHZRLBHADZLKPV-SFHVURJKSA-N 475.483 0.646 50 20 JCGD CS(=O)(=O)N1CCN(CCNC(=O)NNC(=O)c2ccc(F)cc2Br)CC1 749351514 CUKLHFHTHIDJKW-UHFFFAOYSA-N 466.333 0.109 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)c2)CCN1 910422309 NYZWQBVLQZFALU-UHFFFAOYSA-N 499.574 0.934 50 20 JCGD COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)OCC(=O)N2CCNC(=O)C2)cc1OC 914335331 MGNRYLVXIGDOFY-LICLKQGHSA-N 492.492 0.890 50 20 JCGD O=C(CCCC(=O)NNC(=O)c1ccc2c(c1)OCO2)NNC(=O)c1ccc2c(c1)OCO2 915806669 RCBNGYYIQGLWKX-UHFFFAOYSA-N 456.411 0.537 50 20 JCGD O=C(NCCNC(=O)c1ccc(Br)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1 918001607 CTEPJJCBXBTMJR-UHFFFAOYSA-N 473.291 0.799 50 20 JCGD CN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C 920291551 WAPXPZKUXVEFBE-HNNXBMFYSA-N 473.555 0.419 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cncnc1C)N(S(C)(=O)=O)CC2 1317885952 FMWLOQKOOIPMMT-MRXNPFEDSA-N 463.516 0.512 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCN(C)C1)C2 1778092608 KIZQLKLEKJBEQR-KETOKLHRSA-N 472.590 0.976 50 20 JCGD Cc1cccc(/C=C/C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1779028669 HPKCDEBDGUINIX-NFOSPISASA-N 450.499 0.545 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(O)nc3)C2)C1)NC(=O)NCc1ccccc1 1780259558 OAQUGMFLYAWQHV-XMMPIXPASA-N 482.541 0.577 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc(Br)ccc3O)C2)C1 1780557664 SNBLPVJKNWNYAX-OAQYLSRUSA-N 489.131 0.592 50 20 JCGD CN1CCN(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)CC1 1780771512 JOMCSZKDYQGGTB-SZVBFZGTSA-N 463.392 0.828 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)C1 1781332906 GDISYHQDXWFXPS-ZNZDAUKMSA-N 494.358 0.879 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCOCCOCCOCCOC)C2)C1 1781384074 YKJSAEXOPQFYEL-NQIIRXRSSA-N 464.987 0.920 50 20 JCGD CC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1781786834 JVVSSSFRKNUFNX-OPHHTLMUSA-N 460.535 0.159 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2 1782172105 PCRUZPMZDIARQG-DXEZIKHYSA-N 477.986 0.640 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1783461809 RFEKKFCMFPANPF-ZYKLXPEUSA-N 499.373 0.067 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(-c3ccccc3)[nH]n1)CCO2 1783935708 VTWGSWNHEAKHED-QHCPKHFHSA-N 454.531 0.893 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccs3)[C@H]2C1 1785415506 GMFJHANQNJFIBH-JVPBZIDWSA-N 457.556 0.973 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1 1785608291 YOZHQSXCNXLZSX-WHWRDJHUSA-N 450.895 0.119 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncn(C(C)C)n3)[C@H]2C1 1787668651 NBWYEHPCIVREHC-GZERKGCBSA-N 470.534 0.586 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1788639190 INXDVASLBFTTSS-BTFPBAQTSA-N 467.288 0.151 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1789655316 UTHYNCJGPBQFHO-HXUWFJFHSA-N 453.304 0.265 50 20 JCGD CCOc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1789663909 GLALHETVBDIQBG-NYVOZVTQSA-N 452.316 0.672 50 20 JCGD Cc1nn2cc(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)nc2s1 1793662520 LYAUYOGAKWIAGH-RDBQEKCUSA-N 460.329 0.922 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(=O)O)n(C(C)C)n1)C2 1796440970 HOCPGHLQGHLNAK-DHMDNZFNSA-N 499.528 0.499 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3snnc3c1)C2 1796441454 JMVFJPFPIWSTBA-WKOABOCDSA-N 482.526 0.424 50 20 JCGD Cc1ccncc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797749792 TZNBQKASOGMZOX-UPHUGPLXSA-N 452.515 0.225 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1797957432 PAKTZWZOLBJADS-ZSBFGKGUSA-N 452.540 0.198 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCn1c(O)nc2ccccc21 1799062904 AZNYVMWFQZZGLS-GPVSGQMNSA-N 486.573 0.485 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(C)(C)O)C2)NC(=O)NCc1ccccc1 1799094789 KVNOVQMVZUATDC-RMFSNUHRSA-N 461.563 0.083 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)NC(=O)OC(C)(C)C 1799684755 OLOMDRSVFCPVNW-WPLOAARJSA-N 464.357 0.593 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2 1800971479 ZYCNHSPRHTYAPR-QRJUGERDSA-N 463.959 0.106 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1Cl)C2 1801012160 JNHYYHLJICXODF-RYMBOPBQSA-N 452.939 0.336 50 20 JCGD Cc1noc(C)c1CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804244255 JLGACEDCJUDIKL-WMZHIEFXSA-N 462.315 0.929 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1806341724 FXYWROYCEVCOJC-VQIMIIECSA-N 487.420 0.603 50 20 JCGD N=C(N)SCCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807122644 STDDQJQZNSYVHN-QFBILLFUSA-N 455.349 0.098 50 20 JCGD N[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccccn1 1807362462 HEGNCMPTPISXHS-COPCDDAFSA-N 459.315 0.176 50 20 JCGD CN(C)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807369373 HYBFMXZRTPGJHX-XXBNENTESA-N 473.342 0.856 50 20 JCGD COc1nccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1807371100 PUGMNHBCSBYXDK-LAUBAEHRSA-N 478.289 0.938 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373995 FVDURHNIBNJLTO-PERKRYKHSA-N 466.347 0.386 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)COCCO)[C@H]1c1cccnc1 1808416132 FBZWAZNIZONDOX-QGJUGNDFSA-N 456.503 0.230 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1-n1nccn1)CC2)c1ccc(B(O)O)cc1 1815343883 UXFVXQOFDGOTKI-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD O=C(Cn1nnc2ccccc21)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350174 IDWJQRFGHZVDDC-OAHLLOKOSA-N 476.327 0.494 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)nc1 1816196407 PEXHKPHPNDFBNH-LJQANCHMSA-N 497.342 0.508 50 20 JCGD C[C@](O)(C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(F)(F)F 1817469853 FLMZBJHTNPNPKI-KSSFIOAISA-N 454.214 0.709 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817478804 HYVQODXUHPNZBD-IEBWSBKVSA-N 455.324 0.700 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnncc1C(=O)O)CC2 1819797718 HKHZLBCSZJGYHZ-VIFPVBQESA-N 482.482 0.169 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1819898458 KNPUDSKMWJRUOB-WITJGNNASA-N 472.332 0.578 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)n1 1820089622 OTQJEIRNCNDXSB-INIZCTEOSA-N 495.370 0.349 50 20 JCGD Cc1c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)cn2[nH]cnc(=O)c12 1821220771 HOQTUALHEWQYDY-CQSZACIVSA-N 492.326 0.007 50 20 JCGD O=C([C@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1827400587 XOFQDLBQMGADHY-OCCSQVGLSA-N 470.303 0.736 50 20 JCGD Cn1ncnc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828549110 VNVWDYRJAIGZMO-VGSWGCGISA-N 490.948 0.481 50 20 JCGD Cc1nc(Br)sc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830727650 ACUYNTIGQWJIFU-BDJLRTHQSA-N 482.784 0.884 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C2)C1 1831649730 BADCWMMCAMJXEB-SQGPQFPESA-N 462.927 0.345 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n1 1833338883 AKQQQLYKVKHFCG-ORAYPTAESA-N 469.336 0.893 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1833419301 COSWVUNBNNSHNK-ZYVYOHQTSA-N 487.605 0.607 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCCNC4=O)CC2)CC1 1835515741 LVXWZLMRQUVQAR-QGZVFWFLSA-N 480.997 0.456 50 20 JCGD Cc1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737885 LLLKWVMYDCRBEM-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD O=C(c1ccc2cnccc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930247 FILGHPYIRDOZQW-RUZDIDTESA-N 475.310 0.298 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937469 YKLTYMVBQRHRGL-AREMUKBSSA-N 494.353 0.004 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457757 PSPNBKUSIQXHJI-XMMPIXPASA-N 483.525 0.006 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1 1837457874 UHKUGWJDCCCOSY-JOCHJYFZSA-N 485.522 0.877 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4sccc4[nH]3)C2)C1 1837460033 ZOABKZSUXDINGZ-QFIPXVFZSA-N 484.538 0.612 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)n1nc(C)ccc1=O)CCO2 1837658991 JMKBAPJAQACEQO-IIBYNOLFSA-N 454.955 0.761 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920206 RBDORGFUYNVYIB-QGZVFWFLSA-N 459.352 0.780 50 20 JCGD O=C(CCc1ncc[nH]1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837921087 YJCREYJXTZFMRM-UHFFFAOYSA-N 454.336 0.335 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CNC(=O)c3ccco3)CC2)CC1 1837963837 NVNOMCPYMGGFBI-UHFFFAOYSA-N 477.562 0.381 50 20 JCGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1838023347 WLSVPVZHHBGXGN-CQSZACIVSA-N 486.302 0.115 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C)nc1C)CCO2 1838359195 DKMFNGOWWUTDRD-JZZXMACJSA-N 482.541 0.902 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1 1838529300 VQOZYANPYFWGQU-LIRRHRJNSA-N 456.337 0.486 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1839145574 MPVIBWFKZHXWEY-DFUKUNQBSA-N 453.923 0.926 50 20 JCGD O=C([C@@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1 1839199855 XBROGSNPYATYMZ-SQGPQFPESA-N 470.339 0.848 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839743776 SXFTYKVAEVUKEI-BPNKPRMTSA-N 497.520 0.763 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1840151371 ZXOGYYOZGSQLOE-HZMBPMFUSA-N 464.796 0.052 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C3CC3)C2)C1 1840152691 PVUBLSMCHAXHOV-JLHGSKIFSA-N 489.997 1.000 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1 1840498529 PHPGADJSPXKPJP-VQIMIIECSA-N 456.337 0.960 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc([N+](=O)[O-])c1OC 1843014699 QIXNBOFPBDSGGL-UHFFFAOYSA-N 469.259 0.423 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nc3ccccc3n(C)c1=O)C2 1843415973 KLOYGJRXTJGNKP-JFLMPSFJSA-N 475.509 0.885 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)csc2n(C)c1=O 1845014309 SZBPIISTSXESGO-CYBMUJFWSA-N 487.351 0.735 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ncn3nc(N4CCOCC4)ccc13)C2 1846361926 WXLDTVLGDDMHMS-HNNXBMFYSA-N 462.938 0.637 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1=C3c4ccccc4C(=O)N3CC1)C2 1846385276 LBSHFWLLGGPDOM-UHFFFAOYSA-N 451.527 0.834 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c([N+](=O)[O-])c1 23391938 YQSQARJIWHEOQS-UHFFFAOYSA-N 458.474 0.477 50 20 JCGD CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2C[C@@H]1C 28679663 CXGFCLLXTNLRFL-LBPRGKRZSA-N 465.557 0.901 50 20 JCGD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c1 28808832 LXZZEHGDZHITLT-UHFFFAOYSA-N 460.262 0.974 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1 725740679 GIMWPGIVXOEYHE-UKRRQHHQSA-N 450.517 0.607 50 20 JCGD CN(C)N(C(=O)CCNS(=O)(=O)c1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1 728180817 YOJBJZBIXLVZJH-ZDUSSCGKSA-N 468.395 0.610 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNC(=O)c3ccc4c(c3)OCO4)cc2)CC1 728213279 IDZFSIVXWPNTGE-UHFFFAOYSA-N 475.527 0.225 50 20 JCGD CC(C)(C)NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1 746519517 IGBDBSNLDUXHRY-UHFFFAOYSA-N 457.516 0.955 50 20 JCGD O=C(O)c1csc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 747849172 XRTXJZJMYLWLQC-UHFFFAOYSA-N 459.527 0.854 50 20 JCGD CNS(=O)(=O)c1cccc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 915938565 BRKZIONTEYVFJJ-UHFFFAOYSA-N 480.568 0.770 50 20 JCGD Cc1ccc(C)c(OCC(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c1 916516002 BRCMLFKQYYSEQP-UHFFFAOYSA-N 490.586 0.560 50 20 JCGD Cc1csc(CCNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 916573471 PQTIEPTYEWYFRW-UHFFFAOYSA-N 481.600 0.978 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)c1 916645107 CMLVAUXVLQQSTD-UHFFFAOYSA-N 483.572 0.001 50 20 JCGD CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 917901054 NMBOULCYDRQZLC-UHFFFAOYSA-N 498.558 0.983 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCn1cc(C)cn1)c(=O)n2Cc1ccccc1 918537397 QULPBRKBIZHIPG-UHFFFAOYSA-N 478.513 0.171 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C 920290685 NITNQHZYCJXGME-YCHCUCNZSA-N 450.561 0.981 50 20 JCGD O=C(COC(=O)c1ccc(CN2C(=O)CCC2=O)cc1)NNC(=O)[C@H]1COc2ccccc2O1 921181099 AHEFVFHMJPCSKL-GOSISDBHSA-N 467.434 0.480 50 20 JCGD Cc1nc[nH]c1CSCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779287735 MRCDTBVIEOVHNF-NFBKMPQASA-N 486.403 0.459 50 20 JCGD CC(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)n[nH]1 1780154801 MDCLAPDNEAMUAL-NFBKMPQASA-N 454.336 0.654 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780774825 NJWPDHSEVTZMFW-ZOMKSWQUSA-N 452.321 0.342 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1)NC(=O)NCc1ccccc1 1780969302 KUHRSHOCCDBOHE-RUZDIDTESA-N 496.568 0.506 50 20 JCGD C[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)O1 1780969337 XNQCXAKSTLLRIQ-DRMXPCRNSA-N 473.574 0.730 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(=O)oc1)CCO2)NC(=O)NCc1ccccc1 1780970268 SQYYIPOVQFEOLY-DEOSSOPVSA-N 483.525 0.430 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1783538117 UAELNMKERUKQCM-CKFHNAJUSA-N 478.384 0.875 50 20 JCGD COc1ccc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(F)c1 1783658714 VUXNXIVVCZZHBS-JURIHQFCSA-N 483.500 0.990 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(c4ccccn4)CC3)C[C@@H]21)[C@H](O)CCl 1784093350 XMJQORPPKSGZLP-OKYOBFRVSA-N 450.967 0.877 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CS(C)(=O)=O)[C@H]2C1 1784525055 UVUNMLDVHNKYRC-QTVXIADOSA-N 453.399 0.820 50 20 JCGD O=C(CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)Nc1ccccc1 1786978803 XMUPCUSOZZKSMF-VJBMBRPKSA-N 493.369 0.769 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]21)c1cccc(B(O)O)c1 1786986927 WKIQSSYDUBZHHN-AFRXPDRBSA-N 479.298 0.581 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1 1788763697 POKDAGLIMIMEOB-JKQORVJESA-N 459.616 0.661 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])C[C@@H]21 1791290608 AUERTTHFFJMDDW-QSFXBCCZSA-N 490.561 0.627 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1cccnc1 1792975762 XISAVDCVRLRTKC-ADHGMGHFSA-N 482.965 0.837 50 20 JCGD O=C(/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr)NCc1ccco1 1795115922 UZCRFRBCVKYLGI-GFYLOJAKSA-N 454.321 0.827 50 20 JCGD Cc1nn2cc(CC(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)nc2s1 1796188007 SZNYQEJKOJHTNP-VBUUOAMHSA-N 453.333 0.274 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1 1796188464 KBRKHYZGEDCIOH-GGPHIMKMSA-N 466.303 0.906 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccccc2n1 1796824822 MWLLVRDBSUEOHI-IHBLFXCCSA-N 463.498 0.672 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)cnc2s1 1797602246 NTUVQQUSIOKEIM-BTTYYORXSA-N 481.538 0.629 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)N1C[C@@H]2C[C@H]2C1 1797636723 WDIFOULFKQULHG-XYJUKOTESA-N 498.628 0.262 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800369598 YOCMKYGXOLYIDT-HCBXPFHNSA-N 454.307 0.588 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1)n1cnnn1 1800437052 UJGRYEAHHHUPQQ-SOVHRIKKSA-N 477.363 0.830 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2 1800639808 NJLQSWATTVVLOZ-AICCOOGYSA-N 478.384 0.635 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(Br)ccc1O)C2 1801012801 YFYQPOHPIXUINH-USGNIVHTSA-N 497.390 0.660 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc(C)c1O 1801700856 UYCDASWCCIRNKW-HGKCTWBKSA-N 453.499 0.525 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCS(=O)(=O)c1ccccc1)C2 1802333464 TWGUYGNKJJANET-BCDXTJNWSA-N 464.588 0.862 50 20 JCGD O=C(CN1C(=O)CNC1=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1 1804094857 VESNUXRYUZHTOZ-CQDKDKBSSA-N 456.272 0.330 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370413 CZZPPKPHMUFGPQ-HTAPYJJXSA-N 470.298 0.666 50 20 JCGD CC(=O)N1CCN(CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Br)[C@@H]2c2cccnc2)CC1 1809669632 ATJIZAUTZYQZRE-QXAKKESOSA-N 484.370 0.942 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)CC2)C1 1809978867 WHTCFFOTHLFVMZ-XMMPIXPASA-N 477.326 0.946 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CS(=O)(=O)N2CCCC2)[C@@H]1c1cccnc1 1813030559 JJCRJCYRELABRM-JENIJYKNSA-N 472.995 0.767 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C[C@](C)(O)CC(=O)O)[C@@H]1c1cccnc1 1813073599 KTBRZBWAORFCBI-USCONSEESA-N 463.535 0.076 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@@H]1CCc2nc[nH]c2C1 1813324249 QCDGOYNXTYWWJS-ICPLQIHGSA-N 473.342 0.609 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C2CN(C)C2)[C@@H]1c1cccnc1 1813608088 ONNLNRLSKDZNFP-ZXRGJLGVSA-N 451.531 0.783 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)CC1 1814871370 ODEIKQRUFQLERA-GJZGRUSLSA-N 461.972 0.673 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348272 KGBLMAUUDJHYTQ-XJKSGUPXSA-N 493.354 0.262 50 20 JCGD COc1nccnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1816157358 LZIQQWUALVXXNM-INIZCTEOSA-N 450.264 0.508 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3Cc4ccccc4CN3)sc2C1)c1ccc(B(O)O)cc1 1817138674 MORQPCZAGHPZRG-UYAOXDASSA-N 476.367 0.763 50 20 JCGD N[C@@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cccnc1 1817405654 NEFCDAXMOPGOMV-AZUAARDMSA-N 462.319 0.881 50 20 JCGD CCOc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nn1 1817472206 ASVATLFGNVFXBE-SFHVURJKSA-N 464.291 0.898 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1CC[C@H]2CCC(=O)N2C1 1820758628 KJNPMFGLXOJKHB-KPFFTGBYSA-N 479.346 0.796 50 20 JCGD COCCn1nccc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826086204 MKNJXAXPYUCZAX-CYBMUJFWSA-N 463.564 0.585 50 20 JCGD Cc1c(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn2[nH]cnc(=O)c12 1826087395 AQUCMXKZYVULMB-LBPRGKRZSA-N 486.558 0.386 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1826719213 GGWHWIGQZCDPFE-HSZRJFAPSA-N 470.423 0.237 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](C)n3cnnn3)sc2C1 1826977002 RAPXFVJKRSAZRG-UFTMPCDOSA-N 470.519 0.437 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050218 ITNYSKAAGJWBJE-FQEVSTJZSA-N 464.331 0.407 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)N1C[C@H]2C[C@H]2C1 1827052399 YAEZMOSPHDAZAJ-PIBIMKELSA-N 453.392 0.940 50 20 JCGD CC[C@H](O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828532279 GOEBLCZVLUTDCO-NPPFBWRTSA-N 467.950 0.809 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(OC)c1C 1830738956 WEDYFYSTBTZOQD-IIBYNOLFSA-N 456.923 0.682 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1)[C@H](O)CCl 1833310882 XKMASRLMOKXQPV-HXUWFJFHSA-N 475.977 0.951 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1 1833452032 RJFGRPFSHJUQAV-INIZCTEOSA-N 476.716 0.737 50 20 JCGD O=C(CNCP(=O)(O)O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1834666389 PMHRNVXPJPUDSZ-UHFFFAOYSA-N 469.317 0.068 50 20 JCGD N#Cc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834801332 YLFWYXVAMGRGAT-UHFFFAOYSA-N 460.343 0.737 50 20 JCGD CC[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1 1835939617 BTANXTVTGIEURR-KHCICDEESA-N 458.364 0.653 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccnc3)CCO2)C1 1836154505 PNXWPIKZYDIFQW-NWJFTTBMSA-N 468.514 0.215 50 20 JCGD O=C(c1nc(-c2ccccc2)ns1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836249886 MTKUBHOIJBWZOB-YWZLYKJASA-N 466.947 0.875 50 20 JCGD CC(C)c1nc(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)no1 1837133430 GKULLQYUYXZGRM-UHFFFAOYSA-N 484.362 0.728 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)COC3CCCCC3)C2)C1 1837456033 HSVMXARWYAXHON-HSZRJFAPSA-N 475.546 0.104 50 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WPYPLAGASZDUCD-HORZDZNUSA-N 459.547 0.365 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839155232 OTQNKOUOKYZSJC-ZWKOTPCHSA-N 453.367 0.052 50 20 JCGD O=C(NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1ccc[nH]1 1839199359 VDWALKSUACQUET-QAPCUYQASA-N 475.315 0.282 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201927 NUZXLSRNSACDBA-FUHWJXTLSA-N 470.299 0.419 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c([N+](=O)[O-])c1 1839462440 SHVZRVPLZJQJCS-KXBFYZLASA-N 473.841 0.986 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839694336 KIULOMQMEQRSJR-FQEVSTJZSA-N 457.358 0.644 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn2[nH]cnc(=O)c12 1840034303 HQDWDEMGWIMNOJ-BFUOFWGJSA-N 482.335 0.184 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1840036644 SFWZILMOBBHLJZ-ZBEGNZNMSA-N 480.406 0.087 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(O)c3)CCO2)C1 1840060968 VEHZYHCKBAOLAR-JTSKRJEESA-N 498.964 0.989 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)c(O)c3)C2)C1 1840149476 QNTWNLZYFUKSIK-IERDGZPVSA-N 456.923 0.654 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1840151265 XIVBCHLXWJMTCC-IFXJQAMLSA-N 459.952 0.188 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1840153059 BMNFOXFIPZYOKB-OPAMFIHVSA-N 480.949 0.050 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](NC(C)=O)c3ccc(F)cc3)C2)C1 1840154277 RHCKMJDFMSMLAN-KNKQGSTJSA-N 485.940 0.713 50 20 JCGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cc2csc3c2c(=O)n(C)c(=O)n3C)C1 1845014508 OXUQUBIABANFKN-ZDUSSCGKSA-N 468.963 0.298 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)C(=O)c1cccn1C)C2)NC(=O)NCc1ccccc1 1845039543 ZTBBWSRTEJUFPO-UHFFFAOYSA-N 466.542 0.757 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(Cl)ccc1NS(C)(=O)=O)C2 1846385698 KIYLVPZWXKVPLV-UHFFFAOYSA-N 485.994 0.902 50 20 JCGD CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1 725872680 QGALZZSLIHYCFT-UHFFFAOYSA-N 477.543 0.802 50 20 JCGD CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1Br 729181032 OVQGHMCYXSMOOQ-UHFFFAOYSA-N 473.305 0.483 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2cn(-c3ccccc3)nc2-c2cccnc2)c(=O)n(C)c1=O 730569367 WWUCFUAWDWNWGR-UHFFFAOYSA-N 476.522 0.969 50 20 JCGD C[C@@H]1CN(C[C@@H](C)C(=O)NNC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)C[C@@H](C)O1 747725862 RVJMMWNUENATTM-BRWVUGGUSA-N 499.659 0.770 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)ccc1Cl 822755076 DDBZPRZJKMNHFD-UHFFFAOYSA-N 492.988 0.908 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1)NNC(=O)c1cccs1 825467591 AIVUWDNNLBHPAF-CQSZACIVSA-N 467.525 0.823 50 20 JCGD CCN(CC)C(=O)CSc1nnc(SCC(=O)NNC(=O)c2ccc(C)cc2)n1N 843400109 XZAWDHGDJMXIHF-UHFFFAOYSA-N 451.578 0.814 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)NC2CCN(CC(=O)NC)CC2)c2ccccc2c1=O 916516841 MNIXVQYOEMHTRC-UHFFFAOYSA-N 471.562 0.741 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(F)cc3)CCO2)C1 1779031844 ZXWOMAGJFSIBKV-JOCHJYFZSA-N 457.462 0.347 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3cc(F)ccc3n2)C1 1779031885 LTGHHSUYAYQEBQ-WZONZLPQSA-N 474.537 0.974 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3cccnc3nc1O)CCO2 1779036615 BSKZYPOQEJFYHX-QHCPKHFHSA-N 477.481 0.091 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Cl)cn1 1779665410 STFVEODDUTUCSM-DENIHFKCSA-N 457.723 0.856 50 20 JCGD Cc1c(Br)c(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nn1C 1780368299 IHJOINYIQDMULI-LJQANCHMSA-N 485.383 0.308 50 20 JCGD CCC1(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)COC1 1780969067 UQVSGIHWCVFCIP-XMMPIXPASA-N 473.574 0.589 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1781056086 WQIYVVDUIUGVBI-BYUXIZHISA-N 489.573 0.644 50 20 JCGD CC(=O)NCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783023002 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CZYZMVUHUXZQAK-CXOVXGEYSA-N 464.357 0.593 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3C(=O)C=CC3=O)C[C@@H]21 1790958119 IYHMGSRUTDUJCW-AJNGGQMLSA-N 456.337 0.455 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C[C@@H]21 1791255570 VGLSZKGLISSKJY-QYRAFCHESA-N 451.907 0.955 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(-c4ccccn4)nc3)C[C@@H]21 1791288554 DPCKRTBZGDSTGR-QRFRQXIXSA-N 481.557 0.505 50 20 JCGD COc1ccc2c(CC(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)c[nH]c2c1 1795732771 HUVZPCRMEFXBDR-MRSFGVLCSA-N 477.326 0.302 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1Cl)C2)c1cccc(B(O)O)c1 1795737179 ASQRRZRRADLNPC-VPTLXERWSA-N 460.698 0.605 50 20 JCGD Cn1c(=O)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)nc2ccccc21 1797521137 RZZJWOSIMXBZBT-QDMKHBRRSA-N 475.509 0.498 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc[n+]([O-])cc1 1798360061 JMCLXJQOPUUMIA-YVSFHVDLSA-N 468.938 0.655 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(CO)on1 1798730208 RLJKYJCHAWIKON-VZAMPYOESA-N 472.926 0.502 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc[n+]([O-])cc1)NC(=O)NCc1ccccc1 1799046072 LTRARGZAPYWWCC-WKCHPHFGSA-N 466.542 0.918 50 20 JCGD Cc1cc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)no1 1799097701 UPANQLWEPPUKTL-QCBJBGFGSA-N 496.568 0.932 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1800170889 UBEHSBJAWXVMNJ-RLDMLVQMSA-N 472.970 0.748 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1800738894 SLKDHQKEHGYJEH-UNPPPGBBSA-N 471.982 0.823 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801017308 LCZIBJNHAFQLRM-RNJOBUHISA-N 454.351 0.655 50 20 JCGD CC(C)(C)C(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1801918549 KPOMAXOEYDCKMQ-HATOLVCRSA-N 493.369 0.868 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnc(OCF)cn2)[C@@H]1c1cccnc1 1805034388 PSXOAYMYARBCMG-KKSFZXQISA-N 473.509 0.870 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1807028319 JGPDUDRKMWMSPY-NJZAAPMLSA-N 463.269 0.596 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375180 PSEBVOOOKBSKET-XXBNENTESA-N 464.331 0.094 50 20 JCGD CCc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1C 1807375872 QLXYKHLCGOPDOI-PGRDOPGGSA-N 461.331 0.691 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnn2ccncc12 1809386781 QIPYRQQRTUMTNY-GCJKJVERSA-N 470.298 0.438 50 20 JCGD CCOc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)nn1 1809978059 SOTYLFYOXYOYHG-UHFFFAOYSA-N 452.320 0.714 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1 1810303262 RLSQYSRRWFYQCB-KKSFZXQISA-N 490.524 0.902 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCN2CCCC2)[C@H]1c1cccnc1 1810307728 HGBRQMWSUSGKNQ-AVRDEDQJSA-N 465.558 0.886 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C(=O)CNC(=N)N)[C@@H]1c1cccnc1 1811362124 WYOJQXSWAHFKMQ-FOIQADDNSA-N 483.485 0.718 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1812773175 ANYPOTXALWJMAV-GRDNDAEWSA-N 466.336 0.813 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813070086 GCFHRKUJWMUVQS-GCJKJVERSA-N 471.562 0.617 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1814124319 QKPDRWZQDWQPEB-HJNYFJLDSA-N 466.347 0.386 50 20 JCGD C[C@](O)(C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(F)(F)F 1815337108 MXTHBEGHDHOCEO-DIFFPNOSSA-N 457.239 0.362 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362009 YHCMHKDHBGJQNO-MLGOLLRUSA-N 453.333 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cc(Cl)cn3)sc2C1 1815409028 ITPMWKCIHNNFAK-LLVKDONJSA-N 474.934 0.918 50 20 JCGD CCC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816668577 LBRARBGFJJRIBL-BDAKNGLRSA-N 450.912 0.902 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CS(C)(=O)=O)CC2 1817280408 VHTAFHQUJSDFNE-QQUGTJAQSA-N 466.545 0.234 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)n1ccccc1=O 1817472039 DLRRZTFIMZUHJW-KXBFYZLASA-N 463.303 0.818 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1 1819029979 POGFKMOVDLUEDJ-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)COCCO)sc2C1)NC(=O)NCc1ccccc1 1822991727 KRPYXTCDJGXNJQ-MRXNPFEDSA-N 490.586 0.410 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1 1824186210 PFAZFQDLURNJPH-QRVBRYPASA-N 453.971 0.676 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826083971 WQEGOKFULSUADM-ZDUSSCGKSA-N 452.581 0.590 50 20 JCGD O=C(NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccc[nH]1 1827050374 PKONNXTXRYWYCJ-JOCHJYFZSA-N 480.374 0.748 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CC1 1827544367 DOCHJDVPKISMCI-RBUKOAKNSA-N 497.637 0.865 50 20 JCGD N#CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1828806481 UXVWREBEZPMEQT-RUZDIDTESA-N 490.325 0.346 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(Cl)nc1)CCO2 1829518715 IJLQNEOMGXUYBZ-WMPMWDHYSA-N 489.920 0.334 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(C)c1C(=O)O 1830735723 MGFDETLBVRVYQT-IERDGZPVSA-N 454.907 0.671 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](F)Br)CC1)C(=O)C(=O)O 1831166343 CFOKMBWFXDQQBM-OCCSQVGLSA-N 450.305 0.840 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccn3)C2)C1 1832549253 JRFVJRKWURYRPW-YCRPNKLZSA-N 483.953 0.679 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)Cn1cc([N+](=O)[O-])cn1)CCO2 1832795908 HVYFMAKTHZHUTM-INIZCTEOSA-N 460.285 0.033 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCc3cccnc3)CC2)CC1 1835736688 BLUQRHNFXVLVGP-UHFFFAOYSA-N 479.585 0.898 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)c3cc(C)on3)CC2)CC1 1835773561 SGOLXTMWWDJKGO-KRWDZBQOSA-N 469.970 0.538 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3c(Cl)cncc3Cl)C2)C1 1835926247 JBIAXWKVWGONCX-NRFANRHFSA-N 494.140 0.452 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3c(Cl)cncc3Cl)C2)C1 1835933939 KEHMKTUQERZCIO-OAQYLSRUSA-N 494.140 0.452 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939677 DMTCOVLUONMZSV-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD Cc1ccc(OCCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837457027 VWCSLHGDTQRCMT-RUZDIDTESA-N 497.552 0.533 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1 1837458833 FFZGQYAJWVNLCH-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD Cc1ccc(O)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1838893098 RQZFRDFYJKMPLT-HSZRJFAPSA-N 469.498 0.083 50 20 JCGD CCNC(=S)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839154945 DAISRRVKUJTZAA-SJORKVTESA-N 455.408 0.163 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1 1839351789 QLBZCMRPRUJFEY-YJYMSZOUSA-N 454.321 0.639 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839652270 WHNRCYIZRAHRJR-MOPGFXCFSA-N 461.346 0.808 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1840033588 KHEWEAVIYAVCLK-FZKQIMNGSA-N 457.325 0.519 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)s1 1840182631 OPQFHEMAXRBECJ-QFIPXVFZSA-N 466.604 0.819 50 20 JCGD COc1ccc2cc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)[nH]c2c1 1840184531 SDMSAOFXDWYNFR-DEOSSOPVSA-N 487.557 0.620 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)CN2C(=O)CNC2=O)C1 1841848932 VZFFWIVLRJOUGU-HNNXBMFYSA-N 463.332 0.748 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2 1843415543 WRLOBPMSKBTPNK-HWDKICEFSA-N 481.513 0.330 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1 1846384611 MIQPXNZYRNSMLJ-UHFFFAOYSA-N 450.561 0.345 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846951868 XZLOEKFOTLNEOG-KRWDZBQOSA-N 477.392 0.440 50 20 JCGD Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)cc1 9931190 XHFQPPHHBHEKQK-OAHLLOKOSA-N 451.526 0.992 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1 17329756 FJDKBNQTXWUNKH-UHFFFAOYSA-N 451.461 0.248 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cc(-c4ccccc4)n[nH]3)CC2)cn1C 109616994 JETCVGATSZTCKT-UHFFFAOYSA-N 471.543 0.981 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 725741841 ULWBIYROUPMUKE-AWEZNQCLSA-N 466.541 0.396 50 20 JCGD CCCc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1 725872864 SRVPVDHTTRRMKG-UHFFFAOYSA-N 477.543 0.709 50 20 JCGD CS(=O)(=O)NCCNC(=S)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1 727082857 VHOAUVICYXXKAX-IBGZPJMESA-N 461.613 0.658 50 20 JCGD Cn1c(=O)nc(O)c2cc(S(=O)(=O)NNC(=O)c3ccc(Br)s3)cnc21 728502712 AWFNJAZQXAXJFC-UHFFFAOYSA-N 460.291 0.481 50 20 JCGD CS(=O)(=O)N1CCN(CCNC(=O)NNC(=O)c2ccc(Br)cc2Cl)CC1 728954611 RSMGLCLJIQUMBQ-UHFFFAOYSA-N 482.788 0.624 50 20 JCGD Cc1c(C=NNC(=O)CSc2nnc(O)nc2O)c(=O)n2c([nH]c3ccccc32)c1C#N 730558590 LNMOBVKWEABRSL-UHFFFAOYSA-N 450.440 0.800 50 20 JCGD COC1CCN(C(C)(C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 730908458 ZTUAOYSMLCGZCZ-UHFFFAOYSA-N 497.618 0.541 50 20 JCGD CC(C)(C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc(C(N)=O)o2)CC1)c1ccccc1 731221238 HPHUIULJJDFCTM-UHFFFAOYSA-N 463.516 0.403 50 20 JCGD COC[C@H](C)n1c(SCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nnc1-c1ccccc1 751361563 KMIDRRVFVSQIAO-ZFWWWQNUSA-N 482.588 0.762 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 913416375 BFGJKBDODHLOBK-KRWDZBQOSA-N 463.468 0.129 50 20 JCGD C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1 913463209 WMRTZRFOHFICFI-MRXNPFEDSA-N 455.523 0.035 50 20 JCGD Cc1cc(C)cc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)c1 914457858 XYJFDGSYXIYNQT-UHFFFAOYSA-N 460.512 0.264 50 20 JCGD Cc1ccc(C(=O)NCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1F 916272349 OCZKYMMBQPOQIA-UHFFFAOYSA-N 465.507 0.758 50 20 JCGD COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(CC(=O)N(C)C)CC2)c1C 917230984 QJXQLDCIALPVGH-UZQMFHLOSA-N 473.574 0.995 50 20 JCGD O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O 918552036 JVMHFPBFBFDXNM-KDOFPFPSSA-N 487.490 0.611 50 20 JCGD COc1ccc(CCN2C[C@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)cc1OC 933545355 VVTVFASMTFFHMN-MRXNPFEDSA-N 493.520 0.803 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@H](C)n1ccnc1)N(S(C)(=O)=O)CC2 1115900591 OIHARRQWCHGZFQ-BBRMVZONSA-N 465.532 0.558 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1778264598 SUHIUTKEUSTZDC-RUZDIDTESA-N 464.327 0.378 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ncccn3n1)C2)[C@H](F)Br 1780773733 UYUYJXCWHMJPPZ-BWACUDIHSA-N 455.288 0.942 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2)NC(=O)NCc1ccccc1 1780969847 KIDMRXQAMBRADA-PXNSSMCTSA-N 455.918 0.697 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)Cc3ncccn3)CCO2)C1)NC(=O)NCc1ccccc1 1780970412 XVGRFDYDYYACFH-DEOSSOPVSA-N 481.557 0.195 50 20 JCGD O=C(Nc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1)C1CC1 1781466115 JTKJRKSXNMTPQW-RUZDIDTESA-N 477.326 0.472 50 20 JCGD CC(=O)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1781793541 YOKVSQWLGPJLPO-GULKHOJOSA-N 460.535 0.161 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@H]1NC(=O)NC1=O)C2 1781901531 PDVDGEFNAVSIQP-ZVZLLHMNSA-N 459.341 0.272 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccc(F)cn3n1)C2 1782213388 OHJIMDZFFFTQII-OPAMFIHVSA-N 475.525 0.369 50 20 JCGD O=C(CN(CCO)CCO)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783021605 DSSUNYGUJOQWQA-KNQAVFIVSA-N 498.418 0.109 50 20 JCGD CS(=O)(=O)CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783021908 DULARQCMXCIRBB-QFBILLFUSA-N 473.389 0.867 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1783349471 MELUWTAHPUNNHR-ORAYPTAESA-N 468.352 0.634 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnc[nH]3)[C@H]2C1)NC(=O)NCc1ccccc1 1787418278 BUNCQOAYCLSDHV-JBACZVJFSA-N 483.573 0.278 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(N4CCOCC4)cc3)[C@H]2C1 1787547003 MPJUFINSKOQMOC-BVSLBCMMSA-N 487.601 0.490 50 20 JCGD Cc1nc2ccccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1787849062 QDHSQIPGCVVXJH-BZSNNMDCSA-N 456.547 0.609 50 20 JCGD CC(=O)Nc1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1792000475 JRYQTTKGXNDMLV-XJABCFGWSA-N 465.315 0.232 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1792484274 KTYXMSAFPKVGJV-XCQGWFOSSA-N 484.981 0.567 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@H]1NC(=O)NC1=O)C2 1794141010 CRXFNBDQUREOSM-ITGHMWBKSA-N 471.942 0.355 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(C)(C)C)n1 1794417838 SSJHCASVLMGABO-LLJCUJCISA-N 469.546 0.975 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C)c1 1794752089 POHRUUCVCQEHIZ-CCWDJLKJSA-N 457.443 0.771 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1 1796139831 RYEOECNWIPRHPU-VTEUUUEMSA-N 486.437 0.843 50 20 JCGD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[S@@](=O)c1ccccc1 1796192958 FLLPKXQSEXXNGU-ILDDHWCASA-N 454.357 0.815 50 20 JCGD COCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C 1796907971 KWHWRSFUNVAPGS-YRPNKDGESA-N 489.378 0.087 50 20 JCGD CCOC(=O)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)ccn1 1798439841 JYEQAWGNMBRTDO-MUJYYYPQSA-N 466.498 0.822 50 20 JCGD CC(C)(C)OC(=O)N1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)C1 1798440635 USSWIKUPZBLKJF-MUJYYYPQSA-N 472.546 0.804 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)CN)C2 1800333614 AXHCGNGBGZSQNM-PQUOWXTFSA-N 462.348 0.232 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C)C2 1800970913 MTSAFRRRVNVMBL-NNXHMXCWSA-N 475.970 0.466 50 20 JCGD COc1cc(Cl)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1801808733 XDOBORKAVRNIQG-CWPLJXCYSA-N 458.707 0.545 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1802088339 YQZWNWLFUACZJZ-YVECIDJPSA-N 482.361 0.836 50 20 JCGD COC(OC)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1803347386 FXKNJCKNMJLIAU-WIJDIZFFSA-N 456.503 0.840 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)CC1 1804585946 PEVVHCJNZYOAMQ-BCDXTJNWSA-N 457.336 0.676 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1F 1805150168 MBHYIVWHTLJTGK-OXJNMPFZSA-N 459.526 0.955 50 20 JCGD CCn1nc(C)cc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807984788 XCBJRCPDLHLMCQ-UGKGYDQZSA-N 461.331 0.920 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994164 QMURBCKICBSFIX-HRAATJIYSA-N 462.271 0.201 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C#CC(=O)O)[C@H]1c1cccnc1 1808416346 NKMAWJQHJYWEPS-OMSYZAOGSA-N 450.455 0.309 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)C(C)(C)C 1809967522 KCONXPWWVBRRHL-FQEVSTJZSA-N 457.380 0.762 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810301996 FPYQPINDXRARJE-LPHOPBHVSA-N 477.529 0.886 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1812366386 SSNCYKDCKLZGDR-OGWOLHLISA-N 484.513 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(=O)nc3cccnn23)[C@@H]1c1cccnc1 1813072196 BCWCYYUCBMDZNB-UZUQRXQVSA-N 492.540 0.177 50 20 JCGD O=C(/C=C/c1cnccn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813483803 XANXVOVBDLOVRJ-HJCKOOHDSA-N 457.299 0.584 50 20 JCGD Nc1c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)sc2nccnc12 1815253154 URQNZUCSJLFHFF-LBPRGKRZSA-N 494.367 0.949 50 20 JCGD O=C(COc1ccc(O)cc1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336020 XJKYPWKOMSPFBX-OAHLLOKOSA-N 467.312 0.833 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1CCc2nc[nH]c2C1 1822687902 XEIIVECSBQMNTI-XOBRGWDASA-N 462.319 0.924 50 20 JCGD CC(=O)N1CCN(CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)CC1 1823007805 PNDBNXPDNSNNFZ-ABAIWWIYSA-N 476.372 0.910 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@@H]1NC(=O)NC1=O)CC2 1825441383 UOVLLXKOLSXVPQ-NRPADANISA-N 458.338 0.827 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)CC2 1826000139 MMZSOGUPNJKJIE-OLZOCXBDSA-N 479.024 0.981 50 20 JCGD CCCNC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055519 AVDBNUYVVAKVOE-OAQYLSRUSA-N 457.380 0.906 50 20 JCGD O=C(c1cnc(O)nc1O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059838 XARWHJLUMMIOBP-GOSISDBHSA-N 454.292 0.115 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830353668 JJNMKSNWOKPRFA-BTYIYWSLSA-N 477.986 0.593 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(C)C(=O)CC3)C2)C1 1830535858 VIJOVPHHOUGBEX-FZKQIMNGSA-N 459.341 0.082 50 20 JCGD Cn1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)c1 1832549080 DKDMUPVGGFGJOF-BTYIYWSLSA-N 485.969 0.622 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4c3CCCC4)CC2)CC1)c1cccc(B(O)O)c1 1834800181 XABBUHORWCPILP-UHFFFAOYSA-N 479.390 0.467 50 20 JCGD COc1cnc(C(=O)N2CCC(N3CCC(NC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CC3)CC2)cn1 1835118343 RUZJRNQVXSPIMN-MUFRIFMGSA-N 496.572 0.804 50 20 JCGD CC(C)[C@@H](S)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835734676 PANVZVXRKGHBRH-LJQANCHMSA-N 462.620 0.825 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccnc(Cl)n1 1835909265 HHQVYWBXIFPNLL-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930498 JLLHJDAWLFTVTK-XMMPIXPASA-N 486.450 0.488 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N3CCN(C)CC3)CC2)CC1 1836372910 LWYCSZVNUXAZST-IRXDYDNUSA-N 472.472 0.977 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4=O)CCO2)C1 1837139741 GWKWODIIMFVJOQ-QVKFZJNVSA-N 465.890 0.145 50 20 JCGD Cc1cc(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1F 1837460298 ABTUZFMUHUMBRH-HSZRJFAPSA-N 489.479 0.656 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)s1 1837460473 GRCTYSGFIVMVKL-ZZTDINLMSA-N 486.554 0.233 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)nc1Br 1838378066 ZOPDDCSHZKEILM-UGSOOPFHSA-N 492.754 0.522 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)nc1 1839053780 XAJNAVOGGYCSJG-DEOSSOPVSA-N 491.589 0.377 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199667 ZJJBIXZKXQWGCW-FUHWJXTLSA-N 470.299 0.578 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)c12 1839556742 NXWRXPBKMGOAJV-KKSFZXQISA-N 451.907 0.846 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3cccc(Cl)c31)CCO2 1839740552 QNEMBFTWPWNVBQ-CPJSRVTESA-N 498.772 0.820 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCO1)CCO2 1840014438 FMGFYWZGECJZHY-UGKGYDQZSA-N 477.470 0.769 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1840033850 SFYIBGNZFYJGDJ-YJYMSZOUSA-N 471.352 0.778 50 20 JCGD CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840087725 OQQJDQDRKHEJAJ-JLHGSKIFSA-N 492.013 0.982 50 20 JCGD O=C1CCCCN1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840105369 MLONNSJCOKAXKJ-RDJZCZTQSA-N 450.305 0.146 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)C2)C1 1840182944 XEGISQIGDBLDNP-JOCHJYFZSA-N 495.508 0.106 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1 1840185137 LPFZOTABYZCYEC-DEOSSOPVSA-N 486.573 0.325 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840298976 KTHGIWCYYYREFU-CJAUYULYSA-N 481.553 0.634 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1840915781 ZXFJTEMQYZWFHW-HXPMCKFVSA-N 497.376 0.015 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1841392635 HVWSIJXSCLUONF-IBGZPJMESA-N 483.374 0.973 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264095 DCRJBBAYTGZNSE-MRXNPFEDSA-N 476.534 0.042 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCCC12CN(C(=O)CN(CCO)CCO)C2 1845873110 KPMOJQJJQNPWHN-LDADJPATSA-N 491.386 0.846 50 20 JCGD O=C(COC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)NNC(=O)c1ccccc1 10930648 YYOJGLRVOYKCHZ-UHFFFAOYSA-N 465.459 0.465 50 20 JCGD CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)COc1ccc(C#N)cc1)n2C 15888671 IRVTUBNRIAHEDR-UHFFFAOYSA-N 484.538 0.854 50 20 JCGD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1 16148398 YABRWHSPZVEPPK-UHFFFAOYSA-N 482.467 0.909 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2)c2ccccc2c1=O 17161997 WGSWZBPDNXCTHE-UHFFFAOYSA-N 457.512 0.936 50 20 JCGD CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1 26220121 HJSNMGGASKPWHS-UHFFFAOYSA-N 469.541 0.915 50 20 JCGD Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 26773468 CJBXCGCRHUXQPM-UHFFFAOYSA-N 480.506 0.506 50 20 JCGD COc1ccc(C(=O)N[C@H](C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2ccccc2)cc1 727105209 VIYCKPAICPYTCC-WMZOPIPTSA-N 460.512 0.684 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3cc(C(N)=O)c4ccccc43)cc2)CC1 728215943 MHXLYIWGTCHZOO-UHFFFAOYSA-N 470.555 0.820 50 20 JCGD O=C(NCCS(=O)(=O)N1CCOCC1)NNC(=O)c1ccc(Br)cc1Cl 728952634 PSCWOJNAWWOHQQ-UHFFFAOYSA-N 469.745 0.709 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cn3ccc4ccccc43)c2)CC1 729449853 FNZINOJSIVKBFW-UHFFFAOYSA-N 483.550 0.955 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNC(=O)C(=O)N2CCCC2)c1 748241316 VZZOXNRNXFTMPX-UHFFFAOYSA-N 469.564 0.159 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1sccc1S(=O)(=O)NC1CCCCCC1 750715585 FZPCPHHSUYUVNZ-GFCCVEGCSA-N 463.603 0.945 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c2cccs2)[C@H](C)O)cc1C 777290628 LXKWVJZNXUBUHN-GUYCJALGSA-N 469.541 0.397 50 20 JCGD C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 912642863 BFBHVFUWWCSIHC-JLSDUUJJSA-N 476.555 0.796 50 20 JCGD O=C(CN1CCCS1(=O)=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 916147767 CHFNTNIZHIFSEN-UHFFFAOYSA-N 455.500 0.185 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)N[C@H](C)Cn1ccnc1)N(S(C)(=O)=O)CC2 916623407 RKMNVRKHYYIZJA-RHSMWYFYSA-N 494.574 0.568 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1 1778087946 SRHXMQNUKKKSRM-IGMJJTELSA-N 463.934 0.969 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccncc1C(F)(F)F)CCO2 1779030804 XPYCMKSRHXYHDT-FQEVSTJZSA-N 478.431 0.856 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779295231 BIEUBHIYWDAGMP-YWZLYKJASA-N 459.616 0.553 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1780095209 JSIFJTMWRUARBH-BEFAXECRSA-N 455.851 0.563 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(Cl)cc2nn[nH]c12 1780112621 NVBYNKGNMIOWIX-AUSIDOKSSA-N 497.748 0.732 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1780202815 WESCIIYTBVKSSI-HXPMCKFVSA-N 480.319 0.905 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(O)c(F)c1 1780919885 SRSZPCTXQKALJF-NFBKMPQASA-N 456.279 0.652 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)C(C)(C)OC(=O)NC(C)C)C2)C1 1781019694 NLESHFDCBLCAIS-LRULAXNGSA-N 490.561 0.864 50 20 JCGD O=C(C1CCN(c2ccc(F)cn2)CC1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1782797255 MZMBDXFWSDSAJY-DYESRHJHSA-N 454.930 0.867 50 20 JCGD COc1ccccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1783330148 SZQZMBDIIQMRBQ-QHCPKHFHSA-N 453.499 0.380 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1783448954 OFCBVTBTQAKYCW-LRAJWGHMSA-N 457.955 0.673 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1)CCO2 1783882250 WWGMKJPEXUXRAO-RVHYNSKXSA-N 475.970 0.754 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C[C@@H]21 1783968150 QULZHFVGCCTBMS-UHXUPSOCSA-N 467.324 0.042 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC(c4ccccc4)=NO3)[C@H]2C1 1784407568 UOUMMRKXBHYEFC-QIJZPMMNSA-N 471.558 0.532 50 20 JCGD C[C@@H](C(=O)N1CC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1)n1cnnn1 1784603892 SKBINMHCTOORRJ-XTVULVGKSA-N 457.441 0.949 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(C)(C)C)[C@H]2C1)NC(=O)NCc1ccccc1 1786833372 IPACWVJUOCGKBL-ACRUOGEOSA-N 488.633 0.700 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn[nH]c4c3)C[C@@H]21 1787507754 PIGFVIIQESEXBJ-NRJQGIQSSA-N 478.513 0.685 50 20 JCGD CCn1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)n1 1787508887 OKGVSOMAGZBZSH-LVWMUPNFSA-N 455.519 0.630 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C)nc3)C[C@@H]21 1787508893 PFYJHFBRKCTPJK-KPHLYUJDSA-N 453.503 0.512 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)c1ccccn1 1788611270 QYRZKWRYLCXFDG-OFVDUGFESA-N 452.515 0.477 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3ccnn3)C[C@@H]21 1789221947 UGHLXJUNIBFVRU-VQUGOPFGSA-N 486.485 0.966 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C[C@@H]21)[C@@H](F)Br 1789924737 CWZQJTIDIXCBTB-TZQJONAQSA-N 475.271 0.427 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc2ccsc2[nH]1 1790373303 PHVMMXPOENIZJO-IEZWGBDMSA-N 453.329 0.816 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4cccc(F)c34)[C@H]2C1 1790483969 LPSJZAQXBOIWSX-ZQIUZPCESA-N 460.510 0.668 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)N1C(=O)OC(C)(C)C 1792971051 GOOWZZROYPRREY-NYXISSTPSA-N 459.971 0.964 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CC(=O)NC1=O)C2 1794141358 VYVIPMDUKPIGST-CRWXNKLISA-N 471.942 0.309 50 20 JCGD O=C(C[C@@H]1COc2ccccc2O1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188049 YVICARPXTHZUDI-IYWMVGAKSA-N 450.300 0.848 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccc2[nH]1 1796819880 DYZNIYOICTXIAF-UTRJNVLQSA-N 463.498 0.900 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754050 RARPZMYLYDZSIQ-HBCWATKFSA-N 481.488 0.297 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1N(C)C 1799209389 WSSRGEGWIRNTKC-FAQVEIGNSA-N 461.563 0.337 50 20 JCGD COC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1799427440 OLANLSJYRWVNDL-XEMDLRDOSA-N 467.287 0.062 50 20 JCGD O=C(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)Nc1ccc(F)cc1 1799790863 LXONMFAJUVZXEF-ACDBMABISA-N 453.279 0.786 50 20 JCGD Cc1cc2nnc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)Br)c(C)n2n1 1800757858 RTMNKNABXJBPMI-YGSHXTJESA-N 451.325 0.728 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1 1801012359 AEPSHCYIUYJSRU-RMFSNUHRSA-N 460.531 0.440 50 20 JCGD CC#C[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(O)cc1 1801055781 KRJQAHDARLOMMT-NAZDKBRTSA-N 476.338 0.472 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[C@@H]1c1cccnc1)[C@@H](O)CCl 1803139225 VKNPDTHDEFSWSE-YLQAJVPDSA-N 467.935 0.152 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1804608886 QSZYGUFDNCDOGZ-IYWMVGAKSA-N 487.362 0.254 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1 1805515453 PRUTZAVHJWMULT-QRQLOZEOSA-N 465.978 0.997 50 20 JCGD COc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1806039128 OXJMBSKMNMWIJG-UTKZUKDTSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2cnc3ccccn23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807363063 AIQCWDAMZLJSOS-NBGIEHNGSA-N 483.337 0.971 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364854 GYOLPUXSLLNITC-YKSBVNFPSA-N 484.325 0.366 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807368430 TUFLKGIHCUGQSP-HYBUGGRVSA-N 475.358 0.674 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(C)C 1810100336 ITINAGHLMQQLNF-HJNYFJLDSA-N 467.331 0.669 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1811498540 CFYCFTXSYMISPX-LJIGWXMPSA-N 456.927 0.530 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)[C@H](C)NC(=O)c2cnccn2)[C@@H]1c1cccnc1 1813030959 IDGVKPUBJQQSMD-LKCYJCQHSA-N 474.949 0.950 50 20 JCGD CC(C)N(C)CC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1813599189 NURVPJYSGPPYBV-LAUBAEHRSA-N 453.547 0.740 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401825 UNEFLJBAZCJMCD-QGZVFWFLSA-N 456.507 0.583 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1823436790 PBLJOCARIJNTRW-MJGOQNOKSA-N 455.324 0.700 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1826726448 MAEBYQHTISBUNT-NRFANRHFSA-N 464.655 0.617 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1827640089 NAYWMAYYHZNBOG-GOTSBHOMSA-N 464.375 0.565 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCNC2=N)CC1 1827680645 BFOQELKHUPGDLP-FQNOVECQSA-N 470.578 0.580 50 20 JCGD O=C(Cn1cnnn1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829056774 PXEXALYXMLGQSQ-FXAWDEMLSA-N 479.900 0.660 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1 1829882025 YPVXLSYVFOOHCE-VFNWGFHPSA-N 475.970 0.347 50 20 JCGD CC(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1830017967 HMOGNQDFIONRFO-DEOSSOPVSA-N 491.589 0.214 50 20 JCGD Cn1c(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc2ccccc21 1830433523 TVFUCAYUFXOBIF-AREMUKBSSA-N 491.353 0.171 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCCc3ccccc3F)CCO2)C1 1830696092 UUBHHQVGCWPWSN-VWLOTQADSA-N 499.543 0.917 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(C(F)(F)F)o1 1830728721 XJCQJORLMXYSAW-BDJLRTHQSA-N 455.817 0.672 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1830732430 YEEVKKUOCKLCEC-BTYIYWSLSA-N 475.970 0.300 50 20 JCGD O=C(c1ccc(Br)c(O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732819 BFCMBJQWANEWPF-YJBOKZPZSA-N 477.739 0.824 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(O)c1OC 1830733047 CXOUPYHHHMWMEH-VBKZILBWSA-N 458.895 0.079 50 20 JCGD CC(C)(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1830778805 JVJGCIITZVKVFX-YCRPNKLZSA-N 477.986 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2 1832227478 XQXMKLPXDNDMTG-AUSIDOKSSA-N 471.489 0.466 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncn(-c4cccc(F)c4)n3)CCO2)C1 1833354072 LSNODSYSGSUDAC-LAUBAEHRSA-N 481.912 0.730 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1)CCO2)NC(=O)NCc1ccccc1 1834007820 YFGCBGBEKUWGRY-RUZDIDTESA-N 496.568 0.498 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OC)cn3)CCO2)C1 1834531935 JHDGDUXSQFZRBG-FZKQIMNGSA-N 457.325 0.729 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1834560597 MRKJZYOCUXJECY-XOBRGWDASA-N 453.927 0.104 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cn4cc(F)ccc4n3)CC2)CC1)c1ccc(B(O)O)cc1 1834798628 SGOQGVFTVGMWEU-UHFFFAOYSA-N 493.348 0.652 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1 1834820240 RTEONTRTXHYJLL-QUCCMNQESA-N 471.348 0.970 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnc[nH]3)CC2)CC1 1835061939 VIIFYGWLPPSMQC-LQKURTRISA-N 468.562 0.658 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cnc2[nH]ncc2c1 1835523041 IXZILEDTBXMFSM-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccn4cncc4c3)CC2)CC1 1835605782 OEISAECVSNJDHH-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)n1cccn1 1835737437 USAVKGGKXIWKQY-MRXNPFEDSA-N 468.562 0.328 50 20 JCGD Cc1cc(/C=C/C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)no1 1835738131 UZADOVGCQJDACB-NSCUHMNNSA-N 481.557 0.880 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)n[nH]3)CCO2)C1 1835855796 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COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)[C@H](C)O4)CCO2)C1 1838589205 MZYAAOKUXVQURH-DDVAMESESA-N 481.933 0.730 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1839151705 AZUKBQUNQFQFIU-OALUTQOASA-N 462.330 0.702 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc(C)c1C(=O)O 1839480097 LPRFBVQFANLRKJ-RUZDIDTESA-N 496.325 0.065 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3cccc(Cl)c31)CCO2 1839740554 QNEMBFTWPWNVBQ-NLFFAJNJSA-N 498.772 0.820 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1840035269 LLVXTMWTDJIGDQ-VEVIJQCQSA-N 480.356 0.069 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1840077710 HHGYCRJLBQCDMS-UXHICEINSA-N 485.405 0.749 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1840141017 SLOOXXFYQXBJMJ-RZQQEMMASA-N 473.364 0.983 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(-c4cccnc4)c3)C2)C1 1840150071 GBZDZKYJTIGAGH-WIYYLYMNSA-N 463.922 0.591 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1840153612 VGDVNZYKYJUMIL-XOBRGWDASA-N 456.927 0.249 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1 1840156052 MPNPXAHDTBGJMK-QOKUDNMUSA-N 477.945 0.607 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2 1840862962 PXFOZZXQIUWUOR-ITSXBRTRSA-N 477.587 0.720 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H](C[C@@H]2CCOC2)NC(=O)OC(C)(C)C)C1 1843422971 CGYLJUAZMDYYAY-ZWKOTPCHSA-N 495.621 0.883 50 20 JCGD CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1843817809 UFVVOMSXXNBASJ-LJQANCHMSA-N 487.362 0.209 50 20 JCGD O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)[C@@H]2C[C@H](O)CCN2C(=O)OCc2ccccc2)C1 1843846010 KZQQINXSTBNSRX-QYZOEREBSA-N 479.961 0.952 50 20 JCGD CN1CCN(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)CC1 1843913734 VRPMGTFHNKXNFP-INIZCTEOSA-N 458.003 0.569 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1n[nH]c3c1CCc1ncccc1-3)C2 1844264689 XLFAUKDXZOOSSG-UHFFFAOYSA-N 472.509 0.700 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCNC(=O)c1ccccc1)C2 1844265504 JROKVECCHSQQKK-UHFFFAOYSA-N 450.499 0.322 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)Cn1nnc3ccccc31)C2)NC(=O)NCc1ccccc1 1845038285 MRBGHXMTACXEPZ-UHFFFAOYSA-N 490.568 0.981 50 20 JCGD C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1845131957 LYOFNVQDEASKHC-HXUWFJFHSA-N 483.374 0.880 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1845145349 DUECEBIKRCDBTA-ZIAGYGMSSA-N 461.943 0.636 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nc3ccc(F)cn3n2)C1 1845728870 KKSJBFNSEUMPOM-DHRITJCHSA-N 452.450 0.819 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847564439 WIQRFRPZBBFQJG-VGWMRTNUSA-N 455.943 0.647 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc(Cl)c1OCC(N)=O 14326288 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469.612 0.143 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC(=O)N[C@H]2CCS(=O)(=O)C2)c1C 916420302 IPUSPKRNCMOOBQ-RVKFLDTASA-N 480.543 0.775 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1 916641104 XEUHNVZJMSLANZ-UHFFFAOYSA-N 473.538 0.549 50 20 JCGD COc1cc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)ccc1OCCO 918228517 LEDYDZIXXNOXAP-UHFFFAOYSA-N 453.521 0.974 50 20 JCGD COCCN1CCC(NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 920814220 HOCSAMDIZNDFIL-UHFFFAOYSA-N 497.618 0.081 50 20 JCGD O=C(NC[C@H](c1cccc(F)c1)N1CCOCC1)NNC(=O)c1ccc(-n2cnnn2)cc1 921247188 BRSOXZHTFLYNAK-LJQANCHMSA-N 454.466 0.819 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1 1777714323 OAUOIOMULCPGQS-SGCYSOCQSA-N 465.470 0.800 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ccccc4n3)CCO2)C1 1779030728 VVVYORWKBWGJFI-HSZRJFAPSA-N 461.482 0.386 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3nc(-c4ccccc4)ns3)CCO2)C1 1779030868 YUONBVATZQCFST-HSZRJFAPSA-N 493.549 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)NC(=O)CO3)C1 1779051727 KAVVHQDSMUTYDF-NTKDMRAZSA-N 487.557 0.518 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1 1779111942 HDFGSEGWCMEDFW-HSZRJFAPSA-N 462.271 0.174 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3c(F)cccc3n1)C2 1779374609 RZMZBOZHQGBDJA-HOYKHHGWSA-N 495.515 0.913 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1780095211 JSIFJTMWRUARBH-HNAYVOBHSA-N 455.851 0.563 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3csc4c3c(=O)n(C)c(=O)n4C)C2)C1 1780924407 KYDJRDWVEHJPED-QKKBWIMNSA-N 482.990 0.689 50 20 JCGD CCOCCC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969259 JOWCNLJFEBZALM-HSZRJFAPSA-N 461.563 0.589 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2n1 1782574201 AQZWAGRZKDUJEY-XMMPIXPASA-N 462.315 0.388 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC(=O)NC3)[C@H]2C1 1783625720 FCIRTIFTKVHQGB-XAJHFOFHSA-N 486.997 0.624 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CC(=O)OC)NC(=O)OC(C)(C)C)CCO2 1783879362 QVPNSDIVAOPXKY-GXZWQRSESA-N 491.969 0.527 50 20 JCGD Cc1nn(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1784725288 BXJTUXSGUMOLNW-BVSLBCMMSA-N 497.600 0.668 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785132886 DDWDUMUAPWTOQZ-QFIPXVFZSA-N 458.707 0.786 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)CC1 1785319554 YYQRRVOHRSPUTO-RUZDIDTESA-N 499.373 0.377 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1 1785623831 PAJQZUOOPFRQNX-LAPQFRIASA-N 493.964 0.693 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786405890 IJWARZUQCGLADA-JONQDZQNSA-N 491.427 0.993 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4occc4c3O)C[C@@H]21)c1ccc(B(O)O)cc1 1786981640 AQBXDXDPGHGIRI-ZRCAFCQKSA-N 464.283 0.725 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508125 HNFSOOUBSVUYRZ-KGTKRSOYSA-N 499.568 0.856 50 20 JCGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)nc2ccccn12 1787859011 IRHWLZNXEIHOFY-BZSNNMDCSA-N 456.547 0.609 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc(O)n4c3CCCC4)[C@H]2C1 1788791272 RLXUHLHFSLTORN-BRZMCFHBSA-N 497.556 0.652 50 20 JCGD C#CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789727647 KJCWZDLGTOTPCS-ACRUOGEOSA-N 455.559 0.726 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCS(C)(=O)=O)C2 1793882550 LVIYTXVRRPCAMM-FQLMCAECSA-N 481.999 0.143 50 20 JCGD Cc1cc(C)cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1 1795740998 VXQZBEBKUFHLKI-RUMRUAAYSA-N 450.344 0.819 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1 1796190601 PBYHAGDXBJARJL-BJWYYQGGSA-N 490.774 0.989 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)N1C[C@H]3C[C@@H]3C1)C2 1796441917 GTAXIESWWFWXGQ-MKDUBYBYSA-N 456.547 0.050 50 20 JCGD CC[S@](=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1797607705 WGSYIEJYHJETNV-WXVKSQAFSA-N 493.630 0.081 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1797668625 GQKUGEVCKVIMEF-IHSNIMORSA-N 452.515 0.389 50 20 JCGD Cc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)n1 1799097592 PZMRVIGTASRZAN-HATOLVCRSA-N 481.557 0.334 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1800642097 WJGBDILZLGLGLV-JLUCKKNBSA-N 454.325 0.062 50 20 JCGD CC(=O)C[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1800941463 LCECVKGNZJBHHC-ALOBAPJISA-N 473.574 0.537 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CCN2CCOCC2)[C@H]1c1cccnc1 1806951000 LSMYQAYAYCUNJM-PLOCYCMXSA-N 495.584 0.944 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CCN2CCOCC2)[C@H]1c1cccnc1 1806951034 LSMYQAYAYCUNJM-SHIASZOCSA-N 495.584 0.944 50 20 JCGD COC(=O)C12CC(C(=O)N3CCC4(CCCN(C(=O)c5ccc(B(O)O)cc5)C4)CC3)(C1)C2 1809974098 OWDIVBJHQXWWEB-UHFFFAOYSA-N 454.332 0.555 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1813065617 KWXJFENOBLVGSJ-ZFUCPZCZSA-N 484.513 0.016 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1 1813074456 RFSCWDKVVRHMQB-KDOFPFPSSA-N 472.468 0.139 50 20 JCGD O=C(CCCn1ccnc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813352123 RZDTZNUALUEFDZ-OFNKIYASSA-N 461.331 0.758 50 20 JCGD C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1 1814770459 VMOFYMZBAUYMKR-YUMQZZPRSA-N 455.271 0.563 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1)[C@@H](F)Br 1820937821 VJRGMHFVBXQJTA-SWLSCSKDSA-N 450.309 0.379 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)NC(=O)OC(C)(C)C)n[nH]1 1821220298 DUVVUOOHONFDNK-KUHUBIRLSA-N 481.554 0.618 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnn2c1OCCC2 1821429739 MUHLGFVEPQKJNV-GOSISDBHSA-N 464.291 0.688 50 20 JCGD Cn1cc(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1 1827052768 DVKYBPZTOJFWTM-JOCHJYFZSA-N 452.364 0.966 50 20 JCGD O=C(Cn1cncn1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551366 OGNSWIUWJCFVTK-PGRDOPGGSA-N 490.948 0.330 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829074075 WTNALHRJPRVDTR-UTKZUKDTSA-N 457.380 0.905 50 20 JCGD N=C(N)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc1ccccc1 1829359922 MHQVRLDYLXYZFW-HXUWFJFHSA-N 485.372 0.725 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1 1830185123 WQPDLYMSVPOSEW-YJBOKZPZSA-N 493.351 0.851 50 20 JCGD O=C(c1ccc(Br)nc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725738 RMSSGGWIUIRPOS-PXAZEXFGSA-N 480.718 0.653 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1831640379 LXJJFVCKCHJVRY-IERDGZPVSA-N 454.955 0.999 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCCc1ccncc1)CCO2 1833060012 PUHKZMZCSQBMAH-QHCPKHFHSA-N 461.563 0.234 50 20 JCGD O=C(CCN1C(=O)C=CC1=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1833614293 JQTGFKOTGXSLRD-SFHVURJKSA-N 473.343 0.564 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)/C=C/c3cnccn3)CC2)CC1)c1ccc(B(O)O)cc1 1834800493 IGNYVOIBRATVCQ-AATRIKPKSA-N 463.347 0.055 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1 1834824786 MMNDIYJILZKLCI-RXVVDRJESA-N 479.375 0.994 50 20 JCGD Cc1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)s1 1835736936 BDTSHJIELGXYQG-UHFFFAOYSA-N 471.587 0.949 50 20 JCGD O=C(Cc1ccc(Cl)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926432 NGLQUHQBYKDEBB-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD O=C(CCCc1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933703 ALNLFWJXGQXCAL-RUZDIDTESA-N 484.333 0.598 50 20 JCGD COc1ccc(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461600 ZGAVIOSIJLOBKI-HSZRJFAPSA-N 487.488 0.217 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]cc3[N+](=O)[O-])CCO2)C1 1837799024 MMEKBGFYRUVNKE-MEDUHNTESA-N 460.285 0.561 50 20 JCGD O=C1Cc2cc(C(=O)N3CCC(OC4CCN(C(=O)c5ccc(B(O)O)cc5)CC4)CC3)ccc2N1 1837919221 RCRGYVNLEWDGCW-UHFFFAOYSA-N 491.353 0.787 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1 1838012128 KHQPPYGCUFRRDE-HRAATJIYSA-N 463.922 0.796 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840108056 PRZXMBMLMQJWHP-XFQAVAEZSA-N 475.970 0.512 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840108188 BZCJQPOQELZZPS-YVHKJVDXSA-N 489.997 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1 1840184943 CKKSDUADIMYGKD-VWLOTQADSA-N 498.584 0.374 50 20 JCGD Cc1ccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1840397376 XNPWQOIGMMMHFS-IMAOXBOFSA-N 464.588 0.899 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1 1841347845 AWSOFJAEOGKOHF-SIFCLUCFSA-N 459.971 0.798 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCCC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1845160091 DTSLHLZVZGVXAF-INIZCTEOSA-N 477.986 0.738 50 20 JCGD COCCOCCOCCOCC(=O)N1CCCC12CN(C(=O)[C@H](C)CBr)C2 1846256032 KOBIUJBSHWWHED-MRXNPFEDSA-N 465.385 0.917 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CO[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]31)C2 1846385930 MWIPMTURJNELIH-KZNAEPCWSA-N 493.605 0.445 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)C[C@@H]2C[C@@H]21 1847572025 TWWDLMQNIDHQLH-CTXVOCDESA-N 484.557 0.898 50 20 JCGD Cc1nnc(NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(Br)cc3)C2)[nH]c1=O 11548631 ZJBSTOITGRTSBC-NSHDSACASA-N 471.337 0.780 50 20 JCGD COc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 13359323 YUIYNHFDLXKDGG-UHFFFAOYSA-N 471.513 0.332 50 20 JCGD O=C(Cc1ccc2c(c1)OCCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 23710466 GKTHUNNGDIBRBQ-UHFFFAOYSA-N 461.496 0.482 50 20 JCGD C[C@@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1C(=O)NC2(CCCC2)C1=O 726495733 HEIMTPKALYXODY-KRWDZBQOSA-N 456.547 0.599 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCN3C(=O)[C@H]4CCCC[C@H]4C3=O)cc2)CC1 728214101 XZIMQAOMCACBTO-KDURUIRLSA-N 477.587 0.631 50 20 JCGD O=C(CCCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)[C@H]1CCS(=O)(=O)C1 728386662 HEDTVKOBYQLTIX-INIZCTEOSA-N 457.574 0.206 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)C1CCN(c2ncccn2)CC1 728846473 NYLCEOXKRCPWPA-HNNXBMFYSA-N 464.573 0.755 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)c3cccc(C#N)c3)CC2)cc1 728871971 IDUZDYKUTHCGCU-UHFFFAOYSA-N 483.550 0.941 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(S(=O)(=O)Nc2ccc(F)cc2)ccc1Cl 729275165 MMHADCNGFCFYKO-SNVBAGLBSA-N 492.938 0.979 50 20 JCGD O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCCN1CCN(c2ccncc2)CC1 748464634 HLFNSAKIVPIMEJ-UHFFFAOYSA-N 457.491 0.911 50 20 JCGD CN1CC(=O)N(CCCC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1=O 751129944 QBKCCSOIWCGVEK-UHFFFAOYSA-N 476.497 0.824 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)n1 759398507 GIRZPKIMAZYCPN-UHFFFAOYSA-N 494.473 0.682 50 20 JCGD Cc1nnnn1/C(=C\c1ccccc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 849196535 PFQISGANDMJXHQ-QMDZLVRISA-N 464.438 0.510 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccs2)o1 915442268 WNTDJCBFVNZVIQ-GFCCVEGCSA-N 499.523 0.675 50 20 JCGD CNS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 916829383 LJTLUUKMSAFFOR-UHFFFAOYSA-N 474.948 0.289 50 20 JCGD CN(C)C(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 917722114 PJOTWBPAZJTVAC-UHFFFAOYSA-N 480.568 0.796 50 20 JCGD Cn1c(CC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)nc2ccccc21 918549905 VTCMNRUGETUGTD-OAHLLOKOSA-N 497.533 0.901 50 20 JCGD CCc1nc(CC(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC)n(Cc3ccccc3)c2=O)cs1 919842575 LBCSGFGCGMSLAV-UHFFFAOYSA-N 495.565 0.837 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nn1)C2 1778091407 PFGDNSBGNOZIQZ-ZLMOUHMRSA-N 469.502 0.444 50 20 JCGD CO[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1779031243 OYRFAXCCOKEZOG-AUSIDOKSSA-N 453.499 0.516 50 20 JCGD Cc1nscc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371266 YUJORQPLXGHFJR-DYESRHJHSA-N 458.544 0.891 50 20 JCGD Cc1ccnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1 1779373106 ASWXKZLFISMGDI-AUSIDOKSSA-N 452.515 0.830 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(CO)c(F)c1)C2 1779375739 SJLZKVIQHUJTNJ-HYBUGGRVSA-N 485.516 0.758 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780060042 UJOYBMUHGALWSX-SFHVURJKSA-N 450.293 0.318 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnsn1)CCO2)NC(=O)NCc1ccccc1 1780969559 MUHVMXMAKCXYDO-NRFANRHFSA-N 473.559 0.328 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2Cc3ccccc3N2)C1 1781588752 DHXPIKIOXWPVCB-DCLXLUIPSA-N 457.575 0.910 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782569901 ODLLUEFKMZBFJQ-XVWGUNQUSA-N 467.331 0.356 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnc3c(O)cccc13)CCO2 1783937527 UBVGCIDOANTUFW-QHCPKHFHSA-N 455.515 0.757 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C[C@@H]21)[C@@H](O)CCl 1784091317 NGRQVWLPJIMXHC-FRJURHEUSA-N 459.934 0.763 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccc(Cl)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786983699 UEQMTUJJENVPHS-VDGAXYAQSA-N 470.718 0.496 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C[C@@H]21)c1cccc(B(O)O)c1 1786984242 TZRJFYRMVMQAHL-USKVXJDGSA-N 479.342 0.223 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COCc3ccccc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984338 FSVNDJIILYELNA-BVSLBCMMSA-N 452.316 0.177 50 20 JCGD COC(=O)C12CCC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)(CC1)CC2 1788214513 FQOJONZEMFEZEN-URDWGJOXSA-N 498.385 0.473 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610263 UHKUWNKRYBDZTO-NDXORKPFSA-N 467.526 0.991 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)no3)[C@H]2C1)NC(=O)NCc1ccccc1 1788976530 DDHRKCYTQJOOKG-LNLFQRSKSA-N 486.529 0.320 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1NC(C)=O 1789276227 AJASTTLEUCIMHK-BVYOLEPJSA-N 453.923 0.847 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c([N+](=O)[O-])c1 1789965647 RWPOJASABUJYTK-XJABCFGWSA-N 497.313 0.119 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21 1791061621 ZNBUGWGDSGHVGL-JURCDPSOSA-N 485.404 0.655 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1cccnc1)C2 1792868458 APUIVEZVFCMMJE-JJAZEVLHSA-N 453.337 0.432 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1C[C@@H]1c1ccc(F)c(F)c1 1793044589 BDXDADMUFKFCGS-SIUYQDCVSA-N 470.281 0.652 50 20 JCGD Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1F 1793305871 YTGAIYJYHPOJGS-BBIADKPPSA-N 454.307 0.650 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793880392 YCUYRTWQEBDFHG-LFYQSXPISA-N 472.970 0.399 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccccn1 1794198734 QMMKKKYCJROZLC-AOSNRDAWSA-N 452.515 0.738 50 20 JCGD COc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)ccc(F)c1F 1795739973 XTUSKDLDAGIQSF-HBCWATKFSA-N 460.242 0.170 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC[C@@H](N)C(N)=O 1796081565 NJBDTNLMAMLJKL-KHMAMNHCSA-N 459.975 0.350 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796190412 VOBXWEPCYPCXKP-BCDXTJNWSA-N 455.251 0.908 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796192861 UPTDUAIKMZHYQK-KAOXLYBCSA-N 481.333 0.505 50 20 JCGD CC(C)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)CC1 1797748601 LOSIYUKJOHVCRX-XEMDLRDOSA-N 458.563 0.009 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cc2nn[nH]c12 1798617679 BNDOBACXJHWAGJ-YVQILLBQSA-N 498.931 0.949 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1798637389 SLZLQHPSDGXDPI-BQJWPVKWSA-N 474.986 0.908 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C1CC1)C2)NC(=O)NCc1ccccc1 1799095409 RXGLFZNITWZXOD-IJVIZSLASA-N 455.559 0.888 50 20 JCGD CC(=O)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1800513352 LCXWCHITZYOYAE-SFNKJDCFSA-N 452.349 0.718 50 20 JCGD CC1CCN(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1803389168 VQCVHAHXGMFATR-QPPBQGQZSA-N 464.375 0.813 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)C[C@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1804343113 WEYVPHAQRUXPFL-XKVFNRALSA-N 466.336 0.717 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361018 FRKDZOOABRYDKE-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361844 UIFDWKHIOOGNQH-YOEHRIQHSA-N 488.235 0.532 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(=O)OC(C)(C)C 1807362404 GYDNXQNSONSXES-DENIHFKCSA-N 496.373 0.948 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2cnnn2)[C@@H]1c1cccnc1 1807608442 LNJVSOLKRCAFME-BQFCYCMXSA-N 492.968 0.906 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C2=NNC(=O)C2)[C@@H]1c1cccnc1 1808417566 MNFQTJWPTDQRMV-XMCMKKQQSA-N 464.486 0.097 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC2(CCCN(C(=O)CNC(=N)N)C2)CC1 1809687633 IPVJBORUMQBGKU-UHFFFAOYSA-N 460.491 0.848 50 20 JCGD O=C(COC(=O)C(F)(F)F)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810182980 PLUGKTDNGXFGQD-CRAIPNDOSA-N 479.220 0.187 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)nc3cccnn23)[C@@H]1c1cccnc1 1813072193 BCWCYYUCBMDZNB-GAJHUEQPSA-N 492.540 0.177 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1 1813073136 HSSJXDIDSBCZQE-GAJHUEQPSA-N 454.531 0.804 50 20 JCGD Cc1cccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815335726 MKUIDSYLFPEBIP-QGZVFWFLSA-N 450.329 0.995 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ncc(Cl)cn1)CC2)c1cccc(B(O)O)c1 1815354949 IURKIPXQXVSMPM-ZDUSSCGKSA-N 457.708 0.806 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1)c1cccc(B(O)O)c1 1817477126 MRVRVXDSQNFMKL-QGZVFWFLSA-N 494.273 0.166 50 20 JCGD Cn1ccc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n1 1819402946 OUESQDNDFUZJMD-QGZVFWFLSA-N 451.491 0.690 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1820108498 YPENNAOQKBVCPC-IUODEOHRSA-N 458.349 0.354 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cnccn2)CC1 1824304418 CPQYOPJYFHEAGR-FQEVSTJZSA-N 451.531 0.951 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)c2cccnc2)CC1 1825091257 AMUGWTSLRNPTEP-HXUWFJFHSA-N 472.590 0.804 50 20 JCGD O=C(Cn1ccnn1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829023587 ROBWGHBQEXCHFK-XMSQKQJNSA-N 490.948 0.330 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829026454 USWMBBMYFVWDBD-JTSKRJEESA-N 493.373 0.208 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830369890 DLQXGKKNHFPNCQ-DYESRHJHSA-N 469.970 0.178 50 20 JCGD O=C(c1csc(-c2cccnc2)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728284 RKAJERVTSYARJD-OXQOHEQNSA-N 466.947 0.875 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832755372 HJRUYNPCZBHKRL-IIBYNOLFSA-N 467.906 0.041 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1 1833272120 GUPKQUCCIOTKJQ-CVEARBPZSA-N 464.966 0.978 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CN3CC(=O)NC3=O)CC2)CC1 1833709706 DCWLZVNABFQPLD-CYBMUJFWSA-N 472.384 0.141 50 20 JCGD Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1834063822 GDUSSABRXGEBSO-UHFFFAOYSA-N 466.546 0.283 50 20 JCGD COc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)cn1 1834525859 SXAZNIWKMORPFH-SCLBCKFNSA-N 457.325 0.586 50 20 JCGD COC1(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)CCC1 1834800490 ICSSEMMKDFECKS-UHFFFAOYSA-N 457.380 0.511 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCc3cn[nH]c3)CC2)CC1 1835737173 RWQIIEWXSTVHPZ-UHFFFAOYSA-N 468.562 0.226 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CC[C@@H]3CCOC3)CC2)CC1 1835737525 YVFIFNJMIWEGEY-QGZVFWFLSA-N 472.590 0.687 50 20 JCGD Cc1nccn1CCCC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738298 TUTUEAJJOUQCGL-UHFFFAOYSA-N 496.616 0.856 50 20 JCGD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931817 DDPLWRZSCDHJEC-OKFYXZINSA-N 456.348 0.263 50 20 JCGD O=C(CCCCn1cccc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937912 BEALXGXZWYAWGC-DEOSSOPVSA-N 469.347 0.108 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2 1836723392 LVMLYJLOCORJKM-KRWDZBQOSA-N 450.458 0.158 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1 1837046860 GJVLFKVNYKVWDT-UHFFFAOYSA-N 454.600 0.388 50 20 JCGD COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)c1 1838927211 HIGOSWSSTWHUHH-OTZYPNAKSA-N 483.525 0.899 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1839966192 XBKDZHKOKOXEFJ-XOBRGWDASA-N 494.346 0.333 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840650249 FFJIMEKPBBIFBB-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1840727110 IPWLAPRCXNMCKH-DEOSSOPVSA-N 496.524 0.027 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(N3CCOCC3)cn1)C2 1843415505 MNPSVHXSEQLTIR-WPWMEQJKSA-N 479.541 0.869 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(CCN3CCCC3)nc2)C1 1843457320 GGDPVDDUXHKRJL-UHFFFAOYSA-N 462.359 0.531 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 9746383 RTSFHOJYEVIINB-UHFFFAOYSA-N 487.498 0.912 50 20 JCGD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1 24757382 FIPNTCMWTIPYIY-UHFFFAOYSA-N 450.425 0.654 50 20 JCGD COc1ccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N2CCOCC2)cc1OC 725873339 YGWGPTLOOZVLHE-INIZCTEOSA-N 475.502 0.431 50 20 JCGD Nc1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc(Cl)n1 726768529 XIBKCEUBMUQXNQ-UHFFFAOYSA-N 467.935 0.732 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCSCC2)c2ccccc2c1=O 730673371 RPGIXAKGJTVYDO-UHFFFAOYSA-N 496.615 0.519 50 20 JCGD O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 745868049 VWAJNHCESIGYJU-OXQOHEQNSA-N 499.549 0.017 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)c1nnc(O)c2ccccc12 749838826 VFYUDGBPTDRSRC-UHFFFAOYSA-N 486.329 0.899 50 20 JCGD CC(C)(C)c1ccc(C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)CN2CCCC2=O)cc1 751616821 HCHADGSKTMLRSZ-QGZVFWFLSA-N 480.587 0.287 50 20 JCGD CNS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)ccc1OC 787535919 BUXCNZYVEDFUGE-UHFFFAOYSA-N 455.876 0.875 50 20 JCGD COc1ccc(C(=O)NCCCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 914781818 QCTDTLRKKRGLBN-UHFFFAOYSA-N 476.555 0.982 50 20 JCGD COc1cc(OC)c(OC)cc1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 915918846 BXHSDQFYXGZBBU-UHFFFAOYSA-N 494.574 0.870 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCc2cccc(S(=O)(=O)NC)c2)c2ccccc2c1=O 916485934 NUEDEQKLYCBJLL-UHFFFAOYSA-N 458.500 0.469 50 20 JCGD CCn1c(O)nc2cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)ccc2c1=O 916745803 PMENMMPHFRTLAP-UHFFFAOYSA-N 473.511 0.512 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1ccc(F)cc1Br 918341646 TZNLLWCWNUMLHQ-KOLCDFICSA-N 462.297 0.385 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(C(=O)C(=O)N2CCCC2)CC1 918777489 LYEOBSWDTAMQHP-CQSZACIVSA-N 496.362 0.724 50 20 JCGD O=C(COc1ccccc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)Nc1ccccc1F 919884416 GHZKXFNGDNBLOG-ZDUSSCGKSA-N 464.475 0.974 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc([C@@H]2CCS(=O)(=O)C2)n1C 1317736495 DGTWTTKLKMUDTE-SNVBAGLBSA-N 473.964 0.933 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778090908 HADXDFDQDXFQTR-BYHZOJLWSA-N 489.577 0.342 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779333094 HKHMGQGUOYURKT-QRQCRPRQSA-N 453.503 0.024 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1779382106 GSIBMBSEZHTTPQ-FQEVSTJZSA-N 488.413 0.909 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(=O)nc3sccn23)C1 1779988047 VLPOZGMXBWNPHW-OPAMFIHVSA-N 490.586 0.257 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)csc2n(C)c1=O 1780924860 WDXGAVONMRFXKP-KUHUBIRLSA-N 472.926 0.206 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2)NC(=O)NCc1ccccc1 1780969628 IJRLMZBZLLDZKV-RUZDIDTESA-N 499.616 0.444 50 20 JCGD N#Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(Cl)c1 1781967529 IVWFYSDYOCEVTQ-JOCHJYFZSA-N 453.691 0.649 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1 1782017595 YSEVURMJGNMPAD-QHCPKHFHSA-N 476.497 0.023 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1782305113 PKEHRMZGVKDFGE-QHCPKHFHSA-N 481.488 0.538 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c12 1782375805 CQOSJPSTGCWHLM-XMMPIXPASA-N 478.509 0.932 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1 1782811518 PKSPFLMWGWGBNV-QTDGGUCWSA-N 465.978 0.706 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)CCO2 1783540605 ZNSTWKXZYJOMLP-YYQBIWNASA-N 490.395 0.970 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1783666332 JMMGFUXAHYCZRI-RDJZCZTQSA-N 455.321 0.577 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C[C@H]1CCN(C(=O)OC(C)(C)C)C1)CCO2 1783938055 QYMQRIPQHQJGEC-KOSHJBKYSA-N 495.621 0.836 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCNC(=O)c3ccccc3)C2)C1 1785333719 ZFWXQHOQGLRYQX-HSZRJFAPSA-N 459.547 0.009 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786406581 YSAQOTJLJOJPTN-VGWMRTNUSA-N 463.325 0.246 50 20 JCGD CCOc1ccsc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982132 OMEARXDTIAQFAB-IEZWGBDMSA-N 458.345 0.734 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(Cl)cc2nn[nH]c12 1789281754 BSVJTQGWEXAXKO-IXDGSTSKSA-N 483.721 0.198 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)CCN3C(=O)C=CC3=O)CCC2)cc1 1789519851 MPDUZBBYMDGFJX-UHFFFAOYSA-N 476.493 0.748 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)NC(=O)NCc1ccccc1 1789726716 PIEYTTFDEHHZIX-DWRORGKVSA-N 469.945 0.847 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCS3(=O)=O)[C@H]2C1 1790744647 JJKXUYYHDJIFLO-YTFOTSKYSA-N 451.383 0.574 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O 1792780332 VRGFCUJATMZVHQ-JITAAIDCSA-N 496.402 0.929 50 20 JCGD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792975398 QBCXMLYNUHQNKV-SJRVDFGRSA-N 475.970 0.200 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)NCc1ccco1)C2 1796441730 WFKAOBAYLBPGBV-RZNUDEGDSA-N 496.524 0.176 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1797737605 CVTQZKSNEHFCHC-NNXHMXCWSA-N 459.971 0.965 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1F 1797748267 OBJTZJYSKRZDCG-HBCWATKFSA-N 457.462 0.350 50 20 JCGD CN(C)c1cccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797748587 KKOIFDMAKITHJQ-MFKICJERSA-N 482.541 0.033 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1onc3ccccc13)C2 1797753962 MSHNOACHRGSISW-IVWMJMPLSA-N 450.455 0.343 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nn1 1798034961 ATXZKBOBKLDXIP-CNKKGNCFSA-N 459.894 0.467 50 20 JCGD CCn1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)n1 1799094988 OEEMJVOURWHZEC-HATOLVCRSA-N 483.573 0.452 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)OC(C)(C)C 1800672224 DWRKDIIKTRQAKP-OBAMXFLESA-N 476.534 0.235 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)n(-c2ccccc2)n1 1801011683 YQUJABVPQSRLCX-FEJSZKPUSA-N 468.558 0.757 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1cccc(Br)c1)C2 1801012484 JTVCOLQVQFZZGA-HRYATBACSA-N 497.390 0.445 50 20 JCGD Cc1cc(Br)c(N)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801012967 HXFXSSDBILBYJC-VTEUUUEMSA-N 496.406 0.916 50 20 JCGD Cn1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)cn1 1801416891 NWACNJPFDGGCOZ-DFGXFYAUSA-N 469.970 0.684 50 20 JCGD COc1cccc(Cl)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1801802737 GCFFQBIUJKYJIW-VTEUUUEMSA-N 452.939 0.925 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[C@H]1c1cccnc1)[C@H](O)CCl 1803139219 VKNPDTHDEFSWSE-MJEQTWJJSA-N 467.935 0.152 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)COc2ccc(O)cc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361062 UYPIBKSKMVIXPQ-CYFREDJKSA-N 475.310 0.866 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2n[nH]c3c2CCCC3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370461 FIJAAQFTSSCBSV-WZONZLPQSA-N 473.342 0.997 50 20 JCGD CCc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n[nH]1 1807777826 YSFCLYMCQPJJDO-QRWLVFNGSA-N 462.514 0.999 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccn2c(O)nnc12 1808190517 SJYCTJQSQVZNGW-PXNSSMCTSA-N 486.297 0.143 50 20 JCGD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1 1808895295 QCBWGWNBXGAGGB-XMSQKQJNSA-N 460.299 0.798 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCCNC3=O)[C@H]1c1cccnc1 1809678801 FFQXKWWPUAHWOK-VGOFRKELSA-N 496.572 0.104 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1810438095 ZLVSBKLWHJJQMV-QXRTWZOPSA-N 460.922 0.296 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1 1813070606 KBJGFORAXFPGDU-IIBYNOLFSA-N 456.503 0.173 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](N)c2ccccn2)[C@@H]1c1cccnc1 1813070854 LQLBPYAZBNJKSA-MTNREXPMSA-N 453.547 0.555 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1 1813074360 YAXOWXJIHLHZSZ-YADARESESA-N 478.557 0.746 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1 1814770225 RQEKSXBWVCUCNL-RKDXNWHRSA-N 469.298 0.953 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CNC2=O)n[nH]1 1815595120 NFVJOMNDMNPYGA-JQWIXIFHSA-N 455.313 0.985 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3ncn(-c4ccccc4)n3)sc2C1)c1ccc(B(O)O)cc1 1817491144 SVKQXTQZNGXLJL-INIZCTEOSA-N 488.338 0.943 50 20 JCGD COCCn1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1 1818259511 OGHMEPVAILGRJM-IBGZPJMESA-N 466.307 0.552 50 20 JCGD COCCOCCOCCOCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1 1822263753 BYEDJPMHXMQMBA-IRXDYDNUSA-N 476.958 0.698 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1 1822970776 KQYWDUGJBKSHKY-DXRSZSRVSA-N 477.547 0.971 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825966085 PLPNEGWROUYNTL-GVDBMIGSSA-N 483.355 0.804 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1828953519 PDCIPKZRHMMBAH-YADHBBJMSA-N 488.346 0.095 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nccnc2C(N)=O)CC1 1829510308 MPSPXQZXEZQQEA-QGZVFWFLSA-N 480.529 0.121 50 20 JCGD Cc1ccc(OCCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1830206816 AULKLQUHVMOXOC-DEOSSOPVSA-N 476.574 0.593 50 20 JCGD O=C(Cc1cccnc1Cl)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833769073 FKBLTKYXXSCMJO-UHFFFAOYSA-N 484.793 0.843 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)s1)CCO2 1834058789 KBSMOUSZYKPPLH-IBGZPJMESA-N 458.968 0.845 50 20 JCGD Cc1ccn(C)c1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798420 SSPANUXYQVQHSO-UHFFFAOYSA-N 452.364 0.512 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C(=O)c3ccccc3)CC2)CC1)c1cccc(B(O)O)c1 1834801155 RSVFZNRLPMMQQA-UHFFFAOYSA-N 463.343 0.435 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cc3noc(C)n3)CC2)CC1 1835116420 MERHLKKQWABCHQ-JFLMPSFJSA-N 484.561 0.626 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1835833384 CCBQXFJIGQPICB-UHFFFAOYSA-N 476.654 0.663 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CN3C(=O)C=CC3=O)CC2)CC1 1835838018 XFWFBOLYNGCADH-UHFFFAOYSA-N 450.612 0.335 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@H](F)Br 1836412334 FJISZQSNMCVDOF-KRWDZBQOSA-N 470.148 0.242 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@H]1CCc2ccccc2O1 1836558292 OYFFTBGQNASVOQ-RUZDIDTESA-N 491.397 0.945 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4)CC3)C2)C1 1837457176 ZHKXWHJGUQYHEE-DEOSSOPVSA-N 479.537 0.487 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1Cl)CCO2 1838865412 CGZBZQFSTYJXTI-JOCHJYFZSA-N 458.707 0.404 50 20 JCGD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203455 LRMKCOOOLDAWGC-CCJIBRKGSA-N 489.294 0.964 50 20 JCGD Cc1ccn2c(C(=O)N3CCO[C@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)cnc2c1 1839602406 FOSNYUGJXMNQRE-QHCPKHFHSA-N 472.546 0.086 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Cn3cncn3)C2)C1 1839964896 INLZTWPOORDIRF-VKJFTORMSA-N 458.357 0.544 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840034986 CEXGRZVOPNHZJA-SIFCLUCFSA-N 483.363 0.440 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc4[C@H]3O)C2)C1 1840149952 CMKOGJJOWCATGH-GJPOJAMWSA-N 466.962 0.993 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1840153553 SGBXNTVXUDSODL-FLWKIERCSA-N 469.922 0.162 50 20 JCGD O=C(/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)NCc1ccco1 1840188737 ZRUUYLOFUWWCIR-GNAXCBTBSA-N 460.314 0.712 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccn1)CCO2 1840424543 QJGXBBOQSZSQRA-DBHUJENISA-N 498.540 0.439 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1840915780 ZXFJTEMQYZWFHW-BUXKBTBVSA-N 497.376 0.015 50 20 JCGD C[S@](=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841348437 RIQMLSBIKLNLLB-PWNDQGHQSA-N 466.000 0.451 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN 1848099577 WBQVJPHJLGIAKO-JYJNAYRXSA-N 480.953 0.633 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ncccn1)NC(=O)NCc1ccccc1 1848259369 IPRQVSLZUSDZCE-OALUTQOASA-N 451.531 0.567 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)c2ccccc2c1=O 17190889 XGBZBVLAPYQRNW-INIZCTEOSA-N 499.549 0.949 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 728332968 VHCCZJLYEAQCGL-INIZCTEOSA-N 452.416 0.373 50 20 JCGD COc1cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)cc(I)c1OC 728433673 DOVPAIJJOUIIII-QMMMGPOBSA-N 455.274 0.696 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccc2c(c1)OCCO2 770427497 PWZBFXGYFPDKRV-UHFFFAOYSA-N 477.495 0.749 50 20 JCGD CCn1c(=O)n(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc21 792737554 HPWOXELENGZMRB-SFHVURJKSA-N 454.439 0.354 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccccc1CS(=O)(=O)N1CCOCC1 806971944 ZNHGRYIGLDSLHO-UHFFFAOYSA-N 486.554 0.949 50 20 JCGD Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1C 912851791 GNWYJDNYBXIOMG-UHFFFAOYSA-N 453.546 0.336 50 20 JCGD C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1 917724474 YDXFCTMQWCDYIZ-UHFFFAOYSA-N 465.557 0.827 50 20 JCGD O=C(NCCc1ccc([N+](=O)[O-])cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 919780611 HZQNYZQRBXRQLB-UHFFFAOYSA-N 477.499 0.802 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3n[nH]c4c3CCCC4)CC2)c1 1115886416 OMGZNDUPRLVRIZ-UHFFFAOYSA-N 460.560 0.510 50 20 JCGD Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c(C)c12 1115990140 RXEOMLWLNLAIDZ-UHFFFAOYSA-N 452.519 0.665 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3cccnc3n2)C1 1778991065 RFQNTHVPCSTAHU-VFHFUPNESA-N 492.540 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(-c4cnccn4)c3)CCO2)C1 1779032605 OBAVCKCMVGKKKL-VWLOTQADSA-N 487.520 0.899 50 20 JCGD Cc1nc[nH]c1CSCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032807 ZRWUANQNIFWNEH-NRFANRHFSA-N 473.559 0.094 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)N2CCOCC2)C1 1779415481 KENXTCIEBBZGIN-SKWUIDRYSA-N 452.379 0.387 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)cn3)C2)C1 1779421583 KJRIWIMYORLZEK-HXUWFJFHSA-N 474.120 0.281 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780059746 HAJALRPCXNFTKZ-OALUTQOASA-N 454.314 0.769 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccnn1)CCO2)NC(=O)NCc1ccccc1 1780969336 XMOLPIIWACIFCR-QHCPKHFHSA-N 467.530 0.266 50 20 JCGD COc1cc(CC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1[N+](=O)[O-] 1781192126 JRCCYPGACXGBMQ-QFIPXVFZSA-N 477.518 0.349 50 20 JCGD CC(C)(C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccn1 1782410308 QXUOBDSFETUVPH-PXDATVDWSA-N 465.359 0.867 50 20 JCGD C[C@@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)n1ccnn1 1782751265 DQTOFAQQGXNSKJ-AUSJPIAWSA-N 470.958 0.801 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1782899032 FSVHQINYDUUIQK-QHCPKHFHSA-N 472.734 0.715 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1783697121 UROWCODSHKMCDE-JELUSGMUSA-N 468.290 0.671 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1 1783882945 AGILUAXUVFDJBO-PZPWOCDFSA-N 491.969 0.527 50 20 JCGD O=C1CSc2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)cc2N1 1784092835 WRAZEHQKMYOBKU-FATJJJSSSA-N 454.936 0.319 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784093532 AJSCTJMTIWNANJ-QMHWVQJVSA-N 491.969 0.022 50 20 JCGD Cc1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)ccn1 1785121143 XACXYGYXRJRVCY-YYWHXJBOSA-N 466.542 0.615 50 20 JCGD O=C1CSc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)ccc2N1 1786982767 ASASPDXEZRWOTL-QRFRQXIXSA-N 495.366 0.318 50 20 JCGD COc1ccc(F)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610851 CIWQTKPBUZZNEK-GMVOTWDCSA-N 471.489 0.740 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1790654817 CTFGNMSQKFOLGL-TZQJONAQSA-N 475.271 0.427 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21 1791252858 SQZDDKUNRNLSKC-WUGWMSQLSA-N 468.938 0.226 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)ncc1[N+](=O)[O-] 1791290828 ASECSTJZIIDTMJ-MPGHIAIKSA-N 462.507 0.265 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(=O)oc1 1794995998 RBNGAQRMNWXLSU-YVWYUNDQSA-N 471.422 0.990 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(S(C)(=O)=O)cc1 1795415936 MWZYZBJUTVMKOD-HIRMHNASSA-N 458.964 0.476 50 20 JCGD Cc1ccc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)ccc2c1 1795734070 AJXIMQUWUVGGFE-BBIADKPPSA-N 459.311 0.740 50 20 JCGD O=C(Cn1cnnn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1795860962 MYXDJYBASYZKQU-DFGXFYAUSA-N 463.336 0.269 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)ccc21 1796191376 FJYSJYYLRKYLEI-REPLKXPHSA-N 462.315 0.122 50 20 JCGD CCOC(=O)N(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)Cc1ccco1 1796192078 GJKZMPPXZZLSJO-ACDBMABISA-N 483.330 0.870 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(N2C(=O)C=CC2=O)cc1 1796192346 BUFKPTMPGZBYMB-NUZGMZIFSA-N 473.294 0.361 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796368605 ODZJHTOOXFKELI-KNJMQODFSA-N 463.934 0.871 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)nc1C(F)F 1796701500 FFJOXHZREHPCAD-WPLOUJSJSA-N 477.472 0.695 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1797179276 KMKPQNAXXCIHBO-WUUQAYSMSA-N 459.971 0.823 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1OC 1798894630 ZKPKHOONPZNGHF-YVWYUNDQSA-N 469.498 0.219 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2c(nc1=O)SCC2 1799074678 KEFOKPUWQBHEHC-FQLMCAECSA-N 485.404 0.655 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1)C2)NC(=O)NCc1ccccc1 1799094700 GCOPBYHCCWVAQT-VTYHHJSWSA-N 466.542 0.631 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2 1799363867 KSCLZCNHGBHHOA-YYAJDYIMSA-N 473.643 0.703 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nccn12 1799993996 ZIYCWRJGBMKNQT-IHBLFXCCSA-N 463.498 0.672 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1C#N 1801992364 HNVBHJTUNXEXOC-ZMQIZJGTSA-N 478.509 0.661 50 20 JCGD NC[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccc1 1807366041 XKBADCGBEGQULD-YFNKSVMNSA-N 472.354 0.824 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)[C@H]2Cc3ccccc3CN2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374642 HAIOGMXXBGQPND-GPXOXTDOSA-N 484.365 0.796 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374768 JBXDPYVFXDVOQO-AKZDSRSJSA-N 457.361 0.240 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1 1808323265 JMTFGPAMWWGWAO-QLBJFCOMSA-N 484.365 0.796 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc2n(n1)CCCNC2=O 1809676654 FUDHOQGUTOZODF-WBAXXEDZSA-N 460.922 0.331 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C(=O)Cn2cnnn2)[C@@H]1c1cccnc1 1811358480 GYJUMNCLNFELBA-IIBYNOLFSA-N 494.468 0.921 50 20 JCGD O=C(CN1CCSCC1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815335712 MBJMMTCSRYZLAT-OAHLLOKOSA-N 460.390 0.098 50 20 JCGD CN(C)c1ncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)o1 1816328250 YBHLBYYCXJJIIU-MRXNPFEDSA-N 452.280 0.763 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnncc2C(=O)O)[nH]n1)c1ccc(B(O)O)cc1 1817472072 GEVVCNFLWXHSQY-KRWDZBQOSA-N 464.247 0.197 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(C)C(=O)C(=O)O)[nH]n1 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O=C(COc1ccccc1O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 730782432 NOXCBIATKRZTQV-CQSZACIVSA-N 478.483 0.928 50 20 JCGD CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)CNC(=O)c3cccs3)cc2S1(=O)=O 751206112 CJQCHYVTKMZSGJ-UHFFFAOYSA-N 450.498 0.492 50 20 JCGD CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 912852253 YSFVYZHHMATDON-UHFFFAOYSA-N 459.937 0.616 50 20 JCGD COc1cc(N2C[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2=O)cc(OC)c1OC 914406143 PRPAQKRSHOXJCA-CQSZACIVSA-N 481.469 0.502 50 20 JCGD CN(C)CCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1 916382410 ACNSZFGMSREPKV-UHFFFAOYSA-N 480.635 0.831 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNC(=O)NCC3CC3)CC2=O)cc1 920860183 KTOKOXQULDFVOJ-OAHLLOKOSA-N 451.549 0.810 50 20 JCGD CC(C)N[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)C(C)C 1779373172 KHXYYOPBFZADNS-YOSAUDMPSA-N 474.606 0.835 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374162 GIKYWEXPARPVPM-QXATTWAWSA-N 460.535 0.614 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)no1 1779435690 FJXNHOXVSKVCJP-DDUZABMNSA-N 475.315 0.917 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967962 GCQFSWVMFXJOQM-NTKDMRAZSA-N 474.606 0.503 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cn[nH]c1)CCO2)NC(=O)NCc1ccccc1 1780968535 NBEQUKKFEBXBBV-QFIPXVFZSA-N 455.519 0.199 50 20 JCGD C[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)O1 1780969338 XNQCXAKSTLLRIQ-FPGHNAPASA-N 473.574 0.730 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781900087 LJTMZMNFQDRZTQ-SQGPQFPESA-N 467.169 0.667 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1782170129 XZDROLIZZPHEJC-JJPBMRITSA-N 486.374 0.473 50 20 JCGD CN1CCC(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)CC1 1782210340 QYTBBSULPFAIST-AUSIDOKSSA-N 451.612 0.605 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1ncccn1)C2 1782211871 CGPRLEDCVHZFCU-IIBYNOLFSA-N 464.592 0.456 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2 1782214040 JVVRSVHZZACOET-XNBKKKCTSA-N 497.596 0.783 50 20 JCGD COc1cccc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1783414001 OSZUAKIABFCETE-OGZUKIFOSA-N 450.300 0.532 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)CCO2 1783538421 VHPVCTFLDBTVAB-DSEONOSFSA-N 490.395 0.828 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)CCO2 1783880118 BUVPWCWWXHHYKT-IHFIDZABSA-N 465.978 0.706 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786985135 NNLDONDOISWMLG-BUKVSMQUSA-N 486.761 0.864 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nc[nH]c34)C[C@@H]21 1788610065 AEFJDSXVMFILFJ-IXDGSTSKSA-N 463.498 0.469 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cnn(Cc2ccccc2)c1 1788928555 YSTWVNIDHQOPJI-OYDLWJJNSA-N 488.353 0.518 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)nc3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726855 YCBSYEKNTGWPDQ-ACRUOGEOSA-N 496.568 0.727 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc(O)c(O)c3O)[C@H]2C1 1792217599 ANPVEYKMXVPHRU-OHLZFXOVSA-N 476.530 0.169 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cc(F)ccn1 1794026705 PASVQSXYEXVTHJ-VTEUUUEMSA-N 456.478 0.055 50 20 JCGD COc1ccc2c(c1)CC[C@@H](CC(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)c1ccc(B(O)O)cc1)C2 1795734160 GNSCOSSMHNIVHG-WUABMQKPSA-N 492.381 0.773 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)C1 1796190300 LVEMFFMKFASMFG-YRPNKDGESA-N 483.374 0.875 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)C(C)(C)O 1796371258 SIININJFCYVJGT-XVIXHAIJSA-N 451.923 0.775 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)NC(=O)c1cnccn1)C2 1796892010 VZCIOLJRGYKLKE-KKLQPOEKSA-N 480.529 0.367 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc2ccccc12 1796915965 MAZMIHMQROFHPZ-YEZVWNJWSA-N 455.515 0.517 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(OC)c1 1797752739 CVCSKPZUPLTVRZ-VTEUUUEMSA-N 469.498 0.219 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803139124 SXYIBVSTAVBTBH-ZJPYXAASSA-N 483.997 0.929 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807367864 NVYGVPNCRITXPL-CWKRKGSWSA-N 491.353 0.836 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc(O)n3c2CCCC3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374295 GXAHMLGWYZSCOF-XMSQKQJNSA-N 489.341 0.633 50 20 JCGD O=C1Cc2cc(C(=O)NC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)ccc2N1 1809683008 BGCNFKGMKIYUGO-CYFREDJKSA-N 484.321 0.889 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2nncn2c1 1809910589 JKGWODCFVNOKBB-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2cnc[nH]2)[C@H]1c1cccnc1 1810305592 MDMKEDJNPZUZQU-HXOPIXBZSA-N 460.498 0.836 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C2CCC(O)CC2)[C@H]1c1cccnc1 1810306381 XREOWUGGFWMKFN-WVWVSWFPSA-N 466.542 0.951 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1810349813 UKAZGWRAZWRBKZ-PYQAKABTSA-N 469.380 0.769 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1n[nH]cc1[N+](=O)[O-] 1810631236 FCHCCCRDGDZUTJ-KXBFYZLASA-N 464.247 0.026 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)[C@H]1c1cccnc1 1811516756 LZQGKLOZUFEIAC-BSIFCXSSSA-N 492.577 0.304 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CNC(=O)c2cccnc2)[C@@H]1c1cccnc1 1813070727 LLWPEULWAOIMBF-WZONZLPQSA-N 481.557 0.285 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1)C(Cl)Cl 1813079890 JFXNSOWORDEKBZ-GXFFZTMASA-N 451.274 0.331 50 20 JCGD COC(=O)CSCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1815224430 PKCBLKZZSJKYPC-AWEZNQCLSA-N 454.553 0.681 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348440 OBOSJMNTUNXSPF-FZMZJTMJSA-N 461.305 0.610 50 20 JCGD Cc1nc(N)sc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354565 JCMBMYJQEJVDTC-GFCCVEGCSA-N 457.346 0.710 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354846 URRCZYKEHPFUNV-XJKSGUPXSA-N 465.344 0.944 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(S(C)(=O)=O)cn2)n[nH]1 1816198344 ZUAFDAYNOYBAMI-QGZVFWFLSA-N 491.574 0.887 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3Cc4ccccc4CN3)sc2C1)c1cccc(B(O)O)c1 1817138631 LANMELVEYZPMEP-AZUAARDMSA-N 476.367 0.763 50 20 JCGD CC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817282768 LRTROLOMFJATSP-UFOJRKAESA-N 459.532 0.714 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnnn2C)[nH]n1 1818111440 KZBKMALFCNQKCQ-ZWGXDWAISA-N 452.479 0.978 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]nc3ccncc13)CC2 1819797321 SFKVKCCNLKQNNA-JTQLQIEISA-N 477.510 0.953 50 20 JCGD COc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)nn1 1820041383 BQJYJARUBKLQQS-INIZCTEOSA-N 465.474 0.827 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCCO3)CC2 1826085884 FAPUHJRNZFXQKS-LBPRGKRZSA-N 461.548 0.721 50 20 JCGD O=C(c1cc2n(n1)CCCO2)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051808 GTOGVGAUGASZBT-NRFANRHFSA-N 466.347 0.893 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828954080 UZWMNDCCDTUTIR-FGZHOGPDSA-N 488.346 0.095 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)NC=O)CCN2C(=O)OCc1ccccc1 1829228092 QSURVYUNONVFIY-LTMIRXACSA-N 494.976 0.827 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830365765 HKGJHKPJPZXKJH-AOMKIAJQSA-N 466.966 0.921 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1830668162 SAEJKMYAVGAZSG-UXHICEINSA-N 489.378 0.443 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830732825 BKFZBVXIKAEMSN-LAUBAEHRSA-N 454.907 0.533 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)ccc21 1833310613 VCSOOPMRJXEJKQ-FQEVSTJZSA-N 477.993 0.662 50 20 JCGD O=C(CCCc1ccncc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833844809 LTNGRBGFCSCWJY-UHFFFAOYSA-N 478.402 0.970 50 20 JCGD CCc1oncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1834517835 UPTZSHSBDLMCNR-BHSKHCGUSA-N 472.502 0.441 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)C1(O)CCC1 1834797735 AMPITOQJCGALBW-KRWDZBQOSA-N 457.380 0.103 50 20 JCGD Cn1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(C(F)F)n1 1834798555 KMMCWTOGZXTNFA-UHFFFAOYSA-N 489.332 0.537 50 20 JCGD O=C(NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2)c1ccc[nH]1 1834819204 KIZDLLHHNYXXEO-IBGZPJMESA-N 471.352 0.376 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834823145 LEBZXHOQQBCBQT-KSSFIOAISA-N 456.341 0.518 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)[C@H]3SC(=N)NC3=O)CC2)CC1 1835113825 KHFIQZAXVJNDKO-UHOFOFEASA-N 474.027 0.614 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCNC3=N)CCO2)C1 1835639832 FGSOBFXDGPSRJH-VAPFXODJSA-N 488.495 0.168 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cnc4cc(Cl)ccn34)C2)C1 1835928416 OHLZSGOEWWSEGD-QHCPKHFHSA-N 498.732 0.051 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1 1835931630 UHDXYVOWZFCHMB-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1835937104 OMAXFMICTZTRGX-DEOSSOPVSA-N 481.289 0.371 50 20 JCGD O=C(/C=C/c1cccs1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835964936 ZCFFRTGMWWVBJN-XYXUZSOXSA-N 456.329 0.211 50 20 JCGD O=C(NC1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1)OCc1ccccc1 1836688956 HIRXDEIVQAFYIN-GCJKJVERSA-N 495.960 0.502 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccc3)C2)C1 1837456611 LDSFDJACYZIFJZ-XMMPIXPASA-N 467.526 0.388 50 20 JCGD O=C(CC12CCCN1CCC2)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920282 WCUNNJWYCILJGS-UHFFFAOYSA-N 483.418 0.997 50 20 JCGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1838023346 WLSVPVZHHBGXGN-AWEZNQCLSA-N 486.302 0.115 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)no3)CCO2)C1 1838102156 ZIYLTBMYDGXYMA-RNODOKPDSA-N 488.925 0.582 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc3c1OCO3)CCO2 1838477976 UHIFAACKMVDYDB-FQEVSTJZSA-N 451.552 0.732 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1839153234 WUGAQYGZUWPEEI-MSOLQXFVSA-N 452.335 0.521 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1839387600 OYEACZWTEHGNTF-UPRAQXHNSA-N 484.377 0.522 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)c3ccccn3)C2)C1 1839963473 LFMNUWYTPYQPEG-URLQWDBASA-N 455.353 0.711 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1 1839965495 ZSWBLWDKYGTGCC-LBTNJELSSA-N 463.373 0.324 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCc4sccc4C3)C2)C1 1840151323 YNMGGTSCVFDEKG-DYESRHJHSA-N 472.007 0.816 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnc4nc3O)C2)C1 1840155140 QWDJTXLDBKMUKH-IERDGZPVSA-N 464.906 0.659 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cc3F)C2)C1 1840182818 JIKIHZWGHRDKAU-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)COCc3ccccc3)C2)C1 1840183930 ILKSSNYYCWNIJY-HSZRJFAPSA-N 462.547 0.033 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4c(Cl)cccc4n3)C2)C1 1840184464 ONNHZZOYVBTXRE-QFIPXVFZSA-N 492.964 0.431 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1 1840185895 ZRJUZYVERFRLBX-NRFANRHFSA-N 470.929 0.922 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840392947 AMVIMSBIOQYSHY-JTSKRJEESA-N 479.603 0.392 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccc3F)CCO2)C1 1840546489 YYNGXBKFJWEPFK-DEOSSOPVSA-N 485.516 0.527 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1cc(F)ccc1F)CCO2 1840811787 KYFUXBVOTPFENQ-QFIPXVFZSA-N 468.501 0.337 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840897750 UUZAFRFZCGPTNS-YWMZBHJASA-N 453.879 0.664 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2cn3nc(C)sc3n2)C1 1841786403 XDPISBOZRPTJPR-ZMOGYAJESA-N 468.543 0.979 50 20 JCGD O=C1C[C@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CN1Cc1cccs1 1841978767 ZLRYSTSZAJPPLT-KRWDZBQOSA-N 467.356 0.294 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1843953587 HKYUOBIOAXUBBR-QHCPKHFHSA-N 475.326 0.533 50 20 JCGD COc1cc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c([N+](=O)[O-])cc1O 1844737333 YHKIULHIKQHFPL-UHFFFAOYSA-N 455.232 0.120 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1845154487 NHMULQZSZOLGHJ-UHFFFAOYSA-N 476.534 0.043 50 20 JCGD COc1ccc(OC)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 16128189 NNOLVMROUWLYJC-UHFFFAOYSA-N 485.540 0.348 50 20 JCGD Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1ccc(Br)s1 24308017 GALCBWXTSVYTJS-UHFFFAOYSA-N 477.362 0.945 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cc(=O)[nH]c2ccccc12 25166323 RYRMONNSRCZSGG-UHFFFAOYSA-N 484.534 0.943 50 20 JCGD COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)NC1CCCCC1 725987403 KQJIMEKKKIBLMG-MRXNPFEDSA-N 454.549 0.891 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)c2ccccc2c1=O 726523621 SASWPYZSZSTXHA-CYBMUJFWSA-N 454.487 0.992 50 20 JCGD CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)CC1 727605554 NRQPCTOCJAHPNN-NRFANRHFSA-N 473.640 0.645 50 20 JCGD CCN1CCCC[C@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 729301481 CKKJUSJJTDGPPE-IBGZPJMESA-N 452.577 0.662 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1 751206666 LCODOELJHDXVJL-UHFFFAOYSA-N 476.511 0.460 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1 770406875 UZHBJIGHVLVAKZ-UHFFFAOYSA-N 464.500 0.111 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cccc(C(N)=O)c1)N(S(C)(=O)=O)CC2 913476750 URWHTOFTSKXYEV-QGZVFWFLSA-N 490.538 0.513 50 20 JCGD O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 914830851 CHPGUOTVZNYJLT-CABCVRRESA-N 462.553 0.536 50 20 JCGD NS(=O)(=O)c1ccc(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1 915188197 XMHSDHOZYDKTGW-UHFFFAOYSA-N 451.574 0.298 50 20 JCGD COc1ccc(OC)c([C@@H](O)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 916473762 YZXGVWCBVRDAGW-HNNXBMFYSA-N 451.505 0.675 50 20 JCGD C[C@H](Sc1ncccc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)N1CCCC1 1325540913 ZSAKKCZJLFEVEA-QWHCGFSZSA-N 455.562 0.316 50 20 JCGD O=C(C[C@H]1CNc2ccccc2O1)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1778934181 UKLVQPIZNOGPHJ-YADARESESA-N 465.315 0.073 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)C1 1779032758 UGJFIYPMJAGYMB-HSZRJFAPSA-N 476.497 0.023 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)C1 1780608465 APFKBKHXPHTHTN-DDIBASDRSA-N 498.584 0.214 50 20 JCGD O=C(Cn1cnnn1)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783021734 AFHZGDRWSJLHAV-QFBILLFUSA-N 463.336 0.509 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)[C@H]2OCC[C@H]21 1783545527 HEHQYYZLMNOZFB-KALGFKNASA-N 487.981 0.440 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1N(C)C)CCO2 1783934207 AMTMYLAESFTXEE-QFIPXVFZSA-N 476.534 0.477 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)CC(=O)Nc1ccc(F)cc1)CCO2 1783935947 YRFCNNHNJHJUCL-JOCHJYFZSA-N 463.510 0.357 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784084039 KMKXLXHJAWCRPB-KANFNMMFSA-N 452.935 0.985 50 20 JCGD CCOC(=O)N(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)Cc1ccco1 1784302414 KEKIKCGAOFDQQA-JXFKEZNVSA-N 457.911 0.668 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)n1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785284622 HABVKMVDTXACNM-SNRMKQJTSA-N 491.275 0.616 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786404837 WJJFMFPPLLKGNE-RFGFWPKPSA-N 454.387 0.079 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(F)cc3)[C@H]2C1 1786489682 PZMJOTTZPQZLHG-GKCIPKSASA-N 471.489 0.497 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc(OC)c1C 1788610871 CQODZNORWDLFNM-OHEPNIRZSA-N 497.552 0.918 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)[C@H](O)N3CCOCC3)CCC2)cc1 1789521161 OPRVNRUXMLEHTM-QFIPXVFZSA-N 468.514 0.083 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnc4nc3O)[C@H]2C1 1790366519 PHSJQNCKTHIHQC-SZMVWBNQSA-N 470.530 0.302 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=CCN(C(=O)OC(C)(C)C)C3)C[C@@H]21 1791288028 OQCYVPRPWQWNMO-FHWLQOOXSA-N 493.605 0.516 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792972797 VRKPTUJRODUIMM-PHGYOMLWSA-N 489.997 0.184 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C 1793088721 KFPBIDPTCOHCIP-IGNRKKQASA-N 488.379 0.938 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csnn1)C2 1793878190 CHRHNMQAVFKRFO-OPDFLTKYSA-N 459.956 0.873 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(F)c1)NC(=O)NCc1ccccc1 1794850856 HLTIFVJHRQICTO-HATOLVCRSA-N 484.532 0.770 50 20 JCGD COc1ccccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732764 HDELQGQLWSMLOV-BBIADKPPSA-N 452.316 0.211 50 20 JCGD CC#C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)c1ccc(O)cc1 1797754487 ZGGRGQAWOUNPKX-FLFXDLLNSA-N 491.548 0.791 50 20 JCGD COc1cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)ccc1[N+](=O)[O-] 1800047311 KIPFWHSHZVDRIH-REPLKXPHSA-N 467.287 0.778 50 20 JCGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)[S@](=O)c1ccccc1 1800217319 VCRMIZPRTNMENN-AQZZLDPDSA-N 464.588 0.145 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@]12C(=O)Nc1ccccc12 1801970880 BOVKLETYKWPLNN-COVFNRBESA-N 474.521 0.847 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803035802 BNWTXXPDVCOGDR-LUKYLMHMSA-N 470.954 0.573 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cc2cnccn2)[C@@H]1c1cccnc1 1803302609 WNADPEUWIQRSQG-IERDGZPVSA-N 460.498 0.432 50 20 JCGD COCC1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1803537814 SYPFAEWLVBYPHT-VQIMIIECSA-N 452.515 0.826 50 20 JCGD NC(=O)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1 1807363818 BUVGXWSWJMOLBO-RBBKRZOGSA-N 472.310 0.494 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363868 RATMXWOKWTZTKW-HOCLYGCPSA-N 497.210 0.436 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809978443 TVRHQUMCBUILBA-WPWMEQJKSA-N 479.346 0.345 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1nc(O)n2c1CCCC2 1810591027 VCYASNNEUKWQTD-PGRDOPGGSA-N 489.341 0.633 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccnc(Cl)n1 1810767268 RDPTZLXGBIVZKS-APWZRJJASA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnc2snnc2c1 1811338302 BPIXHZHMVRLYOE-OXQOHEQNSA-N 488.338 0.795 50 20 JCGD O=C(CCCn1ccnc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813352125 RZDTZNUALUEFDZ-REWPJTCUSA-N 461.331 0.758 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)C[C@H](N)c3cccnc3)sc2C1 1815178944 YPYVJOGWQFQTPY-BBRMVZONSA-N 480.554 0.853 50 20 JCGD Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3ccc(B(O)O)cc3)CC4)c(C)n2n1 1818247447 IIASFAZARGADOU-HNNXBMFYSA-N 491.342 0.417 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1819828673 QZSVXJXYIDUOBB-IUODEOHRSA-N 466.332 0.339 50 20 JCGD CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](O)N3CCOCC3)sc2C1 1819891292 OLCYQZAYAQVLMD-MMPTUQATSA-N 461.382 0.879 50 20 JCGD COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)nn1 1821066070 GSDAZSBWPHWWIN-ZDUSSCGKSA-N 453.289 0.161 50 20 JCGD Cn1cc(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1 1827055174 UNUVPFXUTWSJOT-QFIPXVFZSA-N 452.364 0.966 50 20 JCGD O=C([C@@H](O)CCl)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H]3C[C@@H](O)C3)C2)C1 1828550993 FQIVZVBRZAYKPN-YWNPBTLJSA-N 479.961 0.809 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1 1828806841 JTMUKDZRFXLXJU-QGZVFWFLSA-N 469.550 0.252 50 20 JCGD O=C(CCc1ccc(F)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830271430 FXNCUJNONDZGDY-DEOSSOPVSA-N 488.296 0.347 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1830885768 KMBUBVPLAYDWBH-BFUOFWGJSA-N 484.377 0.522 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)C1 1831643786 GXLGWIMAFPYJGY-XOBRGWDASA-N 453.927 0.104 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccnc3C)CCO2)C1 1832636993 ADXVEWOHSQKCIP-GQUZIAHASA-N 496.568 0.913 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CCC(=O)N3CCCC3)CC2)CC1 1833698118 GAOBTDWKVDIIRU-UHFFFAOYSA-N 499.616 0.273 50 20 JCGD COC1(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)CCC1 1834801365 BVNNIYSUBQDOMY-UHFFFAOYSA-N 457.380 0.511 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CSc3ncccn3)CC2)CC1 1834864407 IZAZNWXPJQOFQT-UHFFFAOYSA-N 498.613 0.453 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](F)Cl)CC4)CC3)cc21 1835080290 ILRQTXCDEMECBX-KRWDZBQOSA-N 454.934 0.736 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CN)c1ccccc1)CCO2 1835822688 JNJZSYREOBUDNW-XAUMDUMWSA-N 454.365 0.969 50 20 JCGD O=C(CCc1cccs1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935192 GBAFOXZLCVVYPF-QFIPXVFZSA-N 458.345 0.131 50 20 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451.289 0.643 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839203823 XVQFKAHFVKVMBQ-AEFFLSMTSA-N 461.332 0.726 50 20 JCGD Cc1cccc2c(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)n[nH]c12 1839596863 WSAGMHRFAVMQAV-DEOSSOPVSA-N 493.524 0.254 50 20 JCGD CCOC(=O)C1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Br)CC)C3)C2)CC1 1839762428 LNPCLNOALIYKHY-RDTXWAMCSA-N 461.353 0.960 50 20 JCGD Cc1ccccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839940855 CZMBVSPAJZZYTB-VWLOTQADSA-N 466.343 0.378 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)[C@@H](C)O4)C2)C1 1840154288 RIJIDTJGIUTXTR-WEBUEUPWSA-N 481.933 0.730 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1 1840156044 MPNPXAHDTBGJMK-AFXFGAOOSA-N 477.945 0.607 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c(C(C)(C)C)c3)C2)C1 1840183450 FJIOWGGJVTUNDD-HSZRJFAPSA-N 463.579 0.755 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4cc(Cl)ccn34)C2)C1 1840184082 QYXBOPNROJCTKL-JOCHJYFZSA-N 492.964 0.431 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nccnc4c3)C2)C1 1840184572 VTAYETVJPIPGAW-QHCPKHFHSA-N 470.530 0.073 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840190965 XQZPRUKALUWAFC-CKNLXJGOSA-N 496.388 0.617 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCCc1cccnc1)CCO2 1840513462 BPEXKKZGVAFERI-QHCPKHFHSA-N 461.563 0.234 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H](C[C@H]2CCOC2)NC(=O)OC(C)(C)C)C1 1843422969 CGYLJUAZMDYYAY-QZTJIDSGSA-N 495.621 0.883 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc3nc(Br)nn3c1)C2 1844263936 MZVYXOYPVXUUIC-UHFFFAOYSA-N 499.329 0.621 50 20 JCGD CCc1c(Br)c(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)nn1C 1846384523 CPLYNAGPIYBJAP-UHFFFAOYSA-N 469.384 0.935 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC13CN(C(=O)c1cccc(B(O)O)c1)C3)C2 1847094416 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COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C(\C)C1CC1)c(=O)n2Cc1ccccc1 918016948 ORLKUOXVXNOMBT-FOWTUZBSSA-N 480.525 0.558 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CCOc3ccc(F)cc3)CCO2)C1 1779029580 UNDVJWGFTVAZIJ-QHCPKHFHSA-N 471.489 0.737 50 20 JCGD Cc1cc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)CN(C)NC(=O)NCc2ccccc2)CCO3)n[nH]1 1779160124 FPHPKHRYBZGZCS-XMMPIXPASA-N 483.573 0.437 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cc(O)n1 1779373166 JSEISCIDSSQOFV-WZONZLPQSA-N 468.514 0.535 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc(N(C)C)o1)CCO2)NC(=O)NCc1ccccc1 1780970602 YCBFRYVPDRIBBY-XMMPIXPASA-N 499.572 0.530 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3nccn3)C2)C1 1781419902 DSMHFLVRVQVDAZ-IFXJQAMLSA-N 456.931 0.240 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4c(F)cccc4n3)C2)C1 1782370379 WJWBXHAOKHFNNB-JOCHJYFZSA-N 467.461 0.229 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1783694966 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CCC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810309316 QHZDKWRCBBYCOB-JRGCBEDISA-N 481.557 0.705 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CC(F)(F)C(=O)O)C2)CC1 1810878562 SVTWAMLSZXBMRA-UHFFFAOYSA-N 453.446 0.640 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CCn2ccnn2)[C@H]1c1cccnc1 1813430359 NOLQSAQELYWQLU-MZKCJKBZSA-N 477.529 0.903 50 20 JCGD CC(=O)Nc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)o1 1815344193 NDWPPWIFHUYFTH-CQSZACIVSA-N 468.300 0.914 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCNC(=O)C2)[nH]n1 1819404422 JZUIKEPROMCDSD-WBMJQRKESA-N 454.491 0.240 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)N1C[C@H]2C[C@@H]2C1 1819569479 BBAZTUWNACAIKY-DNNBLBMLSA-N 454.361 0.389 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN(C)C(=O)C(=O)O)CC1 1827679365 ZRCNHYIRZCRXMN-BIKZULFDSA-N 488.545 0.283 50 20 JCGD 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Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839428664 RQBMXZCDMJUFDO-BEFAXECRSA-N 459.858 0.712 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1ccccn1)CCO2 1839668091 ZZUANFIQKQJREH-CKJXQJPGSA-N 452.939 0.674 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1839682017 IJAIBADEBRBJDJ-DYVFJYSZSA-N 451.314 0.789 50 20 JCGD C/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839815126 FMBFLUSVQPCVBD-WVKANMAXSA-N 459.547 0.365 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)C2)C1 1840155045 NWUNFIXCFNPLEB-QRWLVFNGSA-N 471.894 0.933 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185225 MQIPDGHZIQDHDT-FDDCHVKYSA-N 461.563 0.090 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CCCO4)CCO2)C1 1840660113 FYVDMQZXNLMWGQ-RUZDIDTESA-N 495.536 0.394 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(NC(C)=O)c3)CCO2)C1 1840730938 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727031115 JWJFZMCRGKEVAJ-UHFFFAOYSA-N 467.592 0.916 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1 728208762 RXAHDLWYOUTRPG-OAHLLOKOSA-N 483.572 0.292 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1 728456144 DQESLAOSMLRWRO-OAQYLSRUSA-N 468.510 0.919 50 20 JCGD CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O 729276609 ISKRHHYMZKUDIJ-GWCFXTLKSA-N 495.421 0.386 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccc(C#N)cc1 747176072 JGKAOQHGCDBPLE-FIIODCPWSA-N 490.563 0.713 50 20 JCGD CCCN1CCC[C@H]1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 749566996 BVBVZRSUFOOFLJ-SFHVURJKSA-N 481.557 0.450 50 20 JCGD COC[C@@H](C)n1c(SCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nnc1-c1ccccc1 751361559 KMIDRRVFVSQIAO-UKRRQHHQSA-N 482.588 0.762 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H]1CSCCS1 863950165 ZWGURQHJCZDKNY-INIZCTEOSA-N 459.615 0.636 50 20 JCGD C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 914631949 KTAYBVCBXDAERK-QHCPKHFHSA-N 495.448 0.898 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@]2(N3CCOCC3)CCSC2)c1 916636700 KAJITKPJDPPLLB-OAQYLSRUSA-N 499.659 0.869 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3ccc(OC)c(OC)c3)cc2S1(=O)=O 916743929 JTQJDFYROUOGFM-UHFFFAOYSA-N 463.468 0.570 50 20 JCGD O=C(O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 918062220 OQKHQIGNBMYTPX-UHFFFAOYSA-N 471.488 0.932 50 20 JCGD C[C@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cc2)C1 918228232 MSFYOQLVTITWFM-KXBFYZLASA-N 458.606 0.988 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(OCC(=O)NC)c(OC)c2)c1 919687379 WJCXZNLDUAGTEH-UHFFFAOYSA-N 492.554 0.925 50 20 JCGD CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 1317917306 AORXNPPVDOELDD-UHFFFAOYSA-N 453.546 0.282 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3[nH]nc4c(Cl)cccc34)CCO2)C1 1779032783 VFUVRBRRMWRBKN-QHCPKHFHSA-N 497.943 0.901 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1 1779035000 ZDGZNHPBDCGSQI-QFIPXVFZSA-N 459.453 0.650 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779295230 BIEUBHIYWDAGMP-MGPUTAFESA-N 459.616 0.553 50 20 JCGD COc1cccnc1CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371248 KRJADYJEKAIEPR-PXDATVDWSA-N 496.568 0.849 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)nc1 1779373196 MXSLOMQKIRGIHL-AUSIDOKSSA-N 468.514 0.530 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)Nc2cccnc2)C1 1779486710 IRDXAIRFIUNRIT-VFHFUPNESA-N 495.540 0.668 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1nccnc1C(N)=O)CCO2 1780097620 ATZPTZAWJNSDFQ-JOCHJYFZSA-N 498.452 0.166 50 20 JCGD CC(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)n[nH]1 1780154813 NBOGJDFPLLFGLN-NFBKMPQASA-N 454.336 0.654 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1cccc(Cl)c1 1780930207 OLODBZQQHKCYFL-QPPBQGQZSA-N 499.760 0.341 50 20 JCGD Cc1ncc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)[nH]1 1780969632 MXTMRDBLVNNTBT-HSZRJFAPSA-N 469.546 0.508 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782788703 IKYIQZSSZQHQBA-ACJLOTCBSA-N 471.308 0.760 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1783355321 NWQZMXVXRMROQV-UGSOOPFHSA-N 471.308 0.760 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4ccccc4C3)C2)C1 1783404666 QYNXSBAVEYHAOV-KBMIEXCESA-N 463.538 0.934 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1F 1783732507 AXNUNEULKLYQPF-BXWFABGCSA-N 450.511 0.801 50 20 JCGD Cc1ccc(OCCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1783761366 RSYMLPJYDXQAAU-VJBMBRPKSA-N 466.343 0.737 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)N(C)C(=O)OC(C)(C)C 1783935675 WXEUHHMWVYMTFQ-ZHRRBRCNSA-N 469.583 0.445 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c1 1784093025 ZMFWMQIRHHAPPS-WPUCRFQZSA-N 462.927 0.422 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN3C(C)C)C2)C1 1784802582 PWNFAXTWYGMRAR-VDGDLTCWSA-N 458.563 0.823 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784813517 QTRSQOZMHQLAHI-WDSOQIARSA-N 489.378 0.263 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)no1 1788672149 TXTYBQFAGQRYRH-TZQJONAQSA-N 461.288 0.383 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(F)c1 1790049768 FWBNLCWYTARBJY-GMVOTWDCSA-N 471.489 0.740 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4O3)C[C@@H]21 1791292987 DMPDYKZRHZHCIT-QIJZPMMNSA-N 458.559 0.733 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CCN)NC(=O)OC(C)(C)C 1795584874 WCMMMAVPKHFPMR-AHDPXTMNSA-N 477.400 0.602 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cn1 1795793649 BBRWEFIKYCAMOK-DPSMYSLWSA-N 456.478 0.487 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)ccc12 1796189214 LPZWCSCKTQUKRA-ACDBMABISA-N 490.325 0.756 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796190133 WUSFZZLUDXEMDG-IYWMVGAKSA-N 487.362 0.254 50 20 JCGD CC[C@@H](C)[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095361 OXKDFBFWSCYTDR-QOXYCXOJSA-N 475.590 0.329 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1799382674 FRIHKYGIDIWUGK-MVJTYMMSSA-N 499.374 0.353 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)N1CCOCC1)C2)[C@@H](Br)Cc1ccccc1 1800434836 DMJWBQLIFHAOSL-FIRLOTFOSA-N 496.402 0.233 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1803162144 ZUMUAVSJRXDINQ-NNWRFLSQSA-N 450.348 0.565 50 20 JCGD Cn1c(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cccc1=O 1805308172 GEAFPRAYPRNWPP-XMSQKQJNSA-N 460.299 0.094 50 20 JCGD Cc1cc(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1C 1807360199 OYQDTYGKYZBCQS-WMZHIEFXSA-N 461.331 0.366 50 20 JCGD Cn1cc(CCC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1807370745 KBLIPOACEVPGJI-REWPJTCUSA-N 461.331 0.447 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n[nH]1 1807777829 YSFCLYMCQPJJDO-YWZLYKJASA-N 462.514 0.999 50 20 JCGD NC(=O)c1nccnc1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1 1808676854 WNEMUCVGLFXTAJ-DFBGVHRSSA-N 465.283 0.981 50 20 JCGD CC(C)=NO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1808846474 YCVFZQJFQHGCDE-PBEJRMEISA-N 452.320 0.882 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CC[C@H](N)C(N)=O)[C@@H]1c1cccnc1 1812777388 SAHXKTZDJKRCRH-QBYUYEEZSA-N 454.369 0.854 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812810789 OZVPCBONURMTML-RXVVDRJESA-N 482.346 0.606 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812865112 UVIZZBYNVLDFSZ-OWQGQXMQSA-N 460.137 0.864 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360742 YDBHVWDQTDLYKV-BKAYVGFPSA-N 494.338 0.819 50 20 JCGD CC(C)(C)n1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nn1 1815360778 NQSLEPFFAXOZPY-AWEZNQCLSA-N 468.348 0.709 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362016 YSRQTHUTSAFLOF-CJNGLKHVSA-N 466.328 0.911 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnncc2C(=O)O)[nH]n1)c1cccc(B(O)O)c1 1817476590 LIZDPKXTISOMRY-QGZVFWFLSA-N 464.247 0.197 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4ncccn4n3)sc2C1 1819012156 HCGWNXBQMMMPEH-NSHDSACASA-N 477.510 0.724 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)c2ccccn2)[nH]n1 1819402099 NDGIDXZNYYHEAT-HKUYNNGSSA-N 463.502 0.809 50 20 JCGD CN1CCC(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CC1 1819790007 BPEBPKFWPDQXLM-ZDUSSCGKSA-N 457.560 0.709 50 20 JCGD CNc1nsnc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819790532 GEBIWBVDXBQTEA-MRVPVSSYSA-N 473.544 0.574 50 20 JCGD CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)[nH]n1)NC(=O)NCc1ccccc1 1820711137 KRFYUVZCJDWPGL-PKOBYXMFSA-N 496.572 0.884 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1cccc(-n2cncn2)c1 1823722299 ZEDPHFUFIICMSX-QGZVFWFLSA-N 488.338 0.943 50 20 JCGD O=C1Cc2cccc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3ccc(B(O)O)cc3)CC4)c2N1 1824200396 HYSKDVNJUSBHNF-HNNXBMFYSA-N 476.323 0.857 50 20 JCGD CC(=O)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1825237463 RJRBYBNEVCYXGB-LGXUHMPSSA-N 459.532 0.715 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(CCO)CCO)sc2C1 1825329310 RJNXJSOONIUKPB-NEPJUHHUSA-N 463.398 0.515 50 20 JCGD Cc1nccn1[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1827030691 FYYUZMKPHWBFIU-WBMJQRKESA-N 453.333 0.815 50 20 JCGD O=C(c1cn2ncccc2n1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059104 FBLZZCHDAHHNCT-NRFANRHFSA-N 461.331 0.956 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)n1cncn1 1828925339 ITOFQWVZOBUAAT-DNVCBOLYSA-N 454.535 0.771 50 20 JCGD O=C(Cn1cnnn1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1829013767 BJCMMAOURNQFLO-PXNSSMCTSA-N 479.900 0.660 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1830538617 LDUOYNIRCDCMIK-XUWXXGDYSA-N 475.409 0.500 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)[C@H]3SC(=N)NC3=O)C2)C1 1830538951 WIGDQHYKERLGBV-JJFYZRJRSA-N 491.408 0.276 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1830542666 BBORMAOPOKNZAB-KYFSNAEOSA-N 486.407 0.875 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1830737370 HGACBYULYBOHSD-DYESRHJHSA-N 454.907 0.072 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CC1 1830737723 GTWINJSZNAAYRZ-JTSKRJEESA-N 487.981 0.610 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873724 URTRCLBLCGMRIA-RTBURBONSA-N 453.584 0.130 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)N1CCN(C)CC1 1831873855 AZMSQMKIHWFSPE-CTNGQTDRSA-N 464.655 0.615 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc[nH]3)C2)C1 1832549087 DUSCYEVOZVFGDH-VBKZILBWSA-N 471.942 0.612 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1 1832769123 IAHGGHBNIVUVNK-NRFANRHFSA-N 451.596 0.941 50 20 JCGD O=C(NCC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)c1cccs1 1833030926 ALCNHPYPIFFIKB-SFHVURJKSA-N 474.377 0.719 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CC2)CC1)[C@H](O)CCl 1833312692 XPAWUXOEKWHLDQ-GOSISDBHSA-N 492.964 0.463 50 20 JCGD O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1 1834421907 SPTKLQKXSGAUSE-UHFFFAOYSA-N 456.341 0.858 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)c1ccccc1)CCO2 1835288003 CXDNCLUTRLYAGJ-KRXPAMOESA-N 483.525 0.310 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc4ccccn4n3)CC2)CC1 1835737798 BAIDSVVYPZZFDP-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD Cc1n[nH]c(C)c1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835870828 GJIHVIFBMKDQDK-UHFFFAOYSA-N 453.352 0.205 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835933630 DXKJIMNFVBNANI-AREMUKBSSA-N 495.385 0.135 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCO[C@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc12 1836919250 NSCUPQOJWOWYTA-DEOSSOPVSA-N 471.558 0.919 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3ncnn3c1)CCO2 1837165334 WIMQFQPNQGHEPS-SFHVURJKSA-N 452.309 0.584 50 20 JCGD C=CC[C@@H](C(=C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837308866 CINPCXUUQGATQP-SBUREZEXSA-N 457.531 0.524 50 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466.966 0.921 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)Oc1ccccc1 1839749132 ZLYIXDZKKJLTNM-YADARESESA-N 476.574 0.673 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1 1840155577 FEXAAIICXXXCEH-IERDGZPVSA-N 450.923 0.747 50 20 JCGD C[C@H](S)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1840159054 WKWLYPIDVRGGDA-NJSLBKSFSA-N 466.000 0.893 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1cccs1 1840186031 WRINHZRWCIUMBD-HRAATJIYSA-N 452.577 0.681 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCOC1)CCO2 1840536644 UQFVRIJXILSOQS-ZHRRBRCNSA-N 477.470 0.627 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843013176 QDFKCARTJVMCOG-UHFFFAOYSA-N 455.320 0.361 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1 1844265065 RFPIITSWMAWOBJ-UHFFFAOYSA-N 451.483 0.993 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc3n(n1)Cc1ccccc1NC3=O)C2 1846385283 MFCBLMQCHLVRBW-UHFFFAOYSA-N 479.541 0.687 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1 1846385988 SAMFQZIGYVQWMF-QGZVFWFLSA-N 459.547 0.878 50 20 JCGD COc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1OC 109583115 NLGIVISFUXOLPG-UHFFFAOYSA-N 465.532 0.608 50 20 JCGD O=C(COC(=O)c1ccccc1S(=O)(=O)CC(F)F)NNC(=O)[C@H]1COc2ccccc2O1 731269553 WCOQFADNEUJWFO-OAHLLOKOSA-N 484.433 0.870 50 20 JCGD CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1 732307171 AWBPBZAFRBJWBV-CJNGLKHVSA-N 493.629 0.067 50 20 JCGD CC(=NNC(=O)C(=O)NN=C(C)c1ccc2c(c1)NC(=O)CO2)c1ccc2c(c1)NC(=O)CO2 744564750 MMMPUXKYMDCMHL-UHFFFAOYSA-N 464.438 0.729 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCN(C(=O)OC(C)(C)C)CC2)c1 744896287 XLAPHJNIIMZZAN-UHFFFAOYSA-N 498.606 0.434 50 20 JCGD Cc1nnc2ccc(C(=O)NNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)cn12 749715511 QLHANAUOZRXKIF-UHFFFAOYSA-N 472.527 0.452 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)n1 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Cc1nc2ccc(F)cn2c1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1782303527 SNFOSJFDURXZKD-HSZRJFAPSA-N 466.278 0.219 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1782850369 MNQAJGLAVGAOPT-RNODOKPDSA-N 486.495 0.346 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1 1783448701 CCHGQFUJEULAJQ-DFBJGRDBSA-N 499.373 0.067 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1 1783535201 ASTVUOOSQYCKNJ-BIENJYKASA-N 453.337 0.813 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cn1ccc3ccc([N+](=O)[O-])cc31)CCO2 1783933432 JKNFEGBBRISWQD-QHCPKHFHSA-N 486.529 0.752 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935753 WKWSXFVIOHYWHN-QFIPXVFZSA-N 491.501 0.337 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1 1784084014 KELVENKORZPWMP-FQQAFBJJSA-N 488.006 0.241 50 20 JCGD Cc1nccn1CCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1784409638 MABPBVLJIUJVGT-QFIPXVFZSA-N 455.519 0.114 50 20 JCGD CC(C)(C)n1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cn1 1785618700 NLXYVGDTJOEHFZ-VDGAXYAQSA-N 454.336 0.225 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3)[C@H]2C1 1786670392 FLBTUKFOOXCQFU-QMVFFVFNSA-N 467.526 0.834 50 20 JCGD Cc1cc(C)c(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(C)c1 1786978633 GBGWGKSTNDZTAQ-PMVMPFDFSA-N 480.370 0.964 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786983548 NORULGCILJADDB-NYVOZVTQSA-N 454.307 0.650 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CO)NC(=O)OC(C)(C)C)[C@H]2C1 1787395248 DFVMALKXHXAYFG-YTFOTSKYSA-N 478.384 0.635 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1snnc1C1CC1 1787736994 OGXJVXOJFXQCPH-XIRDDKMYSA-N 456.333 0.002 50 20 JCGD Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c(C)s1 1788611757 ZKSSYGZAHJIMGP-FNHZYXHNSA-N 472.571 0.594 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1792847668 PLBBZGYRHLUIFJ-XQLPTFJDSA-N 460.535 0.850 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2 1792873660 GDRYJGWGGHEOCX-VVSAWPALSA-N 464.357 0.450 50 20 JCGD CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1793445469 JLIGTAHUSGYCBV-KEDVTSPUSA-N 452.939 0.990 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnnc1)C2 1793878149 ABMMPAXKMDJXGN-FZKCQIBNSA-N 453.927 0.812 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@H]1CCc2nc(O)nc(O)c2C1 1794109238 XXSWOOIAEJBNGQ-OVZMXSCWSA-N 469.336 0.367 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNCP(=O)(O)O)C2 1794142552 GTGHZWCDQQSHEW-CRWXNKLISA-N 482.902 0.482 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Oc1ccccn1)C2 1796445707 HWSUQTDEVYULRW-WYQRWVTPSA-N 468.514 0.573 50 20 JCGD CC(=O)Nc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)ccn1 1797245358 BBMRJBQHBOCEIG-MUJYYYPQSA-N 451.487 0.604 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC1(F)F)C2)NC(=O)NCc1ccccc1 1799097632 QYVPXXVILXIKQJ-ZMMAXQRCSA-N 465.501 0.577 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@H]1CCOC1)C2)NC(=O)NCc1ccccc1 1799099383 VXZKZHPZZATKKK-JCUDRXCFSA-N 487.601 0.739 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)N1CCOCC1)C2 1799219761 NMDSQGZOQCQLGZ-JEZSTIGHSA-N 476.486 0.423 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)Nc1c(C)cccc1C 1799280549 OWJAULNADODPNH-HMALFNAQSA-N 494.552 0.966 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(B(O)O)cc1 1800865241 ZOPYSUBUZFWGLF-MUJYYYPQSA-N 463.259 0.717 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)[C@@H](C)O3)C2 1800979070 RKCJKFDLIZSYJG-UDUPSFLGSA-N 451.907 0.863 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1[C@H]3CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C3)C2 1801427238 VCULSZFPTBOIIT-FJIDUMEYSA-N 488.589 0.633 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802332388 BFCGQKBRBLIDOT-YVSFHVDLSA-N 469.583 0.537 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807154998 GSQSUPRZGSUQIG-NYDSKATKSA-N 473.342 0.977 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360049 GQVFNVHPXPUDTN-UZLBHIALSA-N 463.259 0.631 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375170 PPYLOUUAIQJRDQ-CNDZOEFASA-N 461.331 0.847 50 20 JCGD O=C(CNC(=O)c1ccco1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807588575 PTZNBGGLLFWQTC-GCJKJVERSA-N 476.298 0.104 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807945727 GYJYAROKKGVULN-KDOFPFPSSA-N 470.566 0.379 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1 1808278393 KGXFFZUIFQIAKL-NYIXFNJESA-N 492.496 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1 1809986208 ZDEUIQZUWPHYDZ-VGSWGCGISA-N 453.547 0.917 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812716550 BDGFHKMTDFABOP-KPFFTGBYSA-N 461.390 0.610 50 20 JCGD O=C(CN1CCSCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1814414901 PCESJKIQYIRQDT-SFHVURJKSA-N 457.365 0.444 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nccnc2C(N)=O)[nH]n1 1818112600 BAHYIFCUBLLPLA-VQFVUHPTSA-N 492.500 0.739 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819400213 DVUQVBKRMKISLH-WBVHZDCISA-N 456.507 0.629 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)no1 1819403399 JNPMQVWKPFBTFG-QGZVFWFLSA-N 495.500 0.441 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)/C=N/O[C@H]3CCCCO3)sc2C1 1819905343 ZPWDHZRFOXGTPT-FUYLHOASSA-N 487.542 0.896 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](N)CN)CCN2C(=O)OCc2ccccc2)C1 1829049071 DSDIOFQLVMUNET-NPPFBWRTSA-N 465.982 0.742 50 20 JCGD Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1F 1830100809 SBRGARRWFFVPOD-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830738493 PEDMWRXBJIHYGZ-UGKGYDQZSA-N 453.967 0.741 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cnn3c2OCCC3)CC1 1830879142 KGXRPLNSTLIFLF-OAQYLSRUSA-N 466.347 0.893 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1 1831119178 PTYJVNPPENUMGW-GOSISDBHSA-N 483.529 0.493 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1831318128 MZFQJIJALFXCLI-KSSFIOAISA-N 453.989 0.036 50 20 JCGD CC(C)[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549961 YZPWOKICZZGQJR-QYWGDWMGSA-N 477.986 0.592 50 20 JCGD O=C(c1cnnc(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1833209710 VACWQKVLAJMOGB-SWLSCSKDSA-N 451.680 0.891 50 20 JCGD CC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1834871202 WUFOKEMXBDIYBH-JOCHJYFZSA-N 477.470 0.959 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1 1835212521 ABDYYKHIBLILQJ-FOIQADDNSA-N 463.959 0.564 50 20 JCGD O=C1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)N1 1835312271 VIEUPAHTPYINOU-HMFYCAOWSA-N 494.386 0.728 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C=O)s1)CCO2 1835943349 HVFUPVLJFUOKSQ-NMWDDECMSA-N 487.538 0.765 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836781389 QRKKQDORMAPDPI-XOBRGWDASA-N 498.378 0.260 50 20 JCGD COc1nccnc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837291295 QCNPHQUKGYQMHZ-UHFFFAOYSA-N 483.529 0.410 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)n1ccccc1=O 1837684380 QTOBLDHAYLXQRA-KXBFYZLASA-N 456.337 0.651 50 20 JCGD O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1 1837990193 QJHAZSUGMYSACL-INIZCTEOSA-N 462.931 0.985 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(N(C)C)c1)CCO2 1838923807 ARJXBBINEOAQCU-RPUKTSEFSA-N 496.568 0.957 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1838928579 IGGPYYZZEPFASA-HSZRJFAPSA-N 469.498 0.078 50 20 JCGD O=C(c1cnc2snnc2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200489 LYERJWWCQCJYDZ-MLGOLLRUSA-N 474.312 0.847 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1840034017 YBVYYUPJSADWMX-SCLBCKFNSA-N 455.309 0.260 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1 1840155060 OQGYPLCOKYGZGA-JTSKRJEESA-N 465.934 0.895 50 20 JCGD C/C(=C\c1cccs1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182480 DQZVMWSPTGJMIX-BRBKRDGESA-N 464.588 0.981 50 20 JCGD CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840914220 OQQJDQDRKHEJAJ-HOIFWPIMSA-N 492.013 0.982 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012323 CENYNOWQSXCGPW-IHPCNDPISA-N 483.374 0.971 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CCN1C(=O)OC(C)(C)C 1843012860 NPKNJFARAWUGLY-LPHOPBHVSA-N 471.363 0.829 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844265574 PZZVIWJHDGSJIA-SHTZXODSSA-N 472.546 0.805 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C)C2 1846384118 GFDHLYCAJOWRMU-MRXNPFEDSA-N 467.567 0.199 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc[n+]([O-])c1)NC(=O)NCc1ccccc1 1848291773 HGTKSUITLGSRGI-PMACEKPBSA-N 452.515 0.482 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cn1C 109572278 YCPSQMIHMQCFIC-UHFFFAOYSA-N 450.477 0.499 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)cc1OC 725992696 DWYXSISFDXMREQ-UHFFFAOYSA-N 469.447 0.832 50 20 JCGD CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1Br 729181276 VNHUKCNOMVFMCC-UHFFFAOYSA-N 489.373 0.952 50 20 JCGD COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)cc1 729275011 JMQNHHVVFYJGRD-ZDUSSCGKSA-N 484.556 0.219 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)NC(C)(C)C)ccc1Br 744446811 OOZCCLBDDBRAFP-UHFFFAOYSA-N 463.354 0.812 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1 746387080 BXZLCXZYTOKVGF-AWEZNQCLSA-N 469.336 0.156 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCNC(=O)Cc2cccc(F)c2)cc1 749014045 FBIMYMJMJDKYSE-UHFFFAOYSA-N 479.534 0.444 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1 751203469 PTUYPFFZMULNFJ-UHFFFAOYSA-N 458.543 0.270 50 20 JCGD CN(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 789852153 CYNLKLKNHWSTNU-QGZVFWFLSA-N 463.468 0.081 50 20 JCGD N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)[C@H]3CC(=O)N([C@@H]4CCS(=O)(=O)C4)C3)cc2)cc1 914459263 QAVPIOYWQTZNFW-VQTJNVASSA-N 496.545 0.787 50 20 JCGD COc1cccc(C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n2nnnc2C)c1 916108640 FBJGQSZIQLWYME-IBGZPJMESA-N 487.542 0.485 50 20 JCGD CC(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1CCN(C)CC1 916258135 LCNHKIJWKKCXKV-GOSISDBHSA-N 454.597 0.153 50 20 JCGD CCN(CCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)S(C)(=O)=O 918118771 ATQDFMPDHBHQGD-UHFFFAOYSA-N 475.593 0.087 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CN(C(C)=O)c3ccccc3O2)cc1OC 920056821 DHWTXKHCWKWWRS-IBGZPJMESA-N 457.439 0.822 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)[C@H]2CCS(=O)(=O)C2)cc1 920851177 CDYIWQDLXJJHEQ-QMJOVRGKSA-N 471.539 0.987 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cncnc1C)N(S(C)(=O)=O)CC2 1317885951 FMWLOQKOOIPMMT-INIZCTEOSA-N 463.516 0.512 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C(=O)O)ncn1)C2 1778091488 SIIFPXLCDGDJRP-QCLQCBKUSA-N 497.512 0.436 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc2ccccn12 1778580875 BBOATXHXJMUSJB-HYBUGGRVSA-N 462.315 0.455 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)ccc21 1778611550 ODCREKVMHOJBDE-NJNPRVFISA-N 464.950 0.604 50 20 JCGD CNC(=S)NCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1779040129 SPFRPHBNSTZAGU-NRFANRHFSA-N 493.542 0.448 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cn2ccsc2n1 1779088859 WSKRVNGWESIICC-XMSQKQJNSA-N 468.344 0.517 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc(Cl)n1 1779793193 BGQYBGTXCRATJB-OAQYLSRUSA-N 474.905 0.499 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968625 OQBLVWVTXFXDMG-CPJSRVTESA-N 487.601 0.736 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1781231787 FJUGWURUFDULJS-PMACEKPBSA-N 485.405 0.749 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781231789 FJUGWURUFDULJS-UXHICEINSA-N 485.405 0.749 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1783666328 JMMGFUXAHYCZRI-DOTOQJQBSA-N 455.321 0.577 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ncn(-c3cccc(F)c3)n1)CCO2 1783936595 PZFFZKRDFBOMMZ-QFIPXVFZSA-N 473.509 0.223 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c1 1784091593 YKJJRUYSJFBLDS-FRJURHEUSA-N 454.911 0.854 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)C1 1784343304 LBIJWOUXTCAVIF-JBACZVJFSA-N 499.373 0.137 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C2)C1 1785151416 HDCMRISVBJNHDN-XMMPIXPASA-N 460.299 0.514 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(Cl)c(F)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978742 PGWPOFASRPHEQR-XERREHJYSA-N 490.724 0.831 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786983651 ZHTDXQACJFUNBF-VJBMBRPKSA-N 479.342 0.161 50 20 JCGD CCN(CC)C[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609713 CGQGNNLMOINMDK-FVCZOJIISA-N 460.579 0.256 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1 1791063724 QQUWBOFGPYPTLB-XSLAGTTESA-N 495.411 0.446 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CO)c(F)c3)C[C@@H]21 1791292189 DDRVZBDPBCQKBH-LNLFQRSKSA-N 450.511 0.284 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(N3CCN(C)CC3)CC1)C2 1792873603 FLPMJFUUDOBDNS-WCXIOVBPSA-N 457.413 0.387 50 20 JCGD CC(=O)c1ccc(OCCCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1793094810 WZGYWFMWNPUFIE-GQEURGSBSA-N 494.353 0.631 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2 1793879928 KBSWHHQHSZTRKD-OPDFLTKYSA-N 486.913 0.653 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CCN)NC(=O)OC(C)(C)C 1795584711 MGDOLRMJQCCKIK-YIDVYQOGSA-N 462.975 0.072 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(F)cc(F)cc3[nH]1)C2)c1ccc(B(O)O)cc1 1795734672 YWMSPZPVVXUZSD-GFENJXEQSA-N 469.253 0.643 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cc[nH]n3)n3ccccc13)C2)c1cccc(B(O)O)c1 1795739125 ONZCRVQJVQGGTC-MRSFGVLCSA-N 499.336 0.526 50 20 JCGD C[C@H]1Oc2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)cc2NC1=O 1796188572 VZBRETROEQNERA-CODKJTEISA-N 463.299 0.651 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796368032 BDGKKPIWOGIYFM-CUZKYEQNSA-N 465.906 0.567 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc2ncsc12 1797500420 VPFGGNIACNVUGX-CCWDJLKJSA-N 451.313 0.493 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1799683970 VFUBIXIVELEVLQ-FBUUZDRASA-N 454.293 0.110 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1800801590 OGVVBYODHJLUTM-BUONHZGMSA-N 465.906 0.567 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(O)c1)NC(=O)NCc1ccccc1 1800810221 HUAZYGVHTQRRCI-HATOLVCRSA-N 482.541 0.337 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801017933 AZZUOTYHHZTYCU-GFQSEFKGSA-N 482.361 0.836 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)C1 1804549623 KDURJPHOZFZULB-QDMKHBRRSA-N 490.536 0.896 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)CC1 1806538591 MTSNWLYENYXOHR-UHFFFAOYSA-N 468.448 0.946 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807368042 PPEPQAXVMASJPM-QPPBQGQZSA-N 499.373 0.151 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807374097 XUPLUNCKQWZNGQ-FPOVZHCZSA-N 496.373 0.994 50 20 JCGD CN1CCC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C1 1807540237 FGYBANLSKBPUJI-RZUBCFFCSA-N 450.348 0.423 50 20 JCGD CN(C)c1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)nc1 1807736202 OWKMMNKSPXLFCL-UHFFFAOYSA-N 450.348 0.986 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CS(C)(=O)=O)[C@H]1c1cccnc1 1808415553 YDAVFVPYWPTVKP-RIDCJQHESA-N 474.543 0.266 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1 1809356460 UGSKBDZQZGONGB-KKSFZXQISA-N 485.508 0.756 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1810239338 LCZTXHKQZFCYHU-OXFYSEKESA-N 461.567 0.168 50 20 JCGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1 1810488175 PGSKFNMIBFBRMM-LBPRGKRZSA-N 456.276 0.348 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1 1813032327 GTDMFQDDUVMKJP-RSPOEFSDSA-N 451.999 0.977 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)c4cccc(B(O)O)c4)n[nH]3)CC2)CC1 1817476741 BHJDCQMKDKKUNO-HXUWFJFHSA-N 480.378 0.175 50 20 JCGD Cc1cnn(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c1 1819797415 VIXITJYEQTWRTO-GFCCVEGCSA-N 454.516 0.573 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)sc2C1 1825691414 YJCBVZMPQMSGLS-IQDSPRDJSA-N 456.528 0.935 50 20 JCGD CNc1nsnc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826081399 QLIRYLLJCUMCQD-VIFPVBQESA-N 452.566 0.635 50 20 JCGD COc1nccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827056123 PEEQJCQMYJTSDD-IBGZPJMESA-N 452.320 0.712 50 20 JCGD O=C(C(O)O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1828525310 OSWOXNFNKMIBHY-LIRRHRJNSA-N 488.310 0.440 50 20 JCGD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)nn1C 1829842960 LVVXPXYALXWJLV-FQEVSTJZSA-N 454.336 0.656 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2 1830929743 AIPQDGYGFWCZLZ-IUGJCLRESA-N 497.552 0.975 50 20 JCGD COc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc(OC)c1OC 1832100242 SQKBKRXPUZJXJL-KSFYIVLOSA-N 486.949 0.311 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2 1832392812 MFDJHNOCZFQDPA-HSZRJFAPSA-N 476.549 0.687 50 20 JCGD O=C(C1CCC(CO)CC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1832522914 WGKCORDDVWWYHE-HNFMNYKYSA-N 451.333 0.932 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1 1832648804 GJMRBMFJOOBVJB-RDUCDJESSA-N 455.471 0.062 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccnc1Cl 1833007703 HRMPDPWXEWUDPB-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(C(F)F)c1)CCO2 1833319058 KLNYJVFKMABIDL-QFIPXVFZSA-N 475.257 0.083 50 20 JCGD COc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1834129457 XHYAUOPTVYHEIY-LRULAXNGSA-N 484.513 0.294 50 20 JCGD Cc1ccn(C)c1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800956 CEQWRLCXADOWJR-UHFFFAOYSA-N 452.364 0.512 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cnc(O)nc1O 1835072511 WUMGZWQYZZUOSH-ZDUSSCGKSA-N 460.304 0.764 50 20 JCGD Cc1nc[nH]c1CSCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835690555 KOOAEOOWRBIBSY-UHFFFAOYSA-N 499.446 0.517 50 20 JCGD O=C(c1cccc(-c2cnco2)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931899 GDVGXZMBJIEDDI-VWLOTQADSA-N 491.309 0.405 50 20 JCGD Cc1ccc(SCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835937385 SOFZQFPTFKMCAF-DEOSSOPVSA-N 484.383 0.537 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1)[C@H](F)Br 1836414081 WDIUCHQEMYWAJQ-CABCVRRESA-N 468.389 0.826 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)o1 1837453712 NSJFTXYNUWLQEM-RHSMWYFYSA-N 462.272 0.999 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n1 1837658864 DCXXNKZTMISBOL-KXBFYZLASA-N 489.342 0.434 50 20 JCGD CC(C)(C)NCC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837857186 DTQSJSZMYDWYAY-UHFFFAOYSA-N 460.579 0.685 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1 1838394538 HPKIGQJVFKSGKB-UHFFFAOYSA-N 457.491 0.040 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncn(C)n3)C2)C1 1838527443 SVIDRPWPXRYJPV-NRFANRHFSA-N 488.457 0.032 50 20 JCGD O=C1CCCCN1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202563 JQYFJYJOCHJGDI-RDJZCZTQSA-N 450.305 0.146 50 20 JCGD O=C(c1nc2ccc(F)cn2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202577 KENGHGMYQYPZKY-CXAGYDPISA-N 474.262 0.629 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(=O)Nc3cc(C)on3)C2)C1 1840152856 WXGSYXKZMVDAAT-LIRRHRJNSA-N 458.899 0.022 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@](C)(O)CC(=O)O)CCO2)C1 1840182148 XUPUYFSWGLXCBN-DOPJRALCSA-N 465.341 0.232 50 20 JCGD Cc1ccncc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840182236 ABHBQCKZXNRBFC-HSZRJFAPSA-N 461.563 0.152 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840739376 CKFNXRRJSMKIIY-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1843347147 MTMLVFBJQPRGAW-KRWDZBQOSA-N 488.545 0.138 50 20 JCGD C[C@@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)N1C[C@H]2C[C@H]2C1 1844192479 RRZMNKCAKCJWDR-SESVDKBCSA-N 468.602 0.876 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C[C@@H]2C[C@@H]21 1844263297 OIRZSKSSFQOWMP-WBAXXEDZSA-N 484.557 0.900 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CCCC34CN(C(=O)CO[Si](C)(C)C)C4)csc2n(C)c1=O 1845014237 KOTQRVCATYCFKV-UHFFFAOYSA-N 478.647 0.896 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cc(O)ncn1)C2)NC(=O)NCc1ccccc1 1845038189 BWLRECHGSXMWLE-UHFFFAOYSA-N 453.503 0.345 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cn3ncccc3n1)C2)NC(=O)NCc1ccccc1 1845038872 CDFOSJGCRMBWNW-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C[C@H]1C=CCC1)c(=O)n2Cc1ccccc1 10161649 OPILPVJNCAQZPI-KRWDZBQOSA-N 480.525 0.558 50 20 JCGD O=C(Cn1c(=O)cnc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 20901119 WMNOHSXSYHXFDU-UHFFFAOYSA-N 455.496 0.642 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)c1 725907942 ULPZOAVSEJYBBB-UHFFFAOYSA-N 460.921 0.313 50 20 JCGD C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)c3cnccn3)cc2)C1 728261112 XRVANIYTGFQFJJ-KBPBESRZSA-N 453.546 0.767 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cccc3c2OCCO3)cc1 751263289 XTOXHHCYRZHQEX-UHFFFAOYSA-N 455.514 0.396 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc(OC)c1OC 912920827 DUWZEXTWFHXJIV-OKILXGFUSA-N 452.508 0.089 50 20 JCGD COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)ccc1OC(C)C 912953175 TYEJGWYYEYGNQH-GJZGRUSLSA-N 453.517 0.279 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)c2ccccc2c1=O 913572983 BTJMQFXTZXGDJD-OAHLLOKOSA-N 485.522 0.466 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)C3CCCC3)CC2)cc1 914848993 MHZYINBADPMOAO-UHFFFAOYSA-N 450.561 0.946 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C2CC2)C3=O)c1 917109090 YZEAXCAUAWKAES-UHFFFAOYSA-N 463.493 0.472 50 20 JCGD Cc1nccn1-c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1 918113324 SOHDPCRGSSLSKH-UHFFFAOYSA-N 457.516 0.970 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(NS(C)(=O)=O)ccc2O)cc1 919810711 YXMPNRBIIGDYFP-UHFFFAOYSA-N 470.529 0.154 50 20 JCGD Cc1c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)nc2ccccn12 1778494920 KORJMXIRCIYVNK-CJFMBICVSA-N 476.342 0.764 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(F)(F)F)CCO2 1779028067 BSRKKWRHBSJOOQ-FQEVSTJZSA-N 478.431 0.856 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3c1OCC3)CCO2 1779030677 TULHNFLXFMDIMB-QHCPKHFHSA-N 451.483 0.377 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2 1779203729 ONDPJZMCEGAOMG-AQNCSGRASA-N 454.351 0.801 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)n1ccnn1)CCO2 1780098275 HHGUEVHNXBZOPT-SZNDQCEHSA-N 472.458 0.816 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2NC1=O 1780181637 XUVPTGJJEVESAQ-NPMXOYFQSA-N 473.530 0.223 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnn2cccc(F)c12 1781424951 DUUCVLLKQVEGLP-HYBUGGRVSA-N 480.305 0.595 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(Br)cc3O)C2)C1 1781524829 MRRVHRODIIXUPB-NRFANRHFSA-N 489.131 0.592 50 20 JCGD COc1c(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc(F)c1F 1781847060 PLZSLIQMEALTDM-OAQYLSRUSA-N 454.474 0.790 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1OCC1CC1 1781883473 MTWYYUQQDZYJNF-SANMLTNESA-N 494.353 0.921 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)CC[C@H]3CCOC3)C2)C1)NC(=O)NCc1ccccc1 1784817158 XLYJXCRNTYFIPM-OFVILXPXSA-N 487.601 0.979 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 1785532071 LWHHPXTZELYDMD-NRFANRHFSA-N 465.482 0.479 50 20 JCGD CCC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)n1cccc1 1787462300 FYSMIQPVTIUZNL-QESAQDPVSA-N 453.348 0.803 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)C[C@@H]21 1787507736 NSIFFUACIOQLFR-MDYHZDBPSA-N 457.556 0.975 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3Cl)C[C@@H]21 1788611383 XXJUXGSXPXRJOC-IWEFOYFVSA-N 458.906 0.641 50 20 JCGD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)[C@@H]1SC(=N)NC1=O 1788632414 CBIIJFKUOXHHNO-UGSOOPFHSA-N 480.355 0.917 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21 1788638569 DRLGSCBNMXJVBM-CUXOXCPVSA-N 463.325 0.244 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Br)cn3)[C@H]2C1 1788833183 MVTNHOYKTSUYEF-QRTARXTBSA-N 482.379 0.810 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)Cn3ccncc3=O)CCC2)cc1 1789521962 QZTOJDWJCFBGSY-UHFFFAOYSA-N 461.482 0.690 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnn3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726683 MTLBYTYZHONSBW-ZJOUEHCJSA-N 481.557 0.416 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]3C1)C2 1791257515 LBEZSDQXPYQTJY-RDHIYWLCSA-N 496.992 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C)c1C(F)(F)F 1794275987 GHDZLRJMZJDLIP-DRXBFXEBSA-N 460.457 0.015 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cccc(OCC(F)(F)F)n1 1794335079 KSXUPKQVPUIAQA-NDPMZMCLSA-N 451.829 0.826 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C)noc1N 1795572143 XOFDHWVLHJRFND-IVWMJMPLSA-N 473.442 0.916 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCO3)C2)c1ccc(B(O)O)cc1 1795737011 SCPSHDILXYXWOJ-HATOLVCRSA-N 450.300 0.208 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccccc1=O)NC(=O)NCc1ccccc1 1796223840 YRQHOSMSHVWTGC-WKCHPHFGSA-N 480.569 0.833 50 20 JCGD Cc1ccc(COCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1C 1796471247 YIKPRLACZXEDDD-RUMRUAAYSA-N 466.343 0.403 50 20 JCGD CN[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C(=O)O 1799217950 NWVDXOPTFHWPJT-UMPJEAMMSA-N 462.459 0.835 50 20 JCGD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc([N+](=O)[O-])c1OC 1800821393 ROWPFOBFGIOAKS-BCDXTJNWSA-N 483.286 0.857 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(S(C)(=O)=O)ccc1F)C2 1800979670 UHQLWGNDHSCYSV-DJZPMSPPSA-N 462.927 0.686 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1802141164 KDSRZLZPQAQDSG-DBWAAGBOSA-N 459.971 0.869 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)CC1 1806977738 OMWUYXBVYZFUDL-UHFFFAOYSA-N 481.557 0.678 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1807373323 BLDFHFDNXOZKCD-QPPBQGQZSA-N 475.358 0.985 50 20 JCGD Cn1cc(F)cc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373940 DRTFCFRPYMFKOR-LAUBAEHRSA-N 450.279 0.872 50 20 JCGD CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807944209 NZQRGBIWPYNDBE-BBRMVZONSA-N 458.910 0.792 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCN2CCOC2=O)[C@H]1c1cccnc1 1810303301 QBVUGJNJACJCKR-JXFKEZNVSA-N 481.513 0.242 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(C)(C)NCCC#N)[C@H]1c1cccnc1 1813071428 PXNPFJCODPWFPJ-RXVVDRJESA-N 457.579 0.742 50 20 JCGD CN(C)c1ncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)o1 1816328249 YBHLBYYCXJJIIU-INIZCTEOSA-N 452.280 0.763 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C=CCN1)CC2)NC(=O)NCc1ccccc1 1822518471 PCMQGHMMPVZSEY-AEFFLSMTSA-N 483.598 0.929 50 20 JCGD O=C(c1nc2ccccn2n1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052848 JXQAEILZNJONOA-FQEVSTJZSA-N 461.331 0.956 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN)CCN2C(=O)OCc2ccccc2)C1 1828961288 NEOGPQBKETTYRT-LAUBAEHRSA-N 452.939 0.651 50 20 JCGD O=C(CCc1ccc(F)c(F)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830271432 FXNCUJNONDZGDY-XMMPIXPASA-N 488.296 0.347 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CCCC1)CCO2 1830319183 SSMCZQLWTIBKBJ-AREMUKBSSA-N 492.381 0.948 50 20 JCGD O=C(c1ccc(Br)c(O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732817 BFCMBJQWANEWPF-QAPCUYQASA-N 477.739 0.824 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830737011 CJTRRAOHVFSYJQ-XFQAVAEZSA-N 475.970 0.512 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)nn3C)CCO2)C1 1833446850 SAXKSJIHILJJNQ-FZKQIMNGSA-N 459.341 0.672 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835116491 SXMTZDNRTZCDQX-CICSQNLLSA-N 470.574 0.730 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CC1 1835510844 JQBJTKRBIPLJSV-LJQANCHMSA-N 490.418 0.413 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)Cc3ccccc3)CC2)CC1 1835738233 NPMFUQULCADQSH-QHCPKHFHSA-N 494.596 0.474 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1 1835837358 IELUBKZRKZVCIH-SFHVURJKSA-N 459.685 0.987 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](NC(C)C)C(C)C)CCO2 1835898409 SQRWXTYYLQUNQJ-WOUWVXCYSA-N 490.605 0.599 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835934261 RVDHVWRBFSQRDF-VWLOTQADSA-N 482.342 0.132 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1 1835939622 VUXMZUOEAPJNDI-QHCPKHFHSA-N 498.732 0.280 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1nn[nH]c1C(F)(F)F 1836176084 HIFKOIWRJVIRPK-UHFFFAOYSA-N 494.283 0.002 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2)C1 1836473379 FVFGTAASFDBQHZ-BIENJYKASA-N 494.383 0.112 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1836640493 KSUBXGZMCYNFFH-GCKMJXCFSA-N 475.970 0.300 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCC4)CCO2)C1 1837088225 BXKLIVBERHXGOV-KUHUBIRLSA-N 455.353 0.930 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837634138 XIFGJYDRBOPWAR-YVLOFKIZSA-N 498.374 0.939 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cc[nH]c4cc3F)CCO2)C1 1838573849 GIMDLTJEPGZIQW-DEOSSOPVSA-N 496.499 0.689 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)ccc1C 1838986981 QDLRWPARIBQYMS-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CC(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054295 RRLKLMOGOYQVCC-XMMPIXPASA-N 491.589 0.214 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)C(=O)c1ccccc1 1839198563 ITMSRSBSIKKSDQ-YLJYHZDGSA-N 486.338 0.906 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1839693699 URWGRGQDGMNGKE-PGRDOPGGSA-N 450.967 0.857 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCS1(=O)=O)CCO2 1839780114 ZIHXTVDWFDAGIT-JKIFEVAISA-N 467.382 0.051 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3ccccc3=O)C2)C1 1839964492 SRYPBLYZXGOXDP-KXBFYZLASA-N 456.337 0.478 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)C(F)(F)F)C2)C1 1839966367 CDQPJFGDYUKTBM-NHYWBVRUSA-N 474.274 0.295 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(F)cc1F)CCO2 1839980008 SLRKJSHAAYLLAT-QFIPXVFZSA-N 468.501 0.337 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n(C(F)F)n3)C2)C1 1840153896 FFUNBPNQTRPIDZ-UGSOOPFHSA-N 450.870 0.910 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)ccc3F)C2)C1 1840187367 VZTLEDNVTAAFPK-JOCHJYFZSA-N 468.501 0.337 50 20 JCGD Cn1c(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc2c[nH]c3nccc-3c21 1843014326 XMOHDLGSGVZPGB-UHFFFAOYSA-N 457.299 0.817 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)cc2)C(=O)C1 1843014371 COFZHJMIANOMKS-UHFFFAOYSA-N 460.299 0.610 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(Cl)c3nncn3c2)C1 1844226534 UCJMNAVFYUPMEW-UHFFFAOYSA-N 454.878 0.512 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)ccc12 1844263913 KPEQNQKIYOFASF-UHFFFAOYSA-N 491.508 0.640 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1847131910 FQBHPFXLLOHNBL-ROUUACIJSA-N 475.326 0.531 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccnc1O)c(=O)n2Cc1ccccc1 10161596 ISRLAKISQMCQRZ-UHFFFAOYSA-N 491.508 0.626 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1c[nH]c2ccccc12 14799079 WQBGLTLZNAQMKK-GOSISDBHSA-N 478.552 0.711 50 20 JCGD O=C(CS[C@@H]1CCS(=O)(=O)C1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 725907561 LOJUINVTCHPHGH-QGZVFWFLSA-N 497.620 0.846 50 20 JCGD CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728342152 GJTQLLJYMIPKSP-PKOBYXMFSA-N 456.455 0.367 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)n1 728732906 UUIXSBZJULCQFM-JTQLQIEISA-N 452.411 0.848 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(C(C)=O)cn1C)c(=O)n2Cc1ccccc1 789855548 PJYGTSPVJUTOAT-UHFFFAOYSA-N 491.508 0.430 50 20 JCGD Cn1nc(C(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c2ccccc2c1=O 791176541 LVGOKSGLASVEDA-UHFFFAOYSA-N 468.495 0.289 50 20 JCGD Cc1cc(C)nc(NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C/c2ccccc2)n1 837302323 AWXHLBANPSLPSC-KQPPXVQYSA-N 467.573 0.930 50 20 JCGD COC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 912521151 JNJZPHQUWOVNMB-UHFFFAOYSA-N 482.482 0.521 50 20 JCGD COc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OCC(=O)NC(C)C 916144822 PCZYEVFYBMKISO-UHFFFAOYSA-N 453.459 0.649 50 20 JCGD CC(=O)N1CCc2cc(Br)c(S(=O)(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc21 919961139 UOWOWPPMBNWZBQ-LLVKDONJSA-N 495.377 0.038 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c1 920024349 JSAYSXQNAJAPNF-VSRDTVRMSA-N 484.534 0.654 50 20 JCGD O=C(NNS(=O)(=O)c1c(F)cccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N2CCOCC2)c1 920245701 OTENULAXWBLAMF-UHFFFAOYSA-N 488.475 0.378 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1 920297622 KHAYSPVJOVSXME-KKUMJFAQSA-N 454.549 0.554 50 20 JCGD CCC[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cccc1 1779030448 QOZZYPPKOOHRLY-XXBNENTESA-N 454.531 0.972 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/O[C@H]1CCCCO1)C2 1779372603 NIIPSASJLOSJMY-MRRRHBFGSA-N 488.545 0.342 50 20 JCGD Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)nn1C(F)F 1780307445 IYLQNCPLKJCUGJ-FQEVSTJZSA-N 463.445 0.342 50 20 JCGD COCCCC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970251 VVLFMPNCAJQTKP-HSZRJFAPSA-N 461.563 0.589 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1 1781351190 JCZFVKVXLXKEPV-AUUYWEPGSA-N 478.384 0.877 50 20 JCGD CC[C@@H](CC(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)NC(=O)OC(C)(C)C 1781363519 XJYOKLJURLGDSF-GAJHUEQPSA-N 483.610 0.883 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)C1 1782469523 WJQZKAPDFRWHBC-NEYJZJCJSA-N 469.970 0.225 50 20 JCGD CC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1783141772 NMVOVMJSVIUJDO-YLJYHZDGSA-N 452.349 0.959 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C[C@H]1CNc3ccccc3O1)CCO2 1783936203 SBYYUEZKIOTKOD-GAJHUEQPSA-N 459.547 0.453 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783940651 YIWXLNMARBSJPM-AFBRZQFHSA-N 458.342 0.799 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1784087565 PPMWEMYAGSAZIP-QFIPXVFZSA-N 450.511 0.580 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCS(=O)(=O)c3ccccc3)C[C@@H]21)[C@@H](O)CCl 1784089747 HDJIGIIPBDEFGO-DKIMLUQUSA-N 458.964 0.430 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2C1 1790028183 CONWPEHVYJNBEM-KHDYIWLOSA-N 486.460 0.640 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cc3F)[C@H]2C1 1790978212 LOMUXARYNCNKRA-DCPHZVHLSA-N 473.480 0.799 50 20 JCGD Cn1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1 1795808677 XGJSOEXEGAZPOH-KPEUIFRASA-N 469.970 0.684 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)C(=O)OC(C)(C)C)C2 1796441027 LXPABJLTTOPWRJ-LLJCUJCISA-N 490.561 0.577 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)C2 1797748715 XCJUXXOQWGVXKZ-GUZHFODBSA-N 485.491 0.970 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1N(C)C 1797753211 XROMYBGRUXTRGY-VPTLXERWSA-N 482.541 0.277 50 20 JCGD Cc1ccc(C)c(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797754010 ORQSVACGRALWHO-OPMZPASUSA-N 451.527 0.748 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)n1)C2 1798522067 AABLPSUNCHCCAI-KSPBDQMDSA-N 487.425 0.238 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(-c2ccccc2Cl)[nH]n1 1798682973 UZBPSQARAXGDSK-MFKICJERSA-N 494.744 0.927 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(N)s1)C2)NC(=O)NCc1ccccc1 1799095019 QBIPIDIOJXYREY-HGKCTWBKSA-N 487.586 0.275 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2 1800979560 PAIOFECLLQOMIJ-RXHHHXIQSA-N 464.872 0.987 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1801931503 LOCULXXBEWCAQQ-FCHSSTLOSA-N 483.374 0.731 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803146957 RSZDTQPOGMJIPM-NXWXRZEISA-N 462.938 0.158 50 20 JCGD O=C(CC1CCOCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1806933204 KHUJIMOMLSESRX-NFBKMPQASA-N 451.332 0.898 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366845 HNZYUJLGXQLEPG-WIYYLYMNSA-N 460.299 0.302 50 20 JCGD Cn1nc2c(c1C(=O)N1CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]1c1cccnc1)CCC2 1807372514 FZLHHKAFBKXYGZ-PGRDOPGGSA-N 473.342 0.617 50 20 JCGD CNC(=S)NCCC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808417904 RZYOESDNDNQYNH-QXIYLWIPSA-N 498.613 0.705 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1)[C@H](F)Br 1808661269 HOVLZBMPZUNNNK-GLQYFDAESA-N 478.282 0.823 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C(=O)Nc2cccnc2)[C@@H]1c1cccnc1 1810461117 GKXQHXGTPIOVIQ-JXFKEZNVSA-N 488.508 0.433 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361097 XCQOGSOIPSYOSS-CJNGLKHVSA-N 465.344 0.944 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3C=CCN3)sc2C1)NC(=O)NCc1ccccc1 1817002273 HMQTWBBNYNNRCG-AEFFLSMTSA-N 483.598 0.929 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cn3cccnc3n2)[nH]n1)c1cccc(B(O)O)c1 1817476310 PPFRBXKZFKZNHX-SFHVURJKSA-N 459.275 0.752 50 20 JCGD COCc1oncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1817798526 BZXSMJPTKSCFOJ-ZDUSSCGKSA-N 456.289 0.497 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2 1819798028 QLFWPMRPFNOZNX-QMMMGPOBSA-N 471.459 0.313 50 20 JCGD NC(=O)c1nccnc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2 1821040847 MNGBGTUIQYVJOG-KGFZYKRKSA-N 457.285 0.948 50 20 JCGD O=C(c1cccc(=O)n1O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055810 GIZLMTUKPIMXEE-LJQANCHMSA-N 453.304 0.313 50 20 JCGD N#Cc1ccccc1OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1828029592 GPJNLBDVHBUMKM-KRWDZBQOSA-N 476.323 0.999 50 20 JCGD COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828860434 WUVDFCCZZPMYLS-LAUBAEHRSA-N 453.923 0.685 50 20 JCGD C[C@H](Br)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(O)O)C2)C1 1829330646 NFPJEMYJRRLNRI-VBKZILBWSA-N 484.347 0.533 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830358584 DQWYRPVYCMVHJY-ZHRRBRCNSA-N 491.029 0.950 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1830538684 MPJQADFGRXRCOM-FZKQIMNGSA-N 467.324 0.225 50 20 JCGD O=C1CSc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2N1 1830728614 WHTBMGCOFHAOME-FOIQADDNSA-N 469.947 0.401 50 20 JCGD Cc1nccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549076 DHIQFHDEUXRSKO-AOMKIAJQSA-N 497.980 0.987 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1833085927 XQQUOBHHKIMDDW-IBGZPJMESA-N 487.649 0.936 50 20 JCGD CC(C)(C)n1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1833994210 NUNYTFHIEYVDDN-UHFFFAOYSA-N 481.406 0.817 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1)c1cccc(B(O)O)c1 1834800543 KKGBBTBLSPPUAC-UHFFFAOYSA-N 494.357 0.703 50 20 JCGD N#Cc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834800647 UWVDXAXXTYGLCQ-UHFFFAOYSA-N 474.370 0.666 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2 1835674723 FLYCRRVNERMJJX-DNVCBOLYSA-N 459.385 0.756 50 20 JCGD O=C(c1nn(-c2ccccc2)c2c1COC2)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836391348 VBYYVTSGTJIBCO-CVDCTZTESA-N 490.944 0.572 50 20 JCGD CN1CCN(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)CC1 1838286631 QGUQRCJWLSPJON-SFHVURJKSA-N 463.392 0.923 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnnc3O)CCO2)C1 1838366419 JBCFSLRMPXBKJJ-YCRPNKLZSA-N 499.952 0.384 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc2)C(=O)C1 1838992826 OYDYJNJVBGNUPB-PGRDOPGGSA-N 478.933 0.469 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)c(F)cc1F)CCO2 1839288731 KKPUUFCMFMPKQZ-OAQYLSRUSA-N 472.464 0.547 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839390071 HVMRIGVNIFTWLI-RIPAZEOFSA-N 488.310 0.904 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ncccc3[nH]1)CCO2 1839493966 YTWJFCXPCFJRJM-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1 1839625092 BMQUAILQZMJCSX-AUUYWEPGSA-N 455.874 0.192 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(-c4ccccn4)nc3)C2)C1 1840150299 ISPQAWZXFZSNCZ-VGSWGCGISA-N 475.933 0.862 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccnc3OC)C2)C1 1840150342 IYOLUVUHKPWSIG-UWJYYQICSA-N 455.939 0.733 50 20 JCGD CSc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840184674 ARZQERDQXREFHX-QHCPKHFHSA-N 478.615 0.780 50 20 JCGD CSc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1O 1840184776 AGZQSWBWMMSORZ-JOCHJYFZSA-N 480.587 0.557 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cnc(-c3ccccn3)nc1)C2 1844263751 PWERVQAANSIOAU-UHFFFAOYSA-N 458.482 0.668 50 20 JCGD CC(C)(C)OC(=O)N1Cc2nccnc2C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1846555048 XWEMYPHMAXIVKW-IRXDYDNUSA-N 479.965 0.942 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)[C@H](C)O)cc1C 9084209 SEUXSOZDACVBSM-IFXJQAMLSA-N 497.957 0.989 50 20 JCGD C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)ccc2Cl)C[C@@H](C)O1 15639682 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CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1781234569 VQNPOCKXGJQQEN-MNEFBYGVSA-N 460.362 0.523 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781334650 QHAMWVVOKLFKDC-VQIMIIECSA-N 455.328 0.904 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC[C@H](N)C(N)=O)C2 1781597068 MGXJJXHOXVAVGG-CQBBWOCRSA-N 489.523 0.978 50 20 JCGD N#Cc1ccc(F)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1781963749 MNRHJLYFUZFWKG-JOCHJYFZSA-N 452.446 0.453 50 20 JCGD Cc1ncc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)s1 1782214380 PDIIWVPIBFTBTB-DYESRHJHSA-N 451.593 0.881 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1783533251 YKDGTCSTNYFRAG-AVCJSFLBSA-N 469.336 0.606 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 1783880350 BDRFRMHGXBMTFF-LAUBAEHRSA-N 454.907 0.533 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)CSc3nc[nH]n3)C2)C1 1784387788 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468.320 0.152 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792982962 XFVOZIVEDJGTNA-WHDKQWSOSA-N 471.982 0.823 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc2c(c1)OCO2)c1ccc(B(O)O)cc1 1795743280 QPHVGCKHNVLMST-ACDBMABISA-N 450.300 0.980 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)nc1)C2 1796440368 VIFBEIAVOHPCLI-VJVIZFGWSA-N 459.894 0.467 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799098198 BBWJYUBTBFOJFI-WRHDZBKDSA-N 497.600 0.455 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCNC(=O)OC(C)(C)C 1799260319 GJCBTOBNUODHDS-JYYAWHABSA-N 463.959 0.371 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C 1799362325 YXFFLSIEECFVLW-JBXGNFEISA-N 492.411 0.883 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1F 1800646122 XADZQWAGGMZJAH-GYGSIYFNSA-N 471.489 0.928 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)cc1 1800797930 QZQHYWHSHSIOIU-VPTLXERWSA-N 455.490 0.660 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1800902113 ATFCMEWLCJLGFC-ZHCJQAHYSA-N 459.971 0.869 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1cc(C)cn1 1801340205 QDUBOPSDGROZMC-UXLXASSBSA-N 455.519 0.476 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(I)c(O)c1 1801903962 JYPCAFILKVOTDV-JLUCKKNBSA-N 494.713 0.800 50 20 JCGD CN1CCC(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1802570792 ZFYVUCKAMSRRPZ-IRLDBZIGSA-N 450.348 0.423 50 20 JCGD O=C(CN1CC(=O)NC1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1804187527 YSOSZHDDLQOLEY-SUMWQHHRSA-N 452.309 0.424 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1806341040 VRBFOTJQUQGOIB-APWZRJJASA-N 460.137 0.866 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807368647 WKSQRMQEUHGZMW-NYDSKATKSA-N 474.326 0.944 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1808592599 VPTDDDAGRFEESL-PGRDOPGGSA-N 488.309 0.576 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cccc(N4CCOCC4)n3)CC2)C1 1809966568 FSXAWIZPXWDNNZ-UHFFFAOYSA-N 492.385 0.757 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)cco2)[C@@H]1c1cccnc1 1810300593 ZIKNEXYSODQUSV-MGPUTAFESA-N 462.466 0.667 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nn1C 1811636779 ZXJKTZNHYJOBLY-IERDGZPVSA-N 457.535 0.516 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@H]1c1cccnc1 1812866066 GOIWIRMXWFZCDG-XKVFNRALSA-N 457.325 0.935 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1814991886 DLXBWPVGEBMCRS-CZUORRHYSA-N 465.344 0.944 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(-n3ccnc3)ccn1)CC2)c1cccc(B(O)O)c1 1815361054 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CC1(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CN(C(=O)OC(C)(C)C)C1 1830737118 AJGHAVNVVAZZJT-OPAMFIHVSA-N 489.997 0.690 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCN(Cc3ccccc3)C1)CCO2 1832302465 YWUISDILSQAUKS-LGVFNWMJSA-N 480.005 0.955 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc[nH]n3)C2)C1 1832549476 QMNJTLHQEMXNKZ-MGPUTAFESA-N 471.942 0.612 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)COc3ccc(O)cc3)CC2)CC1 1833211206 AOVNKGLSZXDFDT-UHFFFAOYSA-N 496.568 0.655 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(N2CCC(NC(=O)C(F)(F)C(F)F)CC2)CC1 1833646903 QMTVPKCORCMKLS-UHFFFAOYSA-N 459.249 0.452 50 20 JCGD CC(C)N[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(C)C 1834784435 IIVIXCKEKCGYFY-QHCPKHFHSA-N 472.439 0.574 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)(C)C 1834800115 WHTQMAZMHROXMK-JOCHJYFZSA-N 486.422 0.102 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1834846586 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CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)[nH]n1 1837991917 OAISQLDUPBCUNX-HSZRJFAPSA-N 485.545 0.090 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cc3-n3nccn3)CCO2)C1 1838631613 KPTKVDLKJYDGOK-GCJKJVERSA-N 477.949 0.900 50 20 JCGD O=C(NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1cccs1 1839198136 VFFMYHLVQGSVLB-PBHICJAKSA-N 478.340 0.625 50 20 JCGD Cc1nnc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1 1839199311 MWKZNEHITVQJLE-ZFWWWQNUSA-N 451.318 0.536 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)nn3C)C2)C1 1839962817 RKZQHGNGYOORDN-ACJLOTCBSA-N 459.341 0.672 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1 1839967636 SQLIZFFIOXUGSM-APWZRJJASA-N 456.337 0.960 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)[C@H]3SC(=N)NC3=O)C2)C1 1840032823 LIMRZKHILUIFET-DRAKQNMHSA-N 477.381 0.029 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1 1840036952 TZYMWARLPSKPCF-YJYMSZOUSA-N 454.321 0.639 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C2)C1 1840154075 KPUXZJSSEMVENP-UTKZUKDTSA-N 483.905 0.854 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC[C@@H](C(=O)OC)C3)C2)C1 1840155786 HXDINJKTGKCEEX-VWXURSGXSA-N 460.955 0.676 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1 1840184805 CHAGQXLFYZPAHV-OAQYLSRUSA-N 484.937 0.194 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@@]21C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846189026 AKILFLCNNPNENQ-XDHUDOTRSA-N 469.347 0.583 50 20 JCGD CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1 9863670 JCRWQRDUECLFDA-UHFFFAOYSA-N 496.615 0.952 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3ccc4c(c3)OCCO4)CC2)c1 108845438 SGFQYKGUOIXZAA-UHFFFAOYSA-N 474.539 0.679 50 20 JCGD O=C(CCNS(=O)(=O)c1cccc(Br)c1)NNC(=O)CNC(=O)c1ccco1 725739461 HGMOGRBDXFWSFE-UHFFFAOYSA-N 473.305 0.288 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=S)NCc2ccc(S(N)(=O)=O)cc2)c1 726434626 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Cc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1807369592 PJUJAZRJWNQONG-OXQOHEQNSA-N 451.267 0.565 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375089 LPFSKMPRQZWZQI-AVRDEDQJSA-N 459.315 0.538 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375285 RUYVODPKDQNGJO-ICSRJNTNSA-N 467.331 0.670 50 20 JCGD CC(=O)NCC(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1807452965 LMLCJGVNOSBDMO-XUZZJYLKSA-N 495.584 0.570 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C[C@@H](N)c2cccnc2)[C@@H]1c1cccnc1 1810303030 OMPLLWNOIIAYDJ-QTGUNEKASA-N 488.552 0.885 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1812863448 HOEYAOFJXLDQAV-FDQGKXFDSA-N 460.137 0.864 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@@H]2[C@H]3COC[C@H]32)[C@@H]1c1cccnc1 1813658012 GKHJELMVNJIUGW-YLLORCDKSA-N 450.499 0.292 50 20 JCGD C/C(=C/C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(=O)O 1814097131 KVQRJASDHWJXFJ-HBBBUGNISA-N 452.471 0.431 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ccc(F)cn3n1)CC2)c1ccc(B(O)O)cc1 1815348717 XQIYCNPJOJWGIU-AWEZNQCLSA-N 480.290 0.544 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)n1cccc1C=O 1815354509 GCPQJLMTKANVSF-CZUORRHYSA-N 466.328 0.924 50 20 JCGD Cc1nn(C)c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1F 1817473177 KHFCKVNRVBGEOL-MRXNPFEDSA-N 454.271 0.890 50 20 JCGD Cc1cc(C(=O)NCC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)no1 1819466522 OSGFMSNKQAOIGA-GOSISDBHSA-N 480.290 0.122 50 20 JCGD C[C@H](Cn1cncn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1819540687 WHUNUZDYGLKLGO-DYVFJYSZSA-N 466.506 0.642 50 20 JCGD COCCOCCOCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1822257368 BQXOYLRZULZDHS-SFHVURJKSA-N 482.582 0.845 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1cnc2c(c1)CCNCC2 1824640180 PSCORWWHDSYCRV-GOSISDBHSA-N 491.382 0.446 50 20 JCGD O=C(NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccc[nH]1 1825157535 PHPUGOAOXZXHNB-JOCHJYFZSA-N 480.374 0.748 50 20 JCGD O=C(O)c1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)ncn1 1825502725 POWQDLMIVNYVON-HXUWFJFHSA-N 466.303 0.402 50 20 JCGD COCCn1nccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1827812370 KBWBGBXPQFLKGV-OAQYLSRUSA-N 468.363 0.756 50 20 JCGD CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1828889236 XWSFKFCWOGCZQD-XMMPIXPASA-N 465.315 0.452 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1830454819 HGJZXKOZQLYKST-UUOWRZLLSA-N 476.574 0.628 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCCC1(F)F)CCO2 1831726805 UMSPLXOTGRMKOL-OXQOHEQNSA-N 460.522 0.641 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)no1 1831873590 PGLNRQNQHVLSTK-LJQANCHMSA-N 476.578 0.706 50 20 JCGD Cn1nc2c(c1C(=O)N1CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC1)CCC2 1834799349 YRPBYHYHZGQCTO-UHFFFAOYSA-N 479.390 0.088 50 20 JCGD O=C(Cn1cc(Cl)cn1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834814223 URYLHHXUTVMFPO-UHFFFAOYSA-N 473.770 0.102 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)n1 1834819587 RTJHJZIXOYSEGD-IBGZPJMESA-N 456.337 0.874 50 20 JCGD Cc1nn2cc(CC(=O)N3CCOC[C@@]4(CN(C(=O)CCBr)CCO4)C3)nc2s1 1834819799 WWRTZWZPFATTJX-GOSISDBHSA-N 486.392 0.883 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3csnn3)CC2)CC1 1835116745 ZPSZPOXHUOGCGN-ZVHZXABRSA-N 472.575 0.857 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnn4ccncc34)CC2)CC1 1835737803 BOSFZXZAFCXCLJ-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD CN[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)C(=O)O 1835763971 OOXJWUFRHWJUHQ-JAEDTZDXSA-N 492.479 0.391 50 20 JCGD CC(C)c1csc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)n1 1835927434 ONYYNCDMUYDTGN-QFIPXVFZSA-N 473.360 0.330 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835928293 IRJZHVSMJIJQLH-RUZDIDTESA-N 481.358 0.443 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccc4o3)C2)C1 1835936972 MMOOUMLWBLCZDU-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4c(s3)CCCC4)C2)C1 1835937166 QPCIXIPBWLTXLJ-XMMPIXPASA-N 484.383 0.691 50 20 JCGD Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)on1 1837093144 ACCPVMJNKYRGDS-UHFFFAOYSA-N 455.320 0.518 50 20 JCGD COc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459552 JUGBEWPYEGMQKP-QHCPKHFHSA-N 469.498 0.078 50 20 JCGD CC1(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CCCCC1 1837460311 AULFANHABJMIHR-QHCPKHFHSA-N 459.547 0.726 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)CC2)CC1 1837920075 IZUOPVUFKCDRLM-PWRODBHTSA-N 456.373 0.854 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@]3(F)Cl)CC2)CC1 1837922156 RNNWQANWSWXIOU-NQIIRXRSSA-N 452.719 0.903 50 20 JCGD CSc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1O 1838564357 FHSINMMNBOBWMK-QHCPKHFHSA-N 486.355 0.178 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)c(F)c1)CCO2 1839270926 BZZCOMWVZGUDNY-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1Cl)CCO2 1839324543 OICPRADPJQGPFF-NRFANRHFSA-N 470.929 0.922 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)NC(=O)c3ccccn3)CCO2)C1 1839668093 ZZUANFIQKQJREH-MRUHUIDDSA-N 452.939 0.674 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839718701 JNUVKKKIMJURBC-QGZVFWFLSA-N 463.274 0.017 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1840035356 OCZARHGVCCNYFG-MGPUTAFESA-N 484.395 0.572 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](NC(=O)OC)c3ccccc3)C2)C1 1840149244 JRLJHUCLGNRANY-JBYIUTFZSA-N 483.949 0.794 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H]4Sc5ccccc5[C@H]43)C2)C1 1840184851 BMTQWRILZNTZMH-ZPFZUWPUSA-N 488.610 0.704 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840392946 AMVIMSBIOQYSHY-HTAPYJJXSA-N 479.603 0.392 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cc(C)cn1)CCO2 1840403751 OPUPBBHRPDGOJE-DBKOLHJESA-N 485.545 0.343 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Oc1cccnc1)CCO2 1840451676 SDAAIHCYDCKVOP-YQYWADFRSA-N 498.540 0.439 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1847943259 HPRVREOWBJNQAF-FCLVOEFKSA-N 475.351 0.110 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc(OC)c1OC 17411392 BDMTYPZNGRSKHG-UHFFFAOYSA-N 455.471 0.719 50 20 JCGD Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)CNC(=O)c2ccco2)cn1 725741810 VQIFILOTPZQDMY-UHFFFAOYSA-N 452.474 0.066 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)NCCCNC(=O)c1cccc(Br)c1 725871234 IDYWZDNVOAFZFR-UHFFFAOYSA-N 466.292 0.922 50 20 JCGD O=C(NNC(=O)c1cnc[nH]1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 725880208 ZIGJOIZWIZDDFF-UHFFFAOYSA-N 468.539 0.991 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)nc1 726282366 MTSROHIGUGPQSC-OAQYLSRUSA-N 489.558 0.993 50 20 JCGD CNS(=O)(=O)c1ccc(C)c(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1 728213441 BTEXYOLSOHPCQC-UHFFFAOYSA-N 481.600 0.596 50 20 JCGD COc1ccc(CN2C[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cc1 728846200 NAYYUNJCSVJUQH-GOSISDBHSA-N 452.515 0.898 50 20 JCGD Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCS(=O)(=O)N1CCOCC1 748094578 CQGNQXYYTWNEBJ-UHFFFAOYSA-N 453.546 0.725 50 20 JCGD C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1)C2=O 912919304 LNNCMWLYKGELAF-NXLNFEJXSA-N 451.568 0.770 50 20 JCGD C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1csc(N2CCOCC2)n1 914831497 MQYYZPJPXMVGLW-QFIPXVFZSA-N 484.538 0.740 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2ccc3ccc(=O)oc3c2)ccc1Cl 915789049 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N#Cc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788607916 VGOFKPLWVFRQLJ-NYVOZVTQSA-N 476.537 0.783 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789870835 YZSWTTNCZIFXTD-MBIOBJJBSA-N 458.346 0.515 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnc4cc(C)nn4c3C)C[C@@H]21 1791253963 JYHLNTWQJDGYJU-VGWMRTNUSA-N 450.927 0.588 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1F 1791742747 SRVORMJCNWKUJJ-JLMWRMLUSA-N 470.306 0.350 50 20 JCGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)ccc(F)c1F 1791974591 LPTFTUACNOFFFT-QSFXBCCZSA-N 458.270 0.860 50 20 JCGD CCc1c(Br)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)nn1C 1792977350 TUHKYKBKKKPVHJ-QPPBUOOMSA-N 463.760 0.548 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793116189 HWDZQIATHCPMHI-YBCDSMPPSA-N 471.982 0.983 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2n[nH]cc2c1 1796148157 VOJDXHXVEBOLRF-UCNOBMHRSA-N 463.498 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2 1796441758 ZBISYTFVJMVYDX-CNKKGNCFSA-N 457.447 0.260 50 20 JCGD CC(C)c1csc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)n1 1797749733 LYJBKLZMOSAZIJ-FVCICTRLSA-N 458.544 0.782 50 20 JCGD CCC[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)n1cccc1 1797750923 VVBZZHJEEXPULD-JSJNYSNDSA-N 454.531 0.731 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798443523 FOZXCVZNIMNMBM-ULQWZQFMSA-N 455.515 0.692 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1CCCCO1)C2)NC(=O)NCc1ccccc1 1799095316 NFMVCCWXPMHJQY-XARGGIHNSA-N 487.601 0.881 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2COC[C@H]21 1801603232 YLCWMSTYKFMNFN-XKJRMJSBSA-N 459.455 0.616 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1805407199 BDSVJHLCWIIVNK-IBGZPJMESA-N 489.378 0.097 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CC[C@H](N)C(N)=O)[C@@H]1c1cccnc1 1807191909 FOBZCKUEDHACQT-AESZEHBQSA-N 454.369 0.854 50 20 JCGD Cc1nc(N)sc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807243673 LTNFZDGYLBZEBK-WMZOPIPTSA-N 465.344 0.742 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CSc2ncccn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370824 KYHUDRMYSQCYKY-WIYYLYMNSA-N 477.355 0.663 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)CC1 1809493864 ZWJRIICCJHPDLP-OKZBNKHCSA-N 472.995 0.359 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1 1810637843 DXULSNLAHLASIM-IFXJQAMLSA-N 458.479 0.406 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CSCC(=O)O)[C@H]1c1cccnc1 1813085921 FJGUCFYTVOCXDE-AUUYWEPGSA-N 472.527 0.218 50 20 JCGD O=C(CN1CCCCC1=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348792 YULSYYLSAILAOT-HNNXBMFYSA-N 456.333 0.061 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815359727 BGRLVCIWUFAKEK-FZMZJTMJSA-N 461.305 0.610 50 20 JCGD CC(=O)Nc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)ccn1 1817905638 DONDTWOQFARCDS-MRXNPFEDSA-N 479.327 0.716 50 20 JCGD Cc1nc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)no1 1819401663 NCFIAQPMDZYPBA-HNNXBMFYSA-N 453.463 0.648 50 20 JCGD Cc1nn(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793077 KCAJKWIAZKKTDJ-LLVKDONJSA-N 454.516 0.723 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)N1CCOCC1)CC2)[C@@H](F)Br 1823007256 LLBTTWHCUUGSPF-UGQGEIBHSA-N 451.318 0.396 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CNC(=O)C3)sc2C1 1825197750 DNNFHZZGNGRULK-YPQDEONXSA-N 457.516 0.325 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](O)Cc3ccccc3)sc2C1)c1ccc(B(O)O)cc1 1825429724 ZBJMVVKOPUDCPX-HKUYNNGSSA-N 465.340 0.652 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCOCC2)CC1 1826746003 WYRLCEJQAXKBMY-QFIPXVFZSA-N 457.380 0.322 50 20 JCGD O=C(Cc1ccc(O)cn1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827054500 GOEHSZOWTSHIPE-QFIPXVFZSA-N 451.332 0.943 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1828127035 OAUTWXQZUFZJIP-BLLLJJGKSA-N 473.559 0.672 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1828263312 ZKTBNMOAFYSPMZ-KSSFIOAISA-N 492.366 0.867 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCN(C(=O)OCc3ccccc3)[C@@]3(CCN(C(=O)[C@@H](O)CCl)C3)C2)O1 1828590192 RVOQOWSAUWNFOO-PNLZDCPESA-N 494.932 0.147 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CCC(N)=O)C2)C1 1829340125 DYQGTNJTEXWGJF-MBSDFSHPSA-N 494.976 0.958 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1830544270 SVCWSVSEPWSMHN-IERDGZPVSA-N 498.422 0.820 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1830545818 NFPGRMWYMQKWDH-WBMJQRKESA-N 462.370 0.384 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cnccn3)C2)C1 1830546667 VHXZTXMLHOXFRX-UCAFPWNGSA-N 453.337 0.977 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2NC1=O 1830732878 WYCKQCLNWLOGQZ-QSZISKGPSA-N 467.906 0.076 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1sccc1F)CCO2 1831918807 VYWRJYRORJOWIB-HXUWFJFHSA-N 463.491 0.270 50 20 JCGD O=C(C1CCC(CO)CC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1832522912 WGKCORDDVWWYHE-GULCKSEBSA-N 451.333 0.932 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nn[nH]c3C(F)(F)F)CC2)CC1)[C@@H](O)CCl 1833312335 LGORRBWCYGNFBA-LBPRGKRZSA-N 452.865 0.608 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833400429 SQICASGYJYKYJD-MOPGFXCFSA-N 494.397 0.791 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1 1833566421 CKQZJUOVZVXKSR-UGSOOPFHSA-N 475.315 0.883 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CCC1)CCO2)NC(=O)NCc1ccccc1 1834636608 KMFOMSZFLCHMOV-DEOSSOPVSA-N 473.574 0.589 50 20 JCGD N[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccnc1 1834762533 GLAKMVHIAKVTTK-QHCPKHFHSA-N 479.390 0.037 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1834823022 DYIQTZAVCZZCRX-SFHVURJKSA-N 452.309 0.584 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1n[nH]c2c1CS(=O)(=O)C2 1834913762 WQZWDDKRNHJNME-INIZCTEOSA-N 461.947 0.558 50 20 JCGD CC(C)(Cc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934197 PMUOXYWSLYPLQV-SANMLTNESA-N 480.370 0.705 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835940142 VVFQZHCPEWHJGF-DEOSSOPVSA-N 470.306 0.127 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c(C)n1C 1836066664 OCAFYRFHOFZNKA-UHFFFAOYSA-N 466.391 0.821 50 20 JCGD O=C(CCBr)N1CCC(OC2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1 1837046207 ZUYTTZXQNYQNAC-UHFFFAOYSA-N 459.341 0.322 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837348819 VSIMIVDHHKGOAB-QLVMHMETSA-N 453.923 0.306 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1cnccn1)CCO2 1837476789 DMAVVGIGMZTYTA-SPYBWZPUSA-N 470.368 0.764 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1 1837713318 VSLZKWHHGBGFHP-JOCHJYFZSA-N 477.590 0.939 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NNC(=O)C3)C2)C1 1839743945 GREKNYJFLAEXEP-CMBCZCRSSA-N 473.436 0.204 50 20 JCGD COc1ccccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839954338 NJMFCZSTBNGLJI-XMMPIXPASA-N 483.525 0.006 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1839964951 JTXKKISTMCAUPK-KUHUBIRLSA-N 466.336 0.973 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)c([N+](=O)[O-])cn3)C2)C1 1840152259 CUDCTDUVDQQERI-AUUYWEPGSA-N 456.883 0.622 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(Cl)c(F)c3)C2)C1 1840182368 AVUTXMXAXBHMEX-QFIPXVFZSA-N 484.956 0.851 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1 1840185210 NOCMZAUZFLKRGQ-JOCHJYFZSA-N 476.509 0.145 50 20 JCGD COc1cccc(OC)c1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185493 NMZKHLSVXYKJQN-QHCPKHFHSA-N 478.546 0.147 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840186068 YWXFTJSULFIHMY-MBSDFSHPSA-N 462.547 0.283 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)[C@H](F)C1 1841517974 FVKXSXRARVVSER-RTBURBONSA-N 489.353 0.779 50 20 JCGD O=C(c1cc2cc(Br)ccn2n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011583 SNWFTIJBVJVNGS-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)C(C)(C)F)C2 1843428638 HHZHDJVUHOUWOP-SFHVURJKSA-N 491.369 0.754 50 20 JCGD O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 15795474 YTNBVVQBKHAZHW-GOSISDBHSA-N 465.459 0.448 50 20 JCGD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1 16094823 HOPIXWSTVQGCKK-UHFFFAOYSA-N 452.441 0.900 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc2)cc1 726616947 XBGQSCGTOVQOFZ-UHFFFAOYSA-N 475.527 0.409 50 20 JCGD Cc1nc2cc(O)nn2c(C)c1CCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728339411 NBUNXCWLFGJUDF-QGZVFWFLSA-N 469.454 0.515 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)c1 728528201 BSLJBPGXMGJAIH-UHFFFAOYSA-N 499.299 0.474 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728845157 DGEZTJVXWULAML-ZGBFETHSSA-N 491.552 0.644 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c1 730524962 BAZZKWOPROJSCM-MRXNPFEDSA-N 459.480 0.675 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)c1csc(N2CCOCC2)n1 749561891 RYMJQYZDZZOMSX-OAHLLOKOSA-N 473.511 0.774 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 751204323 GSNAVMFDJSYLGN-CYBMUJFWSA-N 452.464 0.397 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@H](C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)C(C)C)cc1 763670182 MFWUUTNELXAWTG-IBGZPJMESA-N 482.584 0.996 50 20 JCGD Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c(C)c1 912921642 QGDQHGRYHDBQTK-QZTJIDSGSA-N 454.593 0.927 50 20 JCGD COc1cccc(C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n2nnnc2C)c1 916108641 FBJGQSZIQLWYME-LJQANCHMSA-N 487.542 0.485 50 20 JCGD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2)C1 918001665 FBHULAIWHINUNX-MRXNPFEDSA-N 487.586 0.826 50 20 JCGD O=C(NNS(=O)(=O)c1c(F)cc(F)cc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1 918727780 ULOWMPURRUSDGE-UHFFFAOYSA-N 479.458 0.748 50 20 JCGD CS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)ccc1F 920310215 JGSPUFLXQZWECX-UHFFFAOYSA-N 485.924 0.153 50 20 JCGD COc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1 920433458 FNBZYBWFLMNKTO-HUUCEWRRSA-N 466.560 0.745 50 20 JCGD Cn1c(=O)n(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c2ccccc21 1778165203 RHGWZEAVTZTVPV-APWZRJJASA-N 469.311 0.860 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1778437059 NBRFWPLYZDHZEC-XMMPIXPASA-N 460.299 0.375 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1 1778907161 WBRRVWNFVVDWJA-AOAINSGISA-N 476.493 0.164 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(N4CCCC4)ccn3)CCO2)C1 1779030679 TWYMYAPYBKCSNW-XMMPIXPASA-N 479.541 0.438 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779031187 NHEKQUXBDBZSRM-QHCPKHFHSA-N 453.499 0.380 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1 1779032544 SFCMBCQAAZKZMY-HSZRJFAPSA-N 477.481 0.492 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1780021082 GKHHHTKDQXARCB-KUHUBIRLSA-N 466.336 0.948 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1780021083 GKHHHTKDQXARCB-LIRRHRJNSA-N 466.336 0.948 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780934811 JTBXWPNKCLSDNA-GOSISDBHSA-N 471.377 0.506 50 20 JCGD CC(C)[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969603 MUVYMBIHOBESKA-NZQKXSOJSA-N 461.563 0.179 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1 1781764976 DWJDASALIRTPQY-HXUWFJFHSA-N 451.455 0.550 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)N1CSCSC1 1782214766 MOGCHTCDBHTJIO-CBGDNZLLSA-N 487.692 0.916 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782789318 QXBOPPAPGQWOOB-PXAZEXFGSA-N 457.281 0.370 50 20 JCGD C=CCNC(=O)/C=C\C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1783529354 KKTIWNGTTAGWSA-OXLFWHROSA-N 499.008 0.957 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](COC)NC(=O)OC(C)(C)C)CCO2 1783875308 LPMQNSQWGJEINF-AVYPCKFXSA-N 463.959 0.610 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935715 CMYPZFWZBWVBHM-QHCPKHFHSA-N 475.546 0.463 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1 1783966968 NFOHZFFRDUEZOW-MJDBTJCESA-N 450.330 0.062 50 20 JCGD C=C1C[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)N(C(=O)OC(C)(C)C)C1 1784089065 NTFZDMRFFQTJJT-MRUHUIDDSA-N 457.955 0.982 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(N(C)C)cn3)[C@H]2C1 1785750653 PPXDGKOHSYDQJM-YUCXHDEDSA-N 481.557 0.875 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4cc(C)cnc34)[C@H]2C1 1788336109 BCFVPNKYGWAGMV-WRSVAZJTSA-N 492.540 0.765 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@]3(O)CCN(C(=O)OC(C)(C)C)C3)C[C@@H]21 1791257462 IGDYHPQEJMEHDD-JUPXILGHSA-N 489.997 0.592 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(F)ccc3F)[C@H]2C1 1792136216 IZNDZDZQTPWNBA-GMVOTWDCSA-N 473.480 0.799 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C[C@H]2C[C@H]21 1792974854 FGHUILVPRAPYDU-YRXKBASHSA-N 457.955 0.574 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793599273 YIEARADEXWBGDC-FFGOWVMKSA-N 493.630 0.652 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1COCCN1C(=O)OC(C)(C)C 1793603604 YYBHUSPWUJDKOF-NNXHMXCWSA-N 475.970 0.466 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1NC(=O)NC1=O 1793945579 PWEWJKTYBHLRHT-DBHZSDIHSA-N 473.436 0.059 50 20 JCGD COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C3)cn1 1794949982 WNLWMFPMBATPJS-VTEUUUEMSA-N 485.453 0.836 50 20 JCGD C[Si](C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)co1 1795734429 OWKHDSTXSOZTAW-XEMDLRDOSA-N 456.380 0.022 50 20 JCGD CC(C)c1nn2ccccc2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1796082346 HTTMDCBYCALKNV-FEJSZKPUSA-N 476.342 0.655 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)N1C[C@@H]3C[C@H]3C1)C2 1796441916 GTAXIESWWFWXGQ-GJQARSFISA-N 456.547 0.050 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc[nH]n1)C2 1798523228 YKSJODZVOOEQFH-VTEUUUEMSA-N 457.443 0.689 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C 1799366014 DKOSCVHRVMMTFI-HAFSJTIUSA-N 478.384 0.635 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc(C)c1C(=O)O 1799874201 QWACYFLMMROJTH-UPHUGPLXSA-N 460.531 0.578 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cccc([N+](=O)[O-])c1=O 1800285039 RZJJZMSCDLEMRZ-OHTBPHCPSA-N 457.281 0.130 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C 1801161242 ZIKGNYFQZPCPSE-PFFSRIRZSA-N 473.954 0.756 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C/N=C/c2ccco2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361786 UEWPCKXGIFYIHR-ODMMXCMLSA-N 460.299 0.793 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377212 ZLKDQTNLHNAMAA-XMSQKQJNSA-N 488.309 0.561 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1 1809781809 SKBRZCCTROZUBY-UWJYYQICSA-N 464.530 0.817 50 20 JCGD CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1 1811625848 PDIUCUVTTAOAEB-HRAATJIYSA-N 490.524 0.902 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCc2cncnc2)[C@@H]1c1cccnc1 1813071906 VZINIJFVJMODOA-AUSIDOKSSA-N 453.547 0.883 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1814030561 BHQIMVSDUYOURZ-KNQAVFIVSA-N 496.373 0.996 50 20 JCGD C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)n1cccc1C=O 1815354507 GCPQJLMTKANVSF-BBRMVZONSA-N 466.328 0.924 50 20 JCGD CN1N=C(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)CCC1=O 1817473842 CDRNCSHGZWXKJK-KRWDZBQOSA-N 452.280 0.004 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1)c1cccc(B(O)O)c1 1817474306 CSMIAXBIYWKUOD-QGZVFWFLSA-N 475.274 0.458 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)[nH]n1 1819401593 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COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@H]1O)CCO2 1830827015 CVFLUUZNQVNUAN-VLVHOKLOSA-N 466.962 0.993 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833024522 QNBGSILBJUOBGQ-DDVAMESESA-N 482.965 0.857 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1 1834603278 PIBYCXHPEURGCQ-FQEVSTJZSA-N 486.034 0.804 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOCC3)CC2)CC1 1834619494 TXRMYNAQPKEHSL-INIZCTEOSA-N 459.429 0.921 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCc3cnc[nH]3)CC2)CC1 1835737144 OTNTUEPGRIWNDS-UHFFFAOYSA-N 468.562 0.226 50 20 JCGD Cc1c(F)ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1N 1835871574 WMECEUXEDRCKFF-HSZRJFAPSA-N 486.504 0.099 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc43)C2)C1 1835939581 BBKWSEVGTWPZMC-WIOPSUGQSA-N 464.327 0.166 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ncccc3F)CC2)CC1 1836023340 JFVKGAUTAFSSOM-UHFFFAOYSA-N 469.521 0.718 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cnccc4n3)C2)C1 1837459663 VLMKKHQBKMGHPK-DEOSSOPVSA-N 491.508 0.012 50 20 JCGD O=C(c1nnc(-c2ccccc2)o1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837534392 LWFCVBZTYDWOCU-MGPUTAFESA-N 450.879 0.406 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccncc3F)CC2)CC1 1837920390 RVCROXYFIJFPDR-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)nn1 1838346191 LZDHJZWIAXNSLB-SCLBCKFNSA-N 457.325 0.586 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)CCO2 1839084460 DCUZTWHKMZDFEU-MFCZKXCZSA-N 472.380 0.627 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1839146452 OTKOBUXYCOEPBY-KKSFZXQISA-N 479.921 0.766 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@]3(O)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1839148783 JSAPMNUEQJFTDB-USCONSEESA-N 489.997 0.832 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 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Cc1ncc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1840518237 JIWIVUYUOURVFO-UHQIAATHSA-N 486.554 0.233 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)CC2=O)c1 1841008233 KRCLJPHZQGQDOB-SFHVURJKSA-N 477.326 0.245 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)CO2)C1 1841353890 WPHSJGFJHKQAEC-CABCVRRESA-N 457.955 0.816 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1841520631 IQWPQCMEPSZJMT-UHFFFAOYSA-N 470.530 0.679 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1 1844265333 RTDKBVPIPYPLRS-UHFFFAOYSA-N 485.566 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2=Cc3ccccc3NC(=O)C2)C1 1844642731 MZLAGBQEPQYYGV-UHFFFAOYSA-N 460.494 0.928 50 20 JCGD Cn1c(=O)n(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c2ccccc21 10824301 LCQIRECCEMKWHR-UHFFFAOYSA-N 471.539 0.976 50 20 JCGD N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)CC2)cc1 15855712 DPLQMVOKAWBPMZ-UHFFFAOYSA-N 480.506 0.657 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)COc1cccnc1)c(=O)n2Cc1ccccc1 726865945 SKBGNRWOEJMOBA-UHFFFAOYSA-N 477.481 0.049 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2ccc(Br)c([N+](=O)[O-])c2)c(=O)n(C)c1=O 730569143 PPCQJBIAPLHATB-UHFFFAOYSA-N 457.266 0.392 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(C#N)cc3)c2)CC1 747175920 QBIJEYXWQOLNOY-UHFFFAOYSA-N 455.496 0.486 50 20 JCGD COC(=O)c1csc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 749152471 QOBKYAJKEAFLMP-UHFFFAOYSA-N 473.554 0.943 50 20 JCGD Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1O 788024440 YFHJFVQLIVNBPD-CQSZACIVSA-N 471.491 0.693 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1C 879221546 BKHIFZICIKANIB-UHFFFAOYSA-N 457.512 0.632 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)c2ccccc2c1=O 914602622 FZOKYJSGNPQSCE-UHFFFAOYSA-N 455.496 0.697 50 20 JCGD COCCOc1ccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cn1 916512057 FWQDOKSXXCMWBB-UHFFFAOYSA-N 450.521 0.853 50 20 JCGD C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916516284 JLNCRWFNMUEYSC-INIZCTEOSA-N 494.549 0.470 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)C[C@@H](C)O1 917362902 RFRITAKKBHBPNX-ZHALLVOQSA-N 452.577 0.877 50 20 JCGD C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)S(=O)(=O)c1ccc(F)cc1 917901080 PFWDFPWSGSAQDT-CQSZACIVSA-N 499.542 0.470 50 20 JCGD Cn1c(CCC(=O)NNC(=O)NC2CC2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 920766396 DCWCPKXDMHEGND-UHFFFAOYSA-N 450.521 0.020 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2nc(CN3CCOCC3)cs2)cc1 920931298 JZOGEESLGUFFAA-UHFFFAOYSA-N 482.588 0.757 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CC3(F)F)C2)C1)NC(=O)NCc1ccccc1 1778151258 QTYZRMCRVCTVFY-UWJYYQICSA-N 465.501 0.818 50 20 JCGD Cc1c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)nc2ccccn12 1778494876 GDCUWLNSVDQHQZ-CJFMBICVSA-N 476.342 0.764 50 20 JCGD CC[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)N(CC)CC 1779371306 NAQGFILILONCNM-YOSAUDMPSA-N 474.606 0.933 50 20 JCGD COc1nn(C)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970496 WPNDAHLLEKLQFO-XMMPIXPASA-N 499.572 0.218 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc(-n3cncn3)c2)C1 1781127036 ZHGIESVRUPNZHP-HYBUGGRVSA-N 483.573 0.768 50 20 JCGD COc1cc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)ccn1 1782209422 OETKWEGRQGGPMX-NTKDMRAZSA-N 475.590 0.910 50 20 JCGD O=Cc1ccccc1-c1cncc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1782765025 KTZPTAPFTDKSQE-HHHXNRCGSA-N 499.332 0.998 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2cc(C)c(O)nc2=O)C1 1783118859 SGYKOHJSZHWZHK-STXHMFSFSA-N 456.927 0.025 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786986429 AQLZOGDKYDYCKZ-QSFXBCCZSA-N 472.734 0.936 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc2c1OCCO2 1787940942 YDNARYXXRILWIM-LRQRDZAKSA-N 466.299 0.045 50 20 JCGD 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50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837717431 FMRQMDQFIROJJM-NRFANRHFSA-N 452.628 0.887 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3O)CCO2)C1 1837814352 KKXYLLPWZNQHTD-AOMKIAJQSA-N 498.964 0.989 50 20 JCGD Cc1noc(N)c1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837857792 RFTKDZYHPCTPFL-UHFFFAOYSA-N 456.308 0.171 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nnc3C)C2)C1 1838528451 YZOBEJVXYDQIEO-NRFANRHFSA-N 488.457 0.330 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)N1CCN(C)CC1)CCO2 1839105950 MMEUAAIUNVUZEI-SQGPQFPESA-N 475.428 0.110 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)n4ccnc4n3)CCO2)C1 1839549763 JPXULRVWEOPGRB-FOIQADDNSA-N 451.911 0.362 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCOCCOCCOC)CCO2)C1 1840077875 QKZZSFNSSRYCLI-PXNSSMCTSA-N 495.411 0.686 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccnc3OC)C2)C1 1840150341 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COc1cc(OC)c(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1F 1801012934 GJNXDFILELXLPV-NGVSDPCNSA-N 484.500 0.558 50 20 JCGD CCOc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1804918590 YSLYTZWZLFDJIW-IIBYNOLFSA-N 490.524 0.902 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n(C)n1 1804923553 LAIQKUDARQWCCZ-QRWLVFNGSA-N 478.513 0.456 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1 1807362412 VNPMOOJHHGHCCQ-PGRDOPGGSA-N 476.298 0.946 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807368611 VYUMLFVGLDFGFE-FDQGKXFDSA-N 460.137 0.864 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)/C=C/c2cnccn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374564 LIKIYZVPTGERMR-KMCHRFPVSA-N 457.299 0.584 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375347 SMTXYRGPFNNKLI-AGHHOFFYSA-N 461.331 0.614 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3ccncc23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 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JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCNC(=O)C1)CC2 1817283100 UZQLNFUJIKNBPK-FIMJWLBGSA-N 471.543 0.715 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc2cccnn2n1 1820083924 VBHOWJRFEAPPNL-LJQANCHMSA-N 459.275 0.752 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1)[C@H](F)Br 1820932160 YMYBHMXZFRFEIU-DOMZBBRYSA-N 480.360 0.823 50 20 JCGD O=C([C@H](O)CCl)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H](O)C1)CCN2C(=O)OCc1ccccc1 1829096108 NGMKWMHTGFIMNO-KCESLBEFSA-N 479.961 0.809 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1830543938 IVIJASYROJOZPK-BFUOFWGJSA-N 484.326 0.969 50 20 JCGD Cc1ccn(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n1 1833082232 AAMXKJRWBBHHHO-JTSKRJEESA-N 499.996 0.780 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C(=O)c3ccco3)CC2)CC1)c1ccc(B(O)O)cc1 1834797410 IYPMHZDDFUMOIC-UHFFFAOYSA-N 453.304 0.028 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc(F)nc1 1835884034 NXVMTMGNCJAWAT-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD CCc1nc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)co1 1835985615 QGCSZUUQNVAPSK-UHFFFAOYSA-N 469.546 0.735 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc[nH]c3[N+](=O)[O-])CCO2)C1 1836508333 WAGUHZMJNZLXIT-BZNIZROVSA-N 460.285 0.561 50 20 JCGD O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1 1836717843 KFQHLBXNWKKXFS-JTDSTZFVSA-N 455.983 0.986 50 20 JCGD Cc1cc2cccc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c2[nH]1 1837460015 ZHZPLVNXJVBZFC-RUZDIDTESA-N 492.536 0.859 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1838403747 AYABAXVTLPUZSQ-LIRRHRJNSA-N 462.385 0.419 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(C#N)c1)CCO2 1838906726 BUZDWLMVWDHRBK-VNSNFZHPSA-N 478.509 0.762 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C)c3)C2)C1)NC(=O)NCc1ccccc1 1839054173 JVOPGSWEXUPCRX-VWLOTQADSA-N 498.584 0.441 50 20 JCGD O=C([C@H]1CC[C@@H]2CCC(=O)N2C1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839084079 QTYBSVZZMIQOQX-QMYADUOMSA-N 476.343 0.534 50 20 JCGD O=C(c1c(O)cc(O)cc1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201532 AGVDEQXHKPEXLH-WMLDXEAASA-N 463.256 0.564 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(OC(F)F)cc1)CCO2 1839331722 PXVAIDJLVQRLEQ-QFIPXVFZSA-N 484.500 0.731 50 20 JCGD CS(=O)(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839743428 QGPTYGKMGMITFU-CJRTWVEFSA-N 483.493 0.373 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCO2)C1 1839914316 YYSXOWYQIWZHDQ-REYXVDKWSA-N 471.558 0.581 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840036682 PWMLWNMCBMLWGL-QFBILLFUSA-N 481.384 0.296 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1840076085 QQLBKFLBUZOHRZ-YLJYHZDGSA-N 495.411 0.544 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4ccc(OC)nc34)C2)C1 1840153791 AVQUEFQLZVGCNU-BTYIYWSLSA-N 466.922 0.895 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c1 1840185555 RZZNPTHHNASIJW-RXVLNYDTSA-N 474.558 0.538 50 20 JCGD O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1840186502 NTJPTOYELYYCMJ-NSPYISDASA-N 475.329 0.253 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840277344 XAGLPMWHQPFUKU-GSHUGGBRSA-N 489.997 0.690 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)CCO2 1840370203 MQFABNJILNRHBK-WAOWUJCRSA-N 469.970 0.321 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1cccs1 1840378213 LHCAYUBBZWROAM-KKSFZXQISA-N 452.577 0.681 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCCNC(=O)OC(C)(C)C)CCO2 1840907365 VPSCNNXMEBEVMR-HSZRJFAPSA-N 499.609 0.121 50 20 JCGD O=C([C@@H]1CCCN1C(=O)c1ccc(F)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010379 KAQIVORQODAJEF-NRFANRHFSA-N 479.317 0.627 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)cc2)CC1 1843012601 FMXQXIGNHMWKFY-UHFFFAOYSA-N 476.386 0.639 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)[C@H]2SC(=N)NC2=O)C1 1843405349 QTUKXRANZWCEMN-IZMVQDNVSA-N 459.532 0.126 50 20 JCGD Cc1nc(CC(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)no1 1845038463 DYIALNMMEAIHCX-UHFFFAOYSA-N 455.519 0.470 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1OC 15793378 CMAYWPXXSPTJNU-UHFFFAOYSA-N 467.475 0.939 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccc(C)cc2)cc1OC 104563062 ZNLAWLQTPGVSKB-UHFFFAOYSA-N 465.484 0.295 50 20 JCGD COc1ccc(-c2noc(CN3CCN(C(=O)NNC(=O)CNC(=O)c4ccco4)CC3)n2)cc1 725870653 NHCJANQWBQOMDJ-UHFFFAOYSA-N 483.485 0.627 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cnc21 727221453 QUYWMGYGDVGBEF-UHFFFAOYSA-N 497.693 0.550 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(Br)cc1F 728503458 PWCLSNXXCPGXTN-SSDOTTSWSA-N 473.298 0.119 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1)C1CCN(c2ncccn2)CC1 728854323 QXCFGZYYVHYPNU-HNNXBMFYSA-N 488.526 0.140 50 20 JCGD CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)COc1ccccc1O)n2C 730781914 CCIPQRFWGFEPCH-UHFFFAOYSA-N 475.527 0.688 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccoc1 747185843 BKVZQKIJDVTIGB-OQRGYWNNSA-N 455.514 0.434 50 20 JCGD O=C(COC(=O)[C@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1ccccc1 771189368 QCHOJWMKZXRXDH-DOTOQJQBSA-N 481.914 0.468 50 20 JCGD O=C(NN=Cc1c(Sc2nnnn2-c2ccccc2)nc2ccccn2c1=O)C(=O)NC1CC1 818269506 XXPLYGIMRRXSJY-UHFFFAOYSA-N 475.494 0.550 50 20 JCGD Cc1cc(C)cc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)c1 906478303 ORSQEUBRLRWBBX-UHFFFAOYSA-N 460.512 0.264 50 20 JCGD C[C@@]12CCC(=O)N1[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)CS2 912642986 YLQWPXFSTQFERB-HNAYVOBHSA-N 452.558 0.686 50 20 JCGD CC(C)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 913156147 VVZYNPZXBFRZEU-UHFFFAOYSA-N 457.516 0.915 50 20 JCGD O=C(NCc1ccnc(N2CCOCC2)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916389230 RMMVXWOFBHOMCH-UHFFFAOYSA-N 488.570 0.847 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(S(N)(=O)=O)c2)c1 916623939 HMHGXKWCURVPCI-UHFFFAOYSA-N 483.572 0.509 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1Cl 919884545 HXNDHRBDAULDCF-LBPRGKRZSA-N 466.969 0.502 50 20 JCGD COc1ccc(Br)cc1C(=O)CCC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919886146 QOKNRSGQUYLWNK-LLVKDONJSA-N 462.322 0.938 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccn1C)c(=O)n2Cc1ccccc1 920509498 XDUJJEBPUGWAGD-UHFFFAOYSA-N 477.525 0.864 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnc[nH]1)C2 1778091378 XRGYPQGIQLJPDC-VWCSSDMBSA-N 455.519 0.600 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(F)nc3)CCO2)C1 1779028049 ABADSPZSWMBKEF-QFIPXVFZSA-N 456.478 0.296 50 20 JCGD C[C@H](Nc1nccs1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779373168 JTSIWVYNETYKNB-WTBBCNCBSA-N 487.586 0.770 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn(C(F)F)n3)C2)C1 1779615602 NUNNYHRYQCTBGP-AFEQLLIESA-N 463.445 0.856 50 20 JCGD C[C@H](CN)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559546 QMOUGEABLYXXDS-DRMXPCRNSA-N 474.606 0.441 50 20 JCGD CC[C@H](NC)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970034 QKWKNNGOBDILKT-CVDCTZTESA-N 460.579 0.161 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1N(C)C 1781128951 YMYKHBVANURWOE-DEOSSOPVSA-N 467.331 0.198 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CCOCCOCCOCCOC)C2)C1 1781384075 YKJSAEXOPQFYEL-RXVVDRJESA-N 464.987 0.920 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1 1781837911 LKTMADPJXKTDMU-MRAZWZEMSA-N 490.524 0.845 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(-n3cnnc3)cc1)C2 1782210814 OUIZJSYVNTZIHA-HYBUGGRVSA-N 483.573 0.768 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1 1783535104 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0.673 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)ccn1 1833369422 XXXJWOWNHIZUEP-VWLOTQADSA-N 481.358 0.443 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CCNC(=O)c3ccc[nH]3)CC2)CC1 1833800438 PMSPBPZSAXZFMU-UHFFFAOYSA-N 489.621 0.079 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CC3CCOCC3)CC2)CC1)c1ccc(B(O)O)cc1 1834797869 FXBWDLUQFIGKTD-UHFFFAOYSA-N 457.380 0.368 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cccc1 1834799141 PADJYOOYZGLBKC-GOSISDBHSA-N 452.364 0.614 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801248 VRWWWDUSPCVOCT-SFHVURJKSA-N 479.390 0.447 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835055992 SNMPRJFEPCXBRC-OVNWTWFZSA-N 488.593 0.139 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CC2)CC1)[C@H](F)Cl 1835081397 OOINDUJSPZLYQM-KRWDZBQOSA-N 457.890 0.863 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738354 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50 20 JCGD C[C@H]1CN(C[C@@H](C)C(=O)NNC(=S)Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)C[C@@H](C)O1 747725869 RVJMMWNUENATTM-ZACQAIPSSA-N 499.659 0.770 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)c2ccccc2c1=O 749221619 RTFAPYXBWQETAH-UHFFFAOYSA-N 477.525 0.709 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C1CCN(C(N)=O)CC1)N(S(C)(=O)=O)CC2 812437806 FIRPJKLOGOTIDT-MRXNPFEDSA-N 467.548 0.599 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CN3CCCS3(=O)=O)cc2)cc1 916098533 WPWHJDQQBXCUID-UHFFFAOYSA-N 496.567 0.683 50 20 JCGD COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)cc1 919886869 XAYGTZSRMPSGCW-OAHLLOKOSA-N 482.540 0.627 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)n3ccccc3=O)C2)C1 1779264393 CBMZXXYIHUSQMB-QGMFFJNMSA-N 468.514 0.373 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ccc(F)cn13)C2 1779374630 TYKPGWKKXPLQCF-NTKDMRAZSA-N 495.515 0.913 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Cn1cncn1)CCO2 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C[C@@H](Nc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788540175 DZJMHPLZVIUQQD-ALGWMNEGSA-N 466.542 0.779 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnnc3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724643 GXULNOVWLOEKCE-ACRUOGEOSA-N 481.557 0.416 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C[C@@H]21 1791258598 UZDAYNGYFBKXEN-QUSNUVHPSA-N 492.013 0.884 50 20 JCGD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1792314096 ZICUIZBQJKCKGH-UHFFFAOYSA-N 483.380 0.974 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)c1cccc(B(O)O)c1 1793399891 MJOMCRIGTNHHGT-XBYSBRQOSA-N 475.354 0.667 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc(C(F)(F)F)c1 1795741313 UDENSPOCWWWMDQ-CWPLJXCYSA-N 492.259 0.911 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])c2c1OCO2 1798627194 BSNZULJPVLMYSK-NDPMZMCLSA-N 455.851 0.781 50 20 JCGD COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804970980 KEJHQKAMTBRIAK-FXAWDEMLSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360852 CWOPBTRQZSRPMW-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1 1807361182 FFVRQEYTONGPRT-CVDCTZTESA-N 473.342 0.856 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1807366627 GDNGCDGAWGWSQP-AGHHOFFYSA-N 461.331 0.847 50 20 JCGD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc2nccn12 1807372834 IWXFTSWYKIEUHX-KNQAVFIVSA-N 484.325 0.746 50 20 JCGD O=C(Cc1ccc(F)cn1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807480200 YPYPEWUBIBWWRR-JPYJTQIMSA-N 462.290 0.858 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1808291626 OHJCZHHAGQCKNL-AXHNFQJDSA-N 456.330 0.876 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@@H]2c2cccnc2)N1 1808321868 LWINCNFIAMRUIZ-DZXRDFMUSA-N 497.980 0.802 50 20 JCGD Cc1nnsc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1808648053 RVNQKVDZQSJNJT-PBHICJAKSA-N 466.527 0.873 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=C/C(=O)NCc2ccco2)[C@H]1c1cccnc1 1813072555 FISDBLZILRXNNX-YICOQCBLSA-N 496.568 0.926 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCc2cnccn2)[C@H]1c1cccnc1 1813446920 LEFBSVUTNKSNOD-FDDCHVKYSA-N 453.547 0.883 50 20 JCGD CCOC(=O)/C=C/C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819794753 CHIJGFVBVKWXME-QRGHLMKCSA-N 458.500 0.487 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc[n+]([O-])cc2)n[nH]1 1820032256 GHLDUPPQAUDKHI-KRWDZBQOSA-N 450.459 0.661 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCSCC2)CC1 1823720626 BTFXXWYZSISROQ-FQEVSTJZSA-N 474.631 0.967 50 20 JCGD C[C@](O)(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)C(F)(F)F 1824832302 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C[C@@H](Sc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831158842 DWINSMCTEFBXPL-OSPHWJPCSA-N 499.593 0.936 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1831443341 XGHANDDGFITOCW-MRXNPFEDSA-N 453.355 0.134 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC1 1831875489 WIZAIMQLTWKKMI-HTAPYJJXSA-N 454.568 0.595 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833411875 UCBORHYGRSFMBY-HTAPYJJXSA-N 478.933 0.556 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1 1834423480 LEZCQYUPDNMOIZ-LJQANCHMSA-N 497.438 0.814 50 20 JCGD CC[S@](=O)CCC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835656014 TXZWFBFDYWAGTC-XIFFEERXSA-N 478.619 0.029 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](COC)NC(C)=O)CC2)CC1 1835844763 BNAQAOZHZLCPBX-QZTJIDSGSA-N 475.428 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCC(=O)N3CCCC3)CC2)CC1 1837066046 ZXPWKILXVXGXNP-UHFFFAOYSA-N 479.622 0.761 50 20 JCGD O=C(Cc1ccc2c(c1)OCO2)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837748259 OHHFOYMRNRGGQI-UHFFFAOYSA-N 494.353 0.950 50 20 JCGD CC(C)n1cnc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1838148832 RYDUDXMHPRYXKK-UHFFFAOYSA-N 463.583 0.844 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)cc4nn[nH]c34)CCO2)C1 1838620146 SGVHBQLWBHBMMA-IFXJQAMLSA-N 472.329 0.935 50 20 JCGD CC(C)n1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1C(=O)O 1839197725 GQDOGJXIDYMGHD-KDOFPFPSSA-N 491.314 0.923 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200996 UTIOGHSRMQDECK-JDFRZJQESA-N 460.304 0.424 50 20 JCGD O=C1Cc2cccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)c2N1 1839202317 AILWPWGVGAJXSL-VQIMIIECSA-N 470.295 0.942 50 20 JCGD Cc1ccc([C@@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1839946053 WJUAOPBHCPYBMG-CLOONOSVSA-N 466.343 0.549 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1 1840155902 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RAURMXWGCFLUGT-QGZVFWFLSA-N 483.550 0.937 50 20 JCGD Cn1ncc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1C1CC1 747120946 XYFPXQPBARUYOJ-UHFFFAOYSA-N 461.544 0.712 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1csc(N2CCOCC2)n1 748465733 RKSWQDAZAVFPBQ-UHFFFAOYSA-N 488.574 0.058 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1 751278855 CTOOFKWPBDGXSJ-UHFFFAOYSA-N 451.935 0.545 50 20 JCGD COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2=O)c(OC)c1 789047565 YVTRWZCJAIBSAQ-AWEZNQCLSA-N 451.443 0.494 50 20 JCGD COc1ccnc(NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C\c2ccccc2)n1 914762569 PCUQSOMDDBHQKK-CTXBLAANSA-N 469.545 0.322 50 20 JCGD Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 916096595 YBZAXAACXPZOGK-UHFFFAOYSA-N 484.556 0.793 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1 919743403 FJBYSCXCVCRATD-HNNXBMFYSA-N 482.584 0.514 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc3c(c(C(=O)O)c2)OCCO3)c1 919954703 SWRNYSBRQIVESN-UHFFFAOYSA-N 485.496 0.030 50 20 JCGD O=C(CCNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 920212408 IKNRIUSHVLMBIG-SECBINFHSA-N 473.360 0.179 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)COc2cccc(C)c2)c1 920432547 SKKBWPZRWUQCND-UHFFFAOYSA-N 476.555 0.982 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccn4cn3)C2)C1 1778048726 ABVFGQRPWKKCRX-LRULAXNGSA-N 463.498 0.912 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2C1 1778368200 DWOAZZFOFDPXDF-VFNWGFHPSA-N 498.968 0.072 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1 1778635605 QTTSMHZMDWIXJD-QFIPXVFZSA-N 452.251 0.139 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779037097 NRNMUBHBEHYLLU-XMMPIXPASA-N 480.525 0.384 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1780939066 RPLILWIMNAJIBO-DYVFJYSZSA-N 475.340 0.412 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1ccnn1 1780967948 FKIHZBNKVYPBKJ-MBSDFSHPSA-N 484.561 0.015 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)cn1 1780970459 YHAIXMZLEUCIDV-VWLOTQADSA-N 496.568 0.880 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnn1C)CCO2)NC(=O)NCc1ccccc1 1780970619 YRZHLLZBVVGCES-HSZRJFAPSA-N 469.546 0.210 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc2ccnn12 1781224983 RBFSCZIJWRRWPJ-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1782036971 LSUWULLIACHKPC-DEOSSOPVSA-N 466.299 0.300 50 20 JCGD O=C([C@@H]1[C@@H](O)CCN1Cc1ccccc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1782809299 YBPSOSJIQNUKJC-ZVVDCOBXSA-N 451.951 0.051 50 20 JCGD CN[C@H](CC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)C(=O)O 1782864566 OFXHKLZOPUBTRW-ZGADYHEESA-N 462.453 0.764 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 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NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(Cl)cccn34)C[C@@H]21 1788610406 QIJAKJZCSUXZOI-AXHNFQJDSA-N 497.943 0.893 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccn3)C[C@@H]21 1788611539 LNSXYYQANPIWOX-YSSFQJQWSA-N 452.515 0.306 50 20 JCGD CC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)N(CC)CC 1788611656 OMOXETCDECSCJU-QLIIJSOBSA-N 460.579 0.399 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C)nc3O)[C@H]2C1 1789309386 KGYCENNWHQHVRW-YKNBRYRPSA-N 468.514 0.823 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)nn3)C[C@@H]21 1790964649 WCRHUQLXDCGIKD-XUXIUFHCSA-N 457.325 0.714 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1791065376 WRJYIPDLTKAUPS-BJDJZHNGSA-N 464.407 0.610 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)N(C)C(=O)OC(C)(C)C 1791290925 SGJJQSIHTQNLAW-OWSLCNJRSA-N 483.610 0.595 50 20 JCGD COc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1 1792724852 WZVLMBLWVOJEFY-UHHKBMQTSA-N 483.525 0.798 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2 1792868192 QVCFCGWXMZKGQB-NIFZNCRKSA-N 478.384 0.493 50 20 JCGD COC(=O)CSCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1793360111 QTNWDVRDXCZRHR-LOUJCGABSA-N 494.010 0.614 50 20 JCGD CC#CC[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)c1ccccc1 1795740381 ZVSPJQAIWTUYFX-DVKRWUGUSA-N 460.339 0.767 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CS(=O)(=O)C2 1795930682 CKKVPXVBGNEYAZ-NJBDSQKTSA-N 475.365 0.072 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncsc1Br 1796493860 ZWUFACAAFZEFIB-DDFAGTSDSA-N 495.359 0.421 50 20 JCGD CN(C)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797752855 JRXZXZCSXFQQKC-CWPLJXCYSA-N 452.515 0.268 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c1CCC2 1799963846 HRGGNZBAKJOQSZ-DHMDNZFNSA-N 453.503 0.167 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2occc2c1O 1800015298 QCAHBQYHOMWZPY-YVWYUNDQSA-N 450.256 0.335 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)O[C@H]2C1 1800732680 DWKWRXWYRWYFMI-YSJMIEIKSA-N 487.981 0.200 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1COc3ccccc3O1)C2 1801010649 ODGUIQAHPMEEIT-IPPNXFFKSA-N 460.531 0.179 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCCOC3=O)cc1)C2 1801012723 WQDHITSBRLWYSB-OPMZPASUSA-N 487.557 0.610 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1cnccn1 1801444794 DWQYQTRAPAIMBL-DZQZVFGCSA-N 451.487 0.213 50 20 JCGD CN1N=C(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCC1=O 1804121601 HLRNQVQEDOCAQE-QRWLVFNGSA-N 478.513 0.008 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CNC(=O)c2cccnc2)[C@H]1c1cccnc1 1804371654 SSEKQIHCMJMVPB-WZONZLPQSA-N 481.557 0.285 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1806340756 LYXRMRPYUUXLJH-APWZRJJASA-N 460.137 0.866 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1807362090 UKMAKKRIHXWOEU-WMZHIEFXSA-N 473.342 0.856 50 20 JCGD Cn1cc(CCC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1807362183 FKLMVXCWZWVFQJ-NZQKXSOJSA-N 461.331 0.447 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807366277 YEJCHOHLUFVVKP-CTNGQTDRSA-N 463.347 0.363 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1 1810540952 HQJIPDDNUYRAFK-KXBFYZLASA-N 469.578 0.984 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@H]1c1cccnc1 1813075215 XXAOYJJQDQRBNA-SBUREZEXSA-N 469.546 0.589 50 20 JCGD Cc1cnn([C@H](C)C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1 1815347866 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CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1831653716 CZQHFJIRAYDCGG-KKSFZXQISA-N 465.938 0.809 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835059019 KZSKYSYQHDKGCR-ZIAGYGMSSA-N 450.353 0.695 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1 1835498284 CDGUNNXUZRDXNT-GHTZIAJQSA-N 463.922 0.591 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C[C@@]3(F)Cl)CC2)CC1 1835738166 KJAIGOLFBXSKNY-UWJYYQICSA-N 466.945 0.795 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3sc4nccnc4c3N)CCO2)C1 1835880773 HCZNVCHIJLHUKL-CWTRNNRKSA-N 469.951 0.597 50 20 JCGD Cc1ocnc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836008580 PYOAWPUJFCJSLU-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1 1838394784 WOWUQMXMBAKICD-UHFFFAOYSA-N 498.588 0.958 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)cc1)CCO2 1838977216 VVLOTILCELQKDG-QFIPXVFZSA-N 492.259 0.769 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202759 OWFHNDMRZOYYCV-FXAWDEMLSA-N 485.354 0.530 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1 1839351786 QLBZCMRPRUJFEY-BFUOFWGJSA-N 454.321 0.639 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1839964055 DQDKIRXGXBAPJX-KUHUBIRLSA-N 482.335 0.678 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)N3CSCSC3)C2)C1 1840153338 KXSAVWSHXGWDHI-RLFYNMQTSA-N 468.041 0.740 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](N)c3cccc(Cl)c3)C2)C1 1840184297 YWKSFLAZZBIQTB-IFMALSPDSA-N 481.981 0.169 50 20 JCGD C[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1840530329 KJIUKZALESARSA-QQMNAOGKSA-N 459.547 0.581 50 20 JCGD COc1ccc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840654145 ZMIFGEWCDFEQIM-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD O=C(c1ccc(N2C(=O)C=CC2=O)cc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1840771919 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CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1 918138357 PACHHYQKWRMHTI-INIZCTEOSA-N 463.491 0.236 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1nc2ncc(Br)cn2n1 919824590 DROPATYEAODJJD-UHFFFAOYSA-N 473.335 0.860 50 20 JCGD O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919884774 LBYSCFUHTLVIOY-INIZCTEOSA-N 484.531 0.687 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1 920827098 URUAUQNBAQCVAW-UHFFFAOYSA-N 474.495 0.642 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)OCO3)C1 1778441408 AYSFPHDLZJMNEC-AUSIDOKSSA-N 460.531 0.916 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2ncoc2c1 1778696392 ZCJLQDZIDHYLRR-ZJSXRUAMSA-N 463.299 0.949 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779029475 SSAZLCUPUPLWLM-UPCLLVRISA-N 467.526 0.941 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779376094 XHLVDADXGFTCIM-HYBUGGRVSA-N 483.573 0.406 50 20 JCGD COc1nc(C)ccc1C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779740143 DGZIAKHHIOPQQP-JOCHJYFZSA-N 454.487 0.154 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CN3CCN(C)CC3)CCO2)C1 1780097639 BTLOGVGGYGGQMF-QHCPKHFHSA-N 489.529 0.211 50 20 JCGD CNCCCC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968640 CVDQNCVMPVEVME-HSZRJFAPSA-N 460.579 0.162 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCS1(=O)=O)C2 1782002477 QIQIDAWJNDKOLS-VMUDFCTBSA-N 451.383 0.861 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2 1782171197 SNLBUYALDYQSNE-DKNRHBQSSA-N 482.965 0.760 50 20 JCGD COC(=O)c1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1782338109 MXARKCORTDTUBC-ATIYNZHBSA-N 494.353 0.523 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)C(C)(C)O 1783275723 FEOOHVLJFYYKNU-GHZYGTOFSA-N 492.013 0.764 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)CCO2)C1 1783531954 GJRJWSSPQPHZIZ-VFNWGFHPSA-N 494.390 0.635 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@H]1CCc2ccoc2C1 1784232952 BYISSKBEKNRNHT-UZSDIVCKSA-N 452.316 0.358 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1785345860 MLMZQMGHLGJXOH-WZONZLPQSA-N 475.351 0.113 50 20 JCGD COc1cc(C#N)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786980860 BBQXJSRKCKIUFU-HSQYWUDLSA-N 463.299 0.154 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccnc3Cl)C[C@@H]21)c1cccc(B(O)O)c1 1786983402 OVHVTWKENQJDFN-WDSOQIARSA-N 457.723 0.251 50 20 JCGD O=C(CNC(=O)c1cccnc1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788140178 MFUIUGYHDQZWMY-UHFFFAOYSA-N 472.310 0.939 50 20 JCGD COc1cc(OC)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1789546605 JSGOFKTZNJCGOK-SSKFGXFMSA-N 468.315 0.291 50 20 JCGD 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)CC1 1831416082 ASKDIRCXVIVNAR-DFXDRYTJSA-N 456.547 0.876 50 20 JCGD Cn1ncnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1833845432 PYDPBSCFOCDRGZ-DYESRHJHSA-N 492.374 0.891 50 20 JCGD COc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834177986 PPFVTPLAXOGYHH-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834801266 USLHRZZCOLBRQN-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc2c(c1)CNC2=O 1835627572 RWIZQCCZXNTOAB-UHFFFAOYSA-N 490.369 0.109 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ncc(F)cc3F)CC2)CC1 1835737167 RGADWDMMWQXTPQ-UHFFFAOYSA-N 487.511 0.857 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835822100 XDWVIFMAJYIYFS-QGZVFWFLSA-N 466.627 0.236 50 20 JCGD CC#CC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835930661 SNJIQCJVVGBVTF-SQHAQQRYSA-N 490.365 0.634 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc[nH]c4cc3F)C2)C1 1835931080 FIBRNPLGCVWFBD-DEOSSOPVSA-N 481.289 0.371 50 20 JCGD O=C(c1cccc(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931297 LYZRXLRYNSGROX-JOCHJYFZSA-N 458.707 0.404 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc(OC)c1C 1835934177 ONHSDPMISXCUBT-VWLOTQADSA-N 498.341 0.076 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnc4s3)C2)C1 1835936747 BGTIQAKZTDDERW-QHCPKHFHSA-N 481.339 0.360 50 20 JCGD CC(=O)O[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)C(C)C 1837218658 STOKMWFDHNBCOT-UBBHAIMESA-N 491.545 0.165 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)COC3CCCCC3)C2)C1 1837456036 HSVMXARWYAXHON-QHCPKHFHSA-N 475.546 0.104 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)s3)C2)C1 1837456156 CZYLGIAWGSZOAG-HXUWFJFHSA-N 479.946 0.784 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1837482675 ZFDPCEQUZRULMT-JXFKEZNVSA-N 451.600 0.585 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1837712488 UZEBHYGUBWWGRB-IBGZPJMESA-N 452.540 0.096 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)n1cccc1C=O 1837920886 LICOTOOTPNWYKX-SFHVURJKSA-N 481.358 0.854 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1 1838012132 KHQPPYGCUFRRDE-IIBYNOLFSA-N 463.922 0.796 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCc3ccc(O)nn3)CC2)CC1 1838721464 SBUDFEOJVDQWKS-UHFFFAOYSA-N 476.578 0.486 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)COc3ccc(O)nn3)CC2)CC1 1838723966 BCQAAMQQZRESFY-MRXNPFEDSA-N 456.927 0.813 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839049022 FGZZVYCFFAMNDC-WMZOPIPTSA-N 470.299 0.419 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C)c1 1839407283 DNVHYIYBTFSGHO-VWLOTQADSA-N 482.342 0.376 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3ccncc13)CCO2 1839508846 FABWHHGFJDDDBH-XMMPIXPASA-N 469.542 0.678 50 20 JCGD O=C([C@@H]1[C@@H](O)CCN1Cc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1839727256 HBJGJFZOQOCENF-ZVVDCOBXSA-N 469.941 0.613 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1 1839925235 HBRMOTNIUPMHHG-MCCBOCGNSA-N 481.509 0.174 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2 1839962580 KVZYFJVMESIBIK-KXBFYZLASA-N 462.385 0.923 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3C)C2)C1 1840151076 VEZAOZDTYIIBOY-SXWKCWPCSA-N 465.978 0.753 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1840152446 IFLQBQIUAUNWNN-ZHRRBRCNSA-N 480.949 0.201 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])C2)C1 1840155037 NOOJSRUQADSQJA-UTKZUKDTSA-N 485.921 0.856 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840183529 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728329518 QOFKFNMYFXAIBC-GOSISDBHSA-N 467.482 0.967 50 20 JCGD O=C(NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1)NNC(=O)C(=O)N1CCCC1 748460197 MHHQMSUIMPBQSX-UHFFFAOYSA-N 477.518 0.757 50 20 JCGD CS(=O)(=O)N1CCN(CCNC(=O)NNC(=O)c2cc3c(s2)CCCCCC3)CC1 749354285 TXKZGKCUAPKVME-UHFFFAOYSA-N 457.622 0.928 50 20 JCGD CN(C)C(=O)CN1C(=O)C(=NNC(=O)C(=O)N2CCCC2)c2cc(Br)ccc21 750936791 IRNHDIHMPHHKTR-UHFFFAOYSA-N 450.293 0.327 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(F)c1F)c1cccc(S(=O)(=O)N2CCOCC2)c1 751260511 NEDDYLVGPBETTD-UHFFFAOYSA-N 461.468 0.609 50 20 JCGD CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OCC 798149222 XHXAMCRANIKTBO-UHFFFAOYSA-N 489.514 0.199 50 20 JCGD Cc1cccc(O[C@@H](C)C(=O)NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)c1C 817782060 NMLMDBWRMWZIHJ-ZDUSSCGKSA-N 462.484 0.474 50 20 JCGD CCNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1 844235287 DVFOIKGCWPLNAS-UHFFFAOYSA-N 479.511 0.928 50 20 JCGD Cc1c(/C=C(/C#N)C(=O)OCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc(C#N)n1C 913286812 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TYPYXTPBCFQJGN-UHFFFAOYSA-N 482.584 0.810 50 20 JCGD CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)CNC(=O)c2cccs2)c1 1318152391 ZMCBQMAMEMUKRU-UHFFFAOYSA-N 475.346 0.610 50 20 JCGD CC(=O)N1CCN(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)CC1 1778910356 QCPGOIGNLFYJNL-DENIHFKCSA-N 468.671 0.516 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779300020 KPBRCEXGOSMVDK-IIBYNOLFSA-N 473.643 0.944 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)no1 1779373421 PTJWNIRKOXYDLC-UZUQRXQVSA-N 499.528 0.138 50 20 JCGD Cc1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)sc1C 1779981892 NRWXVHYZAJQNBJ-XMSQKQJNSA-N 457.361 0.881 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1)NC(=O)NCc1ccccc1 1780419582 FOWBTPCJJADPGG-QHCPKHFHSA-N 499.528 0.713 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969907 QDQDFDZBKZCESI-JRUKXMRZSA-N 498.584 0.021 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781337516 SZLOBCSMBNIEKH-FNFWKMNBSA-N 495.346 0.276 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2 1781380540 NTOPFJNZWQPGCB-PKOBYXMFSA-N 454.923 0.437 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1 1781881381 SLHQOAKZDRJJCB-XMMPIXPASA-N 460.299 0.514 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2 1782212101 HTBGELDTBDBKKF-IPRDPGLQSA-N 477.606 0.274 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782212380 ZEJXUYCATMNYPH-HOYKHHGWSA-N 499.572 0.941 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC(F)(F)C3)[C@H]2C1 1783456189 PTGRLSLNGKOYNJ-OQUILHJVSA-N 451.474 0.714 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2 1783937384 HXJOTUONTHCRGU-TZIWHRDSSA-N 452.939 0.576 50 20 JCGD 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COc1ccc([C@@H](O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1 1791287150 QEDPTCRYUACUPM-JLEJFLCFSA-N 462.547 0.081 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791578413 SJDIJGLMUDCOLH-LNMJFAINSA-N 484.582 0.854 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793233435 FJZFPELWGSEVHD-JWVYWZTKSA-N 454.357 0.750 50 20 JCGD CC(C)NCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1795711038 LRCUYDVFJYNFOJ-JHDGKUDLSA-N 474.606 0.310 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)cn1 1796079006 XWRSUXXALLQMFK-DABQJJPHSA-N 450.344 0.633 50 20 JCGD CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1797115440 JFUNVXKDCYKRFS-ZHCJQAHYSA-N 475.970 0.202 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1797971919 VNHNZDNNDNFUKV-WPVAHCMFSA-N 496.402 0.733 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc[n+]([O-])cc1)C2 1798524513 DSCGODUTFPSMBC-CWPLJXCYSA-N 470.438 0.671 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]cc1I)[C@H](O)CCl 1798791698 QINSZQGATDLWTC-PKIKSRDPSA-N 452.680 0.866 50 20 JCGD C[C@@H](NC=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1799292879 LXPYVHNICKDFQO-SOVHRIKKSA-N 452.349 0.717 50 20 JCGD COc1cc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1OC 1799706223 BENYRLNYSTYQTG-MFKICJERSA-N 462.547 0.588 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801319634 KWISVTONBHGDJC-ZTENYAIWSA-N 470.555 0.464 50 20 JCGD CC(C)N(C)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1801552605 HMYAUUPWUMSCPP-JHDGKUDLSA-N 474.606 0.262 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371334 SVMFUURJYVXBBZ-DYESRHJHSA-N 467.722 0.631 50 20 JCGD O=C(Cc1ccc2ncnn2c1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807400973 NWMJIAABNOBGRA-GBXCKJPGSA-N 484.325 0.366 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)COCCO)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807454609 VDCOMPCLBLVNGI-ZJSXRUAMSA-N 498.584 0.443 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1nccc2nc[nH]c12 1808132045 NVUROQSFJBJKBI-VGSWGCGISA-N 470.298 0.666 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](COC(C)=O)OC(C)=O)[C@H]1c1cccnc1 1810340670 KVPPZWPZFDAPJE-YDZRNGNQSA-N 469.922 0.836 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc2cccnn2n1 1811268208 VXASPFBAHMUUFJ-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812716551 BDGFHKMTDFABOP-POAQFYNOSA-N 461.390 0.610 50 20 JCGD COC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1813267043 MPJGPLBGSRSWDQ-YRJCQSRDSA-N 469.502 0.577 50 20 JCGD CCOC(CC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)OCC 1815348351 KXOYGVZXZVCNJK-OAHLLOKOSA-N 461.349 0.838 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1817187341 YEVMPRXBGGIAKM-IRXDYDNUSA-N 465.344 0.014 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817474896 ILYFPICXSHQMNX-KRWDZBQOSA-N 471.323 0.920 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnncc1C(=O)O)CC2 1826088015 NLQPDWVECZEYBP-JTQLQIEISA-N 461.504 0.230 50 20 JCGD Cn1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1=O 1827050661 STIZNVXPESTAHT-OAQYLSRUSA-N 451.332 0.612 50 20 JCGD O=C(COc1ccc(O)nn1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053540 SYLFOHNZUHILPB-LJQANCHMSA-N 468.319 0.174 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827058250 VQXGEDDYAVLQOF-VXKWHMMOSA-N 488.346 0.095 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1828128812 XABLXUPQMBKMPF-WBVHZDCISA-N 458.349 0.354 50 20 JCGD COc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)nn1 1829523528 DJBICHIBJSUTHJ-FQEVSTJZSA-N 452.320 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(=O)c3ccccc3o1)CCO2 1830312682 PJOIUAZWBCCTFL-XMMPIXPASA-N 486.525 0.236 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830725477 IZBNSBZEEUBSMG-SVQXRNPESA-N 487.981 0.512 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C[C@H]2C[C@H]21 1830737686 GOKFUKDRCFAPKR-XBJPRQPRSA-N 487.981 0.440 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1 1831114032 VGHXQPIUKHLHSP-LJQANCHMSA-N 468.319 0.174 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2 1832364256 ZCFBFCLKGWFUMV-DEOSSOPVSA-N 482.317 0.307 50 20 JCGD O=C(c1ccc(Br)nc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833256938 XAKLDRHECZCGJK-SJKOYZFVSA-N 480.718 0.653 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)c3cccnc3)CC2)CC1 1833772932 OTUJTWXORNGHSJ-IBGZPJMESA-N 465.982 0.637 50 20 JCGD O=C(Cc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834504750 SMXXCANGBVFDMP-UHFFFAOYSA-N 467.350 0.933 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cnccc1F 1834939000 CCSLSTYWKLYWRA-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc2c(c1)COC2 1835379199 NNYCHRHNHHSJRD-UHFFFAOYSA-N 477.370 0.896 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1 1835582052 INWIARNHOBOWCN-HSZRJFAPSA-N 486.504 0.006 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)n1ccnc1 1835734922 YCPXWRNZXHQMQF-MRXNPFEDSA-N 468.562 0.328 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835749840 ACXQOHFTEVPIAN-QGZVFWFLSA-N 474.610 0.222 50 20 JCGD CSc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1O 1835938377 TZZLROZRYQDCBG-HSZRJFAPSA-N 486.355 0.178 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1 1837456896 RVZXKWSKAVZLKW-NRFANRHFSA-N 474.905 0.117 50 20 JCGD CCCCC[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460594 HNIBIYBWXSXGSI-GAJHUEQPSA-N 461.563 0.972 50 20 JCGD O=C(c1ccnc(Cl)n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837924426 AUBJEXMTLDMENE-IAQYHMDHSA-N 451.680 0.891 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1838435608 XPMURMMQURAKPT-HZPDHXFCSA-N 466.348 0.827 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc3ncnn3c1)CCO2 1839048630 KVKVBCFCBHBWAA-OAQYLSRUSA-N 461.595 0.580 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCN(C)CC3)C2)C1 1839963423 JRYVQOBNXWWTDN-FXAWDEMLSA-N 475.428 0.254 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1840031310 MDKNKMHZPONLBB-KZULUSFZSA-N 455.309 0.034 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)c(C)n2n1 1840033073 SCUWCPVTVHYKJW-ORAYPTAESA-N 481.351 0.595 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1cnc3[nH]ccc3c1)CCO2 1840081963 RELOTUZSZCPDHW-DEOSSOPVSA-N 486.573 0.325 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccccc4)on3)C2)C1 1840182599 HAWJKEVYBQWWNG-DEOSSOPVSA-N 485.541 0.785 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185251 OABRWNMMAFAERW-QHCPKHFHSA-N 490.536 0.225 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(Cl)c1 1840186964 HEUKUFBYDYNSPL-JOCHJYFZSA-N 482.965 0.792 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1841081781 OGGDKJIYPHAOMP-BVZFJXPGSA-N 499.373 0.067 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2ccc(O)nn2)C1)NC(=O)NCc1ccccc1 1842339654 QVHYIOBXKSBDGE-UHFFFAOYSA-N 453.503 0.345 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(CCN3CCCC3)nc2)C1 1843457397 MRGXFEOMEMDFQP-UHFFFAOYSA-N 462.359 0.531 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)O[C@H]2C1 1846149336 RWAJHNHHOMVPHX-RLLQIKCJSA-N 499.373 0.208 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21 10742404 ZUUYJHORKIWKQE-UHFFFAOYSA-N 464.526 0.440 50 20 JCGD CS(=O)(=O)c1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc([N+](=O)[O-])c1 109039794 XNPNVLAQYRGBSR-UHFFFAOYSA-N 455.474 0.366 50 20 JCGD Cn1cccc1C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Br 726540683 JSMQPSSYLSSPHS-AWEZNQCLSA-N 485.360 0.782 50 20 JCGD CCN(CC)C(=O)N1CCC(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1 728329276 UROBWUFOHCPBGG-GOSISDBHSA-N 462.503 0.691 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 729276695 KUPWNZHWOAPQKW-MRVPVSSYSA-N 494.901 0.112 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)c2ccccc2c1=O 729614805 PCMAQWJBFMJXLQ-UHFFFAOYSA-N 479.545 0.270 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccc2cccnc12 747408265 OVIYWYYVLTVFJP-UHFFFAOYSA-N 476.536 0.879 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc4cccnc34)c2)CCN1 747426073 ZSSQLWDYWPRHRL-UHFFFAOYSA-N 453.480 0.430 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1 769694952 SDTLDOXBOZGWES-UHFFFAOYSA-N 477.543 0.282 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 913391876 KZGIHKVXVRVBOP-UHFFFAOYSA-N 487.582 0.527 50 20 JCGD COc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)cc1 913395354 FPDVHSURVNDISF-LIRRHRJNSA-N 469.450 0.579 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccnc2N2CCOCC2)cc1 916400103 QSGPCFRUYWDSBE-UHFFFAOYSA-N 476.559 0.378 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCOc3ccc(F)cc3)nc2)CC1 916613303 KTFLMEHBNWRWMF-UHFFFAOYSA-N 452.512 0.862 50 20 JCGD CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1 916646753 LXOJDTREPYMPRC-UHFFFAOYSA-N 454.530 0.485 50 20 JCGD O=C(CNC(=O)NC1CCCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 917902092 MCYZOUVPOBOMII-UHFFFAOYSA-N 451.549 0.864 50 20 JCGD O=C(COc1ccc(F)cc1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O 918548344 AAXOGLSKAIOHMX-MRXNPFEDSA-N 477.470 0.989 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)CS(C)(=O)=O)cc2)cc1 919690557 UDSITHZOARECLM-UHFFFAOYSA-N 453.542 0.621 50 20 JCGD C[C@@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919885858 OJIQABQRFCZLQI-RHSMWYFYSA-N 492.579 0.958 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)cc1 921074655 VTCYZINEPVQNSS-UHFFFAOYSA-N 453.546 0.634 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]23)c1 921301610 GIGSNVOHVGBEIX-YQQAZPJKSA-N 469.589 0.424 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)nc2N1 1777819112 VFLPAWHXTISKFC-CJFMBICVSA-N 492.341 0.087 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)n1ccnn1)C2 1778093005 ZOWAFTZSJQQHQV-QVQKURAXSA-N 470.534 0.487 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(C4CCN(C(C)=O)CC4)CC3)C2)C1 1778321574 ZCTMOMOYFXOGRH-QPPBQGQZSA-N 499.052 0.793 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn3nccc3c2)C1 1779163819 SBQRITMWNHMVAF-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1OC 1780655241 BHSFSCWRFMNZRC-QHCPKHFHSA-N 454.288 0.141 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(CCO)CCO)C2 1780716652 LEOJRLDZSLHBQL-ATZDWAIDSA-N 454.395 0.023 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)nc2nccn12 1781312752 VBTYYZJEOFXSOK-WZONZLPQSA-N 471.562 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1 1781881846 KDUAFCHMZYPLKT-XMMPIXPASA-N 475.509 0.833 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1O 1782136311 XYVQBERYXHBTAL-JOCHJYFZSA-N 461.519 0.167 50 20 JCGD COC(=O)[C@H]1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)C1 1782164206 FLSOZDTUXQGBMS-NRAIQUKZSA-N 480.606 0.853 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC[C@@]3(CN(C(=O)[C@@H](Cl)COC)CCO3)C1)C2 1782856360 RMDGEDDVYIKCPU-WCJKSRRJSA-N 482.965 0.706 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1O 1783783893 FIGISDNOCWXRPY-XERREHJYSA-N 483.525 0.235 50 20 JCGD CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21 1784618034 GXZXPOWOUYORFY-NXOAAHMSSA-N 450.001 0.799 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)cc(F)c3F)C2)C1 1785087231 VMHKXWKHHKQMOW-NRFANRHFSA-N 463.416 0.860 50 20 JCGD Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(C)s1 1785409372 FHUPSPPBQYMEIV-QRFRQXIXSA-N 457.361 0.276 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(Cl)cn3)C[C@@H]21 1787509080 RPDMDFKFPIBTGH-RAKJEAAFSA-N 475.937 0.650 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cnnc2ccccc12 1787884704 XTSDQSZFXCQKBB-BUKVSMQUSA-N 460.299 0.217 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1788572633 METXSRDIVUHFGG-GNOJTZLFSA-N 459.547 0.673 50 20 JCGD COc1cc(OC)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1789547055 SLVLLERMSHLCKW-SSKFGXFMSA-N 468.315 0.291 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)no1 1789926126 OJRVOKCKKZLQFN-TZQJONAQSA-N 461.288 0.383 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(F)c(F)cc1F 1790043353 WLQHGIABAXMVAJ-RISOHXOYSA-N 462.233 0.691 50 20 JCGD CC(C)(C)OC(=O)N1Cc2[nH]nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)c2C1 1792976240 RWWXXSJTXAZMQE-NOXHYTERSA-N 483.953 0.463 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792982693 MCMQNDNCVWKUJF-TZZQQRSASA-N 457.955 0.575 50 20 JCGD CC(C)(C)OC(=O)N1CCc2nc[nH]c2[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792984152 UORDNWZYXKOCGV-HYUSYPKPSA-N 497.980 0.433 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCCN1C)NC(=O)NCc1ccccc1 1793001992 HEAQRCMKFHQINW-ADYITMSISA-N 486.617 0.407 50 20 JCGD CCOC(=O)c1c(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c[nH]c1C 1793127237 DXDXAGWSPQDKRV-FEJSZKPUSA-N 491.589 0.395 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1CS(C)(=O)=O 1794403473 MNXNKWFWMWXTCQ-VWPFQQQWSA-N 488.404 0.860 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn(-c2cccc(F)c2)n1 1794586370 UQJKMSDQXHYMHL-ACHSLPGTSA-N 478.488 0.971 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1C(F)(F)F)C2)c1cccc(B(O)O)c1 1795737456 IEOYALGFQXPRAF-UPHUGPLXSA-N 476.260 0.831 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2 1796439442 DYECKOBFCAOVDW-QLHHLMATSA-N 468.352 0.741 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)N(C)C(=O)OC(C)(C)C 1797752729 BOZJIDDAKUPRJS-ZXFNITATSA-N 490.561 0.144 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)N1CSCSC1 1797841894 BAFLISPQIPVYCV-GLPAEGGISA-N 494.643 0.753 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(Cl)n1 1798079546 GQDLKBYWERTTLY-WPLOUJSJSA-N 459.894 0.467 50 20 JCGD COCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798522405 VOSLYMHZLDUIBH-YVWYUNDQSA-N 465.459 0.386 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C2CC(O)C2)[C@H]1c1cccnc1 1803044572 YWHRDSUBXIVCEY-OUVGGJRISA-N 452.515 0.992 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1C 1803287500 TZBPZQUNXPHOSX-CVDCTZTESA-N 461.331 0.366 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@H]1CCN(C(=O)CNC(N)=O)[C@@H]1c1cccnc1 1804241580 OOHRHFFBCKYKQF-HLLBOEOZSA-N 482.969 0.888 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCC3(CCCN(C(=O)C(C)(C)CCl)C3)CC2)n(C)c1=O 1805256658 MWUNMRPRCIHBDX-UHFFFAOYSA-N 493.008 0.930 50 20 JCGD NC[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccc1 1807251088 FUPULCPBEIVCJG-OEMFJLHTSA-N 472.354 0.824 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1807950554 UVEVRTOFOCYFHZ-ITDIGPHOSA-N 475.307 0.311 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnc2[nH]ncc2c1 1809703361 KVNLPCVZZVTUTA-LAUBAEHRSA-N 470.298 0.666 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809980533 VAUONAYNDGQSKZ-UHFFFAOYSA-N 459.352 0.736 50 20 JCGD CC(=O)NCC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1815342020 WGPOTJMJSSGPAT-KRWDZBQOSA-N 470.534 0.876 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nonc3c1)CC2)c1cccc(B(O)O)c1 1815356713 MZUKQWSQRRODAV-AWEZNQCLSA-N 463.284 0.899 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CSc2nc[nH]n2)[nH]n1)c1cccc(B(O)O)c1 1817479824 SROQVNSEXMUDQC-OAHLLOKOSA-N 455.309 0.306 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1[nH]nc2ncccc12 1817913670 GPUMGZIEDRSPFQ-QGZVFWFLSA-N 459.275 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)[nH]n1 1819404099 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1830733330 IPXUQQYRPXOIKJ-APWZRJJASA-N 486.750 0.990 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1831639823 DVNJRRNAMFXOPZ-WEBUEUPWSA-N 482.965 0.857 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873627 QPOJSOMMTIHAIE-VQTJNVASSA-N 482.578 0.474 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1 1833263029 GSKYGSAIHZWQKG-KDOFPFPSSA-N 475.428 0.740 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1 1833263030 GSKYGSAIHZWQKG-KSSFIOAISA-N 475.428 0.740 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1833947635 GKMPFXDVBNLGFD-UHFFFAOYSA-N 471.388 0.936 50 20 JCGD CCOc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)nn1 1834798439 WBTSEMDNNGQVTM-UHFFFAOYSA-N 481.362 0.054 50 20 JCGD CC(C)N1CCC(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1834800035 QTEPDCXBXLCFSK-UHFFFAOYSA-N 484.450 0.672 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)[C@@H]1SC(=N)NC1=O 1834821595 OOXPKFJJXWOHSD-PLQHRBFRSA-N 477.381 0.030 50 20 JCGD Cc1ccccc1OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835152332 CFDIJVXKDADBLE-DEOSSOPVSA-N 483.525 0.143 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccns3)CC2)CC1 1835737185 UENARLGOTJKZMX-UHFFFAOYSA-N 457.560 0.641 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cn4cccnc4n3)CC2)CC1 1835737824 FIJQXGHRTHDSMU-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1)CCO2 1836641409 FUNFVERMHGZZIB-HOIFWPIMSA-N 489.997 0.954 50 20 JCGD C=CC[C@@H](C(=C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459368 NHMNEHSHRMHCFY-SBUREZEXSA-N 457.531 0.524 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(Cl)s3)C2)C1 1837459790 XKMPJQSEZNWTJB-IBGZPJMESA-N 480.934 0.179 50 20 JCGD CCSc1cccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1838847363 ZWTXWOHAVFLYRX-HSZRJFAPSA-N 485.371 0.257 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)N1CCN(C)CC1 1839154584 RTYXKHYLUUSNGL-FFZOFVMBSA-N 465.422 0.315 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)nc3OC)C2)C1 1839963690 SCFIDFZKXQHINN-RDTXWAMCSA-N 459.341 0.672 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3C(=O)c4ccccc4C3=O)C2)C1 1840150918 SLRDTLPGDUBDFW-WZONZLPQSA-N 493.944 0.383 50 20 JCGD CO[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1840206860 KPQYOMRDRIDFQX-AUSJPIAWSA-N 463.959 0.610 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)Cc2ccc3ncnn3c2)C1)NC(=O)NCc1ccccc1 1845028628 MSDPZDQZEKXFRZ-UHFFFAOYSA-N 490.568 0.821 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1 1845219187 ZNLAAZGGZIRLCX-INIZCTEOSA-N 469.348 0.967 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H]3C[C@@H]3N1C(=O)OC(C)(C)C)C2 1846384000 RNFITVOHEDBLBA-ULQDDVLXSA-N 463.579 0.961 50 20 JCGD Cn1ncc(I)c1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847558431 FJIOZGHFKFPDJX-GARJFASQSA-N 452.680 0.440 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)cc(Cl)c1 729274855 FWIZBGHCXWDRSK-ZANVPECISA-N 451.332 0.683 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1 729274877 GKIXPLVFCNENOT-NSHDSACASA-N 458.493 0.325 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)Cc1ccccn1 729393327 MSTFMIMHSNDHPB-MRXNPFEDSA-N 488.975 0.207 50 20 JCGD O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)N1CCCC1 748247482 PXNFYMHVPRLAKY-UHFFFAOYSA-N 474.495 0.642 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br)C(=O)N1CCCC1 748247747 VQJCPHSIEADIAT-UHFFFAOYSA-N 459.322 0.273 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O 751209207 MNYBPRADAVWIAP-ZDUSSCGKSA-N 456.480 0.714 50 20 JCGD CC(C)NC(=O)C(=O)N1CCN(C(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1 838683119 OTZLPOHUOQFSEW-ZDUSSCGKSA-N 484.351 0.626 50 20 JCGD Cc1c(/C=C(/C#N)C(=O)OCC(=O)N(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc(C#N)n1C 913286748 HHRPRRIVDQONEV-UFPSXOQQSA-N 474.539 0.850 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)C[C@H]1CCCO1)N(S(C)(=O)=O)CC2 915639823 WYIWKSTWILZQGE-ZBFHGGJFSA-N 455.533 0.669 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c1 915906222 SPZUUSXGEDDULE-UHFFFAOYSA-N 480.547 0.136 50 20 JCGD C[C@@H]1CN(CCCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@@H](C)O1 916249651 DEYLINIJNBXFIH-IAGOWNOFSA-N 469.612 0.143 50 20 JCGD COc1cc(CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccn1 916255504 HZFNJNYZSWTMGY-UHFFFAOYSA-N 477.543 0.574 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCc1ccnn1C)N(S(C)(=O)=O)CC2 916570926 FRCLLDGTYWPWGI-INIZCTEOSA-N 480.547 0.217 50 20 JCGD C[C@]1(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)CCS(=O)(=O)C1 916649878 VMNCCORPHRLVCO-QAPCUYQASA-N 460.578 0.025 50 20 JCGD O=C(COC(=O)[C@H]1C[C@H](O)CN1C(=O)Cc1ccccc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1 919179820 CLIYOZSISVTKCF-FUHWJXTLSA-N 488.428 0.243 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)COc3ccc(OCc4ccccc4)cc3)n(C)c2n(C)c1=O 919688787 HQHNTFFIKLNPKM-UHFFFAOYSA-N 491.504 0.995 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)c1 920238446 CPTKSEYEACQTPM-HNNXBMFYSA-N 475.593 0.085 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778113832 DUGDNMYKZCVNQV-KBXCAEBGSA-N 480.425 0.519 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3ncccn23)C1 1778653515 YODIQQZMOGPFQT-WZONZLPQSA-N 478.513 0.169 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNCP(=O)(O)O)C2 1780712839 FTEUSQSVIZWEJM-UHOFOFEASA-N 460.295 0.461 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)c1 1780865264 ZWERVALAVVQHDN-HSZRJFAPSA-N 453.499 0.759 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(O)cn1)CCO2)NC(=O)NCc1ccccc1 1780968841 FVFZYPOLGOHPFS-XMMPIXPASA-N 482.541 0.577 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2)NC(=O)NCc1ccccc1 1780969843 KIDMRXQAMBRADA-FXAWDEMLSA-N 455.918 0.697 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)(Cl)Cl)C1 1781840160 KUEFYOYVHIOTAS-RHSMWYFYSA-N 463.554 0.864 50 20 JCGD COC(=O)[C@H]1CCC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)C1 1782214052 LDWUVCPNZGLVHJ-YBJWPOLQSA-N 480.606 0.853 50 20 JCGD O=C(CCOc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1783789716 FGCPAJMQBNDPRH-HSQYWUDLSA-N 470.306 0.568 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@H]1C[C@H]1c1ccc(F)cc1 1783884939 OWVYEIKWATUMTN-RSYUGDCRSA-N 466.318 0.903 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)nc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984659 WAPFHKWGMOEDSK-IHPCNDPISA-N 455.295 0.127 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1787125243 KKZCNTYWMXFVCF-QNILMXGZSA-N 463.934 0.871 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)n3)C[C@@H]21 1787508813 VLVOCMNFSWCDLZ-XGBLWMCESA-N 456.478 0.948 50 20 JCGD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)[C@@H]1SC(=N)NC1=O 1788632402 CBIIJFKUOXHHNO-ACJLOTCBSA-N 480.355 0.917 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ncsc4[nH]3)[C@H]2C1 1788788760 BRQBSIXYGDAYBR-YLVFBTJISA-N 469.527 0.530 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1789592085 YZQXJXQAILDUFI-YSSFQJQWSA-N 453.499 0.601 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21 1789870254 AZHSLILEAOPNNM-IVAHSZNUSA-N 468.341 0.919 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)[C@H](O)C1 1792513899 IHKIIOZWQOVQFA-RHJCGQNESA-N 459.971 0.842 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)no1 1792867502 CLLPYWIYRMFBCK-AKENFEQQSA-N 457.325 0.932 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)c1cnccc1C(=O)NN)CC2 1797753991 NXVIPGYPUHTTBN-PRHHBONVSA-N 493.564 0.702 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c1CCC3)C2)NC(=O)NCc1ccccc1 1799098039 ZBOBVVOWEKVVQJ-BBIADKPPSA-N 495.584 0.379 50 20 JCGD CC(=O)N[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)c1ccc(F)cc1 1799822546 XXEFXABSZPQFOR-CIAFKFPVSA-N 467.306 0.635 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCN(c2ccccn2)CC1)c1cccc(B(O)O)c1 1799859518 UGUFJZLWCWRIAC-KOUNCHBCSA-N 462.359 0.930 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Cl)COC)C3)cc1 1800433523 PMTBOIYMZXHTEC-YNVMFWSZSA-N 472.991 0.866 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3ccccc3n(C)c1=O)C2 1802336193 JQHATUGUSJAPKW-MUJYYYPQSA-N 454.531 0.558 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1 1804193791 FDZGASLTJAMSJQ-APWZRJJASA-N 487.420 0.603 50 20 JCGD Cn1c(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cccc1=O 1805312109 QOUWYXAOPKBHOX-KKSFZXQISA-N 475.509 0.412 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807365836 PPWPCKIARPUWPE-CEMLEFRQSA-N 450.348 0.565 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807369382 IFQXDJUPPINWJX-AUSIDOKSSA-N 487.325 0.748 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371320 SMJYUIPFKDMMQF-APWZRJJASA-N 460.137 0.866 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1810538828 ABZDQHJXBXQJFC-GHTZIAJQSA-N 482.679 0.669 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1810789083 KLMIGFLGHHSQMO-IBGZPJMESA-N 489.378 0.097 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1C 1811636780 ZXJKTZNHYJOBLY-IIBYNOLFSA-N 457.535 0.516 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1)C(Cl)Cl 1813079892 JFXNSOWORDEKBZ-MFKMUULPSA-N 451.274 0.331 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813437495 OYBCZTZTCXZVCV-NYDSKATKSA-N 474.326 0.944 50 20 JCGD Cc1nc2ncccn2c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815341025 SETDDURKUFXPSU-OAHLLOKOSA-N 476.327 0.714 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2)[C@@H]1SC(=N)NC1=O 1817257331 PBPCDISHFMUOMI-WMFXKJRFSA-N 481.604 0.231 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2 1817275713 AAVZLZKEMNQKSX-SHZQBKKCSA-N 452.924 0.789 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])[nH]n1)c1cccc(B(O)O)c1 1817475399 PURWGJDDTNGGQD-AWEZNQCLSA-N 453.224 0.341 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc4ncccn4n3)sc2C1)c1cccc(B(O)O)c1 1819010076 IYPYMRPXNJDUCL-CQSZACIVSA-N 462.300 0.405 50 20 JCGD COc1nccnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819402271 YPHIMGQOIPKPGS-HNNXBMFYSA-N 465.474 0.827 50 20 JCGD Cc1cc(C)n(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819792929 DPBJJMBJCVONHJ-CYBMUJFWSA-N 468.543 0.881 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3ccncc13)CC2 1819796937 IVDITRBJNFUXBC-NSHDSACASA-N 477.510 0.724 50 20 JCGD COc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)nn1C 1820376992 UFCXRNPUOVEVKH-KRWDZBQOSA-N 452.280 0.451 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)[nH]n1 1822413275 QZVFNJDPOFEVTH-KRWDZBQOSA-N 491.574 0.887 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059907 YILKRPSTMPEWFR-LEWJYISDSA-N 470.404 0.626 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1 1827599181 FMFOHVRDACZVLU-GOSISDBHSA-N 454.292 0.115 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1829030091 POXHZHPLCSSMAW-FXAWDEMLSA-N 487.605 0.588 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccnnc2O)CC1 1829537719 MTCMVZXUHZIEDM-GOSISDBHSA-N 453.503 0.728 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1830361810 DUWZCKNMBOZRKN-NRFANRHFSA-N 467.954 0.352 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1830543666 XRNNNOXNZFDBJT-BONVTDFDSA-N 484.273 0.925 50 20 JCGD O=C(Cc1ccc(Br)nc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733529 OQVQBOXAVQPPAL-RDTXWAMCSA-N 476.755 0.443 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830737778 HAJCQSIYSFAXOV-AUUYWEPGSA-N 479.933 0.002 50 20 JCGD CC(C)[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1830840657 BFCNDGLOTKQQTF-OZXSUGGESA-N 480.370 0.876 50 20 JCGD Cc1nn2cc(CC(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](C)Br)C4)C3)nc2s1 1832109730 BWZZRRIQAJKDPL-SGTLLEGYSA-N 486.392 0.882 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@@H]1CCC(F)(F)C1 1833043746 WCLGLNLJBXUMGD-QGZVFWFLSA-N 463.334 0.987 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)C1 1833308865 BGQNKMVMFLZTFC-HKUYNNGSSA-N 485.390 0.141 50 20 JCGD CC1CCN(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1833405705 ZVQYNZUBXVWBEZ-UHFFFAOYSA-N 470.423 0.284 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1csc(C)n1)CCO2 1834456215 YRPLSJUEQZUVNI-JHXRPTDYSA-N 474.543 0.656 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCC(N2CCC(NC(=O)CNC(=N)N)CC2)CC1 1834678277 RFQNBBOSGTWYET-LFIBNONCSA-N 473.528 0.926 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(Cl)cnc3O)CC2)CC1)c1ccc(B(O)O)cc1 1834798095 SCLGZPUNLXZPHB-UHFFFAOYSA-N 486.765 0.619 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)(C)C 1834800116 WHTQMAZMHROXMK-QFIPXVFZSA-N 486.422 0.102 50 20 JCGD O=C(CCc1ccc2c(c1)OCO2)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1835177519 AZPTXHLEOSUFBJ-HRAATJIYSA-N 454.907 0.404 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC#N)CCO2)C1 1835360261 YIGJNZMQJAAFFK-NRFANRHFSA-N 460.443 0.894 50 20 JCGD N#Cc1c[nH]c(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835737843 GXVJWYAGEWJZBQ-UHFFFAOYSA-N 464.530 0.384 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C#CC3(O)CCCCC3)CC2)CC1 1835753547 WQLFIJCLIFJCDU-UHFFFAOYSA-N 496.612 0.569 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1 1837011426 BMXCEKSLSALTDN-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD C[C@](O)(C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(F)(F)F 1837017025 CREQVHQWRYVXJJ-FQEVSTJZSA-N 487.479 0.611 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(F)c1 1837459942 PBLQLIKQCYQXTR-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(F)c3F)C2)C1 1837461244 RFYNKADSQXLXLC-QFIPXVFZSA-N 493.442 0.486 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)n1nc(C)ccc1=O)CCO2 1837658989 JMKBAPJAQACEQO-HRAATJIYSA-N 454.955 0.761 50 20 JCGD CC[S@@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919091 CXHGVBDDWALVHY-JGCGQSQUSA-N 464.393 0.137 50 20 JCGD O=C(Cc1ccc(F)cn1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921062 WSCCBCCGTKNKAS-UHFFFAOYSA-N 469.322 0.755 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)Cc3cscn3)CC2)CC1 1838063954 GMNLCXMWRCOLIS-IBGZPJMESA-N 480.635 0.385 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838394786 WUYHSGFSHNWWIZ-UHFFFAOYSA-N 487.557 0.807 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]nc3C)C2)C1 1838528101 FLVOBTHAEIPSRT-QFIPXVFZSA-N 487.469 0.935 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C)c1 1838901811 AJHMQYTUSPXVPY-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839032950 BEEOEAIBBKNCKF-VGSWGCGISA-N 478.933 0.725 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839106112 BGDGZSJIUCURGK-FXAWDEMLSA-N 487.439 0.254 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1C 1839404263 NNQORDUPZBHRSK-XMMPIXPASA-N 489.573 0.396 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3CCC4)CCO2)C1 1839530673 DIIBCSKLRWLNQO-IFXJQAMLSA-N 455.353 0.930 50 20 JCGD CN(C)[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccc(Cl)cc1 1839729323 CHCLFVUNGHPFDS-LQWHRVPQSA-N 474.385 0.999 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1 1840156275 PNYJBPWFSLTESZ-PGRDOPGGSA-N 452.935 0.874 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3c3ccc(F)c(F)c3)C2)C1 1840183017 ZILNRPRAIGXWLS-NXMSCROESA-N 494.539 0.898 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc(C)c1O 1840677082 OGORCTZKNUNUFJ-HSZRJFAPSA-N 462.547 0.452 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1Cl 1840732270 UHPKZMFPQLQOKD-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)ccc(Cl)c1F)CCO2 1840751777 DGEKFFVBACTTON-JOCHJYFZSA-N 494.687 0.682 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)CC1 1840817900 AGFLISPWFNPMAS-UTKZUKDTSA-N 475.970 0.565 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1 1840905878 UCNUDTWUGGTBOB-IERDGZPVSA-N 482.375 0.965 50 20 JCGD C[C@H](CC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)NC(=O)OC(C)(C)C 1843379210 XFTPPNBEAIOCAW-CQSZACIVSA-N 460.535 0.805 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1 1844265544 NLXXLKMBYZWCDX-UHFFFAOYSA-N 450.499 0.241 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)[C@@H](C)O)cc1C 9084206 SEUXSOZDACVBSM-KUHUBIRLSA-N 497.957 0.989 50 20 JCGD Cn1nc(SCC(=O)NNC(=S)Nc2cccc(Br)c2)c(=O)n(C)c1=O 16945189 AKPOJHKKDDWQKH-UHFFFAOYSA-N 459.351 0.351 50 20 JCGD C[C@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C1 725871159 GVTOEFNLVNAUOS-HNNXBMFYSA-N 477.543 0.961 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@@H](C)N1C(=O)NC2(CCCC2)C1=O 726651782 NUTQOEXVUMVDQM-LLVKDONJSA-N 466.878 0.906 50 20 JCGD COc1cc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)cc(OC)c1OC 728203458 JWDPAFNQFVCANT-AWEZNQCLSA-N 495.558 0.914 50 20 JCGD CCOC(=O)c1sc2ncc(S(=O)(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2c1C 728510332 HBNVEDFZJUHBCL-SECBINFHSA-N 464.547 0.029 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)n1 728733215 IYNBYFYUGCKNPG-CQSZACIVSA-N 474.495 0.718 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(S(=O)(=O)NCC2CC2)c1 728889916 SWHGLAIWKFOZDW-UHFFFAOYSA-N 458.544 0.843 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2O)cc1 730819804 JWABRBFNSVJHMS-UHFFFAOYSA-N 452.489 0.226 50 20 JCGD CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cc1 906369852 UNTFXIDFCNAJPQ-UHFFFAOYSA-N 496.596 0.639 50 20 JCGD CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 913445743 DTOVGEWYGBMUAV-UHFFFAOYSA-N 492.004 0.869 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1)[C@@H]1CCS(=O)(=O)C1 914868811 FLBCSWFPSSGVJX-CHWSQXEVSA-N 459.471 0.722 50 20 JCGD COc1cccc(C[C@@H](C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)n2nnnc2C)c1 916134602 RQZZGPPMEBBWQB-KRWDZBQOSA-N 486.558 0.837 50 20 JCGD O=C(NCc1cccnc1N1CCOCC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 916400248 YTBQCHJDRBUKKY-UHFFFAOYSA-N 488.570 0.847 50 20 JCGD CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNc2ccc(-n3cccn3)nn2)CC1 916639622 NWFPVJFTCIEPFC-UHFFFAOYSA-N 459.511 0.806 50 20 JCGD O=C(CN1CCN(C(=O)COc2ccc(F)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 917109235 OESONKWDVSMVBQ-UHFFFAOYSA-N 459.434 0.718 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1)N[C@H]1CCS(=O)(=O)C1 919886624 XVOIRLPAGJMVCJ-SFHVURJKSA-N 498.627 0.484 50 20 JCGD O=C(NNC(=O)c1cc2c(s1)CCCCC2)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 1290007091 RCAGFBOZWUJSDV-CYBMUJFWSA-N 452.558 0.944 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2Cc3ccccc3O2)C1 1778838209 NFGFFWZUKTUPJT-DNRQZRRGSA-N 479.537 0.816 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnnc(Cl)c1)C2 1779371098 MPNOKCZOMUAYRG-IIBYNOLFSA-N 473.921 0.570 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(OC4CCOCC4)n3)C2)C1 1779904349 MFNDZKRWRNSQQC-DEOSSOPVSA-N 489.573 0.456 50 20 JCGD CSc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1O 1780153880 DHEBCHDRKZOXMQ-OAQYLSRUSA-N 450.561 0.931 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccn(C)c1=O)CCO2)NC(=O)NCc1ccccc1 1780969795 ONSHRURWLUXYKT-RUZDIDTESA-N 496.568 0.175 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1781445982 WJXMIMITKGEHSS-QHCPKHFHSA-N 482.497 0.621 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c([N+](=O)[O-])c1 1782085628 COPJDGSAOXWCCH-BEFAXECRSA-N 455.851 0.425 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CNC(=O)C3)C2)C1 1783158252 QGIGLRASRJEFLI-LAPQFRIASA-N 458.943 0.085 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1 1783838738 DUDHRZORJRBLGG-QPPBQGQZSA-N 450.300 0.204 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(C(=O)OC)cc3)CCO2)C1 1783884871 VKZALPVEWPNZIV-DYESRHJHSA-N 454.907 0.936 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783934227 BKZKRPJXJTYBRL-OAQYLSRUSA-N 455.556 0.103 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1occc1Br)CCO2 1783934422 GAHPXTCBBVXOES-SFHVURJKSA-N 457.325 0.859 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4ccccc4[C@@H]3O)[C@H]2C1 1784151036 CZBILTOABVTHTA-DCDFMAEDSA-N 493.564 0.574 50 20 JCGD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784219330 VTMCXVGHGHJDQE-YSMRIERISA-N 469.259 0.174 50 20 JCGD O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21 1786401170 RKMJBEOLZOFZNU-DUPGQFARSA-N 483.363 0.757 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c(OC)c1 1788610269 VGTSZYRQNHNWGK-JBYOLUDKSA-N 483.525 0.609 50 20 JCGD Cc1cc(C)nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610482 UZAFGXFFVKHGCX-QSFXBCCZSA-N 452.515 0.604 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)C1CCN(c2ccccn2)CC1 1789719789 QXJYYQMUBITGLS-PMVMPFDFSA-N 492.385 0.271 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccncc3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726673 LRZLEVGTJHTLHC-VABKMULXSA-N 494.596 0.950 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1791054968 BZYCXFMJKPHCAB-LXFSFDBISA-N 478.384 0.635 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C[C@@H]21 1791289424 ZHWOWZRKVMBBJE-SNRMKQJTSA-N 450.511 0.557 50 20 JCGD Cc1cn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)c(=O)nc1O 1792132323 GHAKAYAKSGKKPB-XUXIUFHCSA-N 457.325 0.020 50 20 JCGD CN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl 1793112609 ODVCROGAHXYUHL-ZHCJQAHYSA-N 489.013 0.986 50 20 JCGD CC[S@](=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793880379 XLSINXJEEZYQJF-JJMVIIOLSA-N 480.027 0.867 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2 1793880917 KZVCDTJISQBUKW-LOUJCGABSA-N 484.937 0.828 50 20 JCGD O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cn1)C2 1795112431 HNQKEGURIMPHGL-CCWDJLKJSA-N 467.364 0.906 50 20 JCGD COc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)ccc(F)c1F 1795735741 CCPUJXMLFPTYDA-HBCWATKFSA-N 460.242 0.170 50 20 JCGD CN(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)c1ccccc1Cl 1795741299 SSCQRZSJEHQQNA-YVCBRDFCSA-N 485.777 0.526 50 20 JCGD Cc1cc2[nH]c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)cc2s1 1795741417 WJNJPVCXRAGFBC-YVWYUNDQSA-N 453.329 0.735 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)C1 1796191531 UTLYLYIZXOKUKG-YDLHNXBPSA-N 489.353 0.967 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccccc1C(=O)OCCO 1796191978 XHFFPLGWBZVOSC-REPLKXPHSA-N 466.299 0.081 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2 1796299901 HNJPQKHTODSHBS-IVSAIRAKSA-N 459.616 0.313 50 20 JCGD Cc1nc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)ccc2s1 1797030638 WAAJHUSTQWQAKD-UPHUGPLXSA-N 465.340 0.802 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)c1ccc(O)cc1 1797753179 WLYBGUXETCZSLT-NTNQKNOYSA-N 453.499 0.398 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)C2 1797754209 NLXNTYHCPBJDMB-XEMDLRDOSA-N 475.509 0.592 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798443521 FOZXCVZNIMNMBM-IWSXDTNSSA-N 455.515 0.692 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C)c1)C2)NC(=O)NCc1ccccc1 1799094825 MKJVJOSQOYXDMM-VTYHHJSWSA-N 468.558 0.575 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799347663 NIJJCWIWMXMLAS-BAESOJJISA-N 478.340 0.520 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C 1799350495 UFSAFFBAFDMHMG-QMHWVQJVSA-N 492.411 0.883 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC(=O)NC1)C2 1800329856 GNVCDLDJXQCMBB-ULXNIHAVSA-N 458.465 0.988 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCO1)NC(=O)NCc1ccccc1 1800729628 SGMGQRNOQADGJF-JTJHWIPRSA-N 459.547 0.101 50 20 JCGD COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1F 1801012157 JHMMUUCTADQGGK-MFKICJERSA-N 450.511 0.339 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 1801050609 SQHSIDRGCPAADV-WUUQAYSMSA-N 475.970 0.202 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O)C2 1802336569 MXZZQLZFSRXNJY-RHQZKXFESA-N 495.621 0.616 50 20 JCGD Cc1nc(N)sc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807243669 LTNFZDGYLBZEBK-FUHWJXTLSA-N 465.344 0.742 50 20 JCGD Cn1cc(CCC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1807370740 KBLIPOACEVPGJI-NFBKMPQASA-N 461.331 0.447 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCCO3)[C@@H]1c1cccnc1 1809863542 YNQFREGSVVXWLO-KKSFZXQISA-N 490.524 0.693 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc2ncnn2c1 1810054170 YQHRNCFPIBXKBG-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)[C@H](O)N1CCOCC1 1810351844 QFUMAROTEHCAJY-XSWJXKHESA-N 459.316 0.429 50 20 JCGD Cn1ncc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1Cl 1811166752 FVLDRHOUGLIBTF-APWZRJJASA-N 467.722 0.782 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1 1811270927 PYRRARQGKCZUOW-IIBYNOLFSA-N 485.508 0.756 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3cccnc13)CC2)c1ccc(B(O)O)cc1 1815344130 JKUHGKSCUNWPHQ-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2C(=O)C=CC2=O)n[nH]1 1815472090 PVXMBTQUUKDKHW-MRXNPFEDSA-N 480.485 0.029 50 20 JCGD Cc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c(=O)[nH]c1C 1816114446 XZONXGLUPVJRBY-MRXNPFEDSA-N 479.501 0.728 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCc3nc[nH]c3C2)[nH]n1)c1cccc(B(O)O)c1 1817479535 POIPSXONDAMUPD-FOIQADDNSA-N 462.319 0.924 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1 1819402965 PWFIXHFFOQKWGG-HNNXBMFYSA-N 475.473 0.466 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)n1cncn1 1819404804 ZZNKLANVJNUAEI-LRDDRELGSA-N 452.479 0.567 50 20 JCGD CN1CCC[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)C1 1819798104 WBAOZWUQLLRLMD-STQMWFEESA-N 457.560 0.709 50 20 JCGD O=C(Nc1cccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1820046040 PRGBUONHENTVDP-CQSZACIVSA-N 465.300 0.082 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3ccncc13)CC2 1826085741 ADIRFLUEGZALBV-GFCCVEGCSA-N 456.532 0.785 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)C2CCN(S(C)(=O)=O)CC2)CC1 1828358910 OHFKQBAVBSSIMK-HXUWFJFHSA-N 499.678 0.651 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1828873493 QKSXYZWTWAPKMM-BEFAXECRSA-N 473.578 0.626 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1830540324 PMQUODMTXSSQHB-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD COc1ccccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1830992830 DLWXUKNOYZGCTA-RUZDIDTESA-N 497.552 0.397 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)C(C)(C)C 1831090131 YWBMEAKBSAIWKD-NQIIRXRSSA-N 457.644 0.845 50 20 JCGD O=C(Cc1cc(F)ccc1Cl)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832267835 AKZAOLFOYPEMEN-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD COc1ccc([C@@H](O)C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1 1833181365 XAKIZAXJCFIKHQ-WOJBJXKFSA-N 453.967 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3ccno3)CC2)CC1 1834184124 TYZFOBBDLKFMFE-CVKSISIWSA-N 455.519 0.994 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccn4nccc34)CC2)CC1)c1ccc(B(O)O)cc1 1834799352 ZBPWUUDUVOTUDZ-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD Cn1c(=O)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)nc2ccccc21 1834821206 BHOZMYJECQAMIC-NRFANRHFSA-N 493.358 0.789 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c2ccccc21 1834821442 KKQYBWNRYIRJHP-NRFANRHFSA-N 495.374 0.581 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834821706 UVLWWUHXOBKTGG-IBGZPJMESA-N 466.336 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccc3c(c1)OCO3)CCO2 1835182514 YTKKLGKHQSBHAQ-DEOSSOPVSA-N 490.557 0.177 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc2cnccc2[nH]1 1835611867 UFAFLVMXRPGRGM-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CS(=O)(=O)N3CCCC3)CC2)CC1 1835837201 BAQYLXVKLGWPSB-UHFFFAOYSA-N 488.727 0.835 50 20 JCGD CC(C)(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cn1 1835934529 XBOVCFUXOFNUDT-VWLOTQADSA-N 481.358 0.443 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(=O)Cn3cncn3)CC2)CC1 1836107383 HUCSXOHAFMHZNW-UHFFFAOYSA-N 499.528 0.997 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836130929 VWHQUWVFXCHHPC-ACJLOTCBSA-N 458.309 0.249 50 20 JCGD O=C(c1cc2cn[nH]c2cn1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837199222 CJWUXEVNPZRJFX-WMLDXEAASA-N 456.272 0.718 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1C 1837456536 NUSRLRSNZOCOTH-VWLOTQADSA-N 497.552 0.315 50 20 JCGD O=C(/C=C/c1cnccn1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837921041 UKNDPRMYRVSNGR-AATRIKPKSA-N 464.331 0.482 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)NC=O)CC2)CC1 1838103280 WYWSSZAKODSQKA-DAWOQIAZSA-N 460.535 0.254 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)cc(Cl)n1)CCO2 1838240215 RPPREQATEOMRCG-OAQYLSRUSA-N 494.140 0.452 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838394098 RJYRDDJCANJCPJ-INIZCTEOSA-N 488.589 0.602 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1838943944 YEVOBXZUHUWXQJ-XMMPIXPASA-N 467.526 0.686 50 20 JCGD O=C(c1cnn2ccncc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200037 AJTCKAPACQMAQT-YOEHRIQHSA-N 456.272 0.490 50 20 JCGD COc1cc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1 1839334448 PQFVECMAFRVMOX-JOCHJYFZSA-N 484.500 0.416 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C3CC3)cc1)CCO2 1839438881 DHEAOAUJUYAVTE-RUZDIDTESA-N 464.327 0.628 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1840034841 YYHDUVNXQGEWNM-KPZWWZAWSA-N 456.293 0.664 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)C2)C1 1840150144 GKUUZNVRCGQLEY-SGXKBVARSA-N 471.982 0.488 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)ccc(F)c1F 1840703495 FPFXKNMYBDYFLM-QHCPKHFHSA-N 474.269 0.337 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1842784537 CIGUPCWQRFQTBE-UHFFFAOYSA-N 452.316 0.833 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc(OC3CCOCC3)n2)C1 1844606015 QTFPLXICKHSZIN-UHFFFAOYSA-N 480.525 0.769 50 20 JCGD COc1cc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c([N+](=O)[O-])cc1O 1844737710 PIPWEOSRCYYSFG-UHFFFAOYSA-N 470.442 0.438 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccc(CO)o1)C2)NC(=O)NCc1ccccc1 1845038962 NJQPHPQFNLLLLL-UHFFFAOYSA-N 455.515 0.935 50 20 JCGD C[C@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)N1CCN(C)CC1 1845099308 MRKOKVBAWSBFLC-HXUWFJFHSA-N 485.633 0.172 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)C2 1846386434 LKFHCVNUJRWKHZ-UHFFFAOYSA-N 455.531 0.522 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1847072687 BPQKYMRKLHBESC-SFHVURJKSA-N 459.352 0.877 50 20 JCGD O=C(NNC(=O)c1cc2c(s1)CCOC2)c1cccc(S(=O)(=O)N2CCOCC2)c1 728455693 OVBVWMUPAOCIBK-UHFFFAOYSA-N 451.526 0.917 50 20 JCGD C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1=O 728845631 NPTGAMPDNBHYGM-JOCHJYFZSA-N 451.487 0.308 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2cccnc2)o1 728851510 HHXZQVQSGPDNIL-AWEZNQCLSA-N 450.473 0.395 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cc(C(C)=O)c[nH]1)N(S(C)(=O)=O)CC2 731761075 QKMAGJRUWZOHMF-QGZVFWFLSA-N 478.527 0.945 50 20 JCGD CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 732307830 OBALEZAQNRHUHY-HFWIMWPKSA-N 475.614 0.281 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1 746386458 UQJLYSLRLXQAKM-HUUCEWRRSA-N 483.363 0.545 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(CS(N)(=O)=O)cc1 746631312 PDNZFDYRIAPCEE-UHFFFAOYSA-N 455.876 0.755 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccc(C#N)cc1 747176074 JGKAOQHGCDBPLE-RNUYOQPASA-N 490.563 0.713 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)CNS(=O)(=O)c1ccc(OC)c(OC)c1 769087992 POFQPEASFVYQAB-UHFFFAOYSA-N 475.527 0.742 50 20 JCGD C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1=O 818516117 SOQGIQBAHMRFIR-QFIPXVFZSA-N 466.429 0.945 50 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COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1=NN(c2ccccc2)[C@H](C(N)=O)C1 934245887 JHFRGORPRLQNGU-INIZCTEOSA-N 473.873 0.773 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1778237929 PEMDIPDIQPDPAL-HOYKHHGWSA-N 487.362 0.067 50 20 JCGD Cc1ccc(COCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1779030228 KXKLDTSIVVKQNP-RUZDIDTESA-N 481.553 0.962 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034959 YOIJYXWRKACTIW-KDOFPFPSSA-N 454.325 0.302 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnn3cccc(F)c13)CCO2 1779037346 WRYJYKVUGCRBAV-JOCHJYFZSA-N 467.461 0.229 50 20 JCGD COc1cccc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n1 1779371553 ZBFGDWUPAUBALU-CJFMBICVSA-N 496.568 0.849 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)cc(Cl)n3)C2)C1 1779803711 BOIMHXIWHFSNRQ-FQEVSTJZSA-N 464.114 0.826 50 20 JCGD CN1CCN(C2(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](F)Br)C4)CC2)CC1 1780652117 IPFHNSCBOZZYQZ-GPMSIDNRSA-N 475.403 0.971 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccc(F)cc1 1780909872 AWSZRUPOCALXGI-GMAHTHKFSA-N 477.537 0.206 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2 1781382992 FKOQZFFBXAYEOG-JOCHJYFZSA-N 490.670 0.754 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1782036911 JUDCFAHLPAHZKC-XMMPIXPASA-N 466.299 0.300 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(F)c(F)ccc4c3)C2)C1 1782468647 YKRSBEAQBGGXNR-XMMPIXPASA-N 481.264 0.950 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)CN3CCCCC3=O)C2)C1 1783756366 QQSSPIBDYLCPPV-QHCPKHFHSA-N 488.497 0.976 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1784633359 DFONAERBDVOZBX-DFBJGRDBSA-N 497.600 0.929 50 20 JCGD CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS(=O)(=O)N3CCCC3)[C@H]2C1 1787503632 NTYVKSVTRPLVPJ-JYJNAYRXSA-N 450.001 0.657 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCNC4=O)[C@H]2C1 1788255247 LCFFGZUKIHBQGF-ZJOBFFGXSA-N 482.379 0.783 50 20 JCGD CCOc1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789475730 ZKTLAIQUYWQUGS-XJABCFGWSA-N 452.316 0.672 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc([N+](=O)[O-])cc1F 1790027164 ARHNORRPCXPKCM-DCPHZVHLSA-N 471.250 0.321 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]3C1)C2 1791257516 LBEZSDQXPYQTJY-WSRJKRBPSA-N 496.992 0.856 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)O2)C1 1792972508 SCWXLFHSBRQXQV-ZHCJQAHYSA-N 487.981 0.344 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(C(C)C)CC1 1793797861 UZJXNPYEPVJESM-KBQLEIQFSA-N 472.590 0.830 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1794328397 YRGUAWJOPQLKNF-OPMZPASUSA-N 490.325 0.083 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@@H]1CCCCO1)C2 1796441920 GWPLXZMOQTYYMT-WNTHAQNASA-N 477.587 0.970 50 20 JCGD CC(=O)Nc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)ccn1 1796442167 UIHPIIOWTZUYHU-NSAWHWOWSA-N 481.513 0.377 50 20 JCGD Cc1nc(Br)sc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1796743234 MXEOZOJRSSKLIC-JJLQDPRZSA-N 488.408 0.790 50 20 JCGD Cc1ccc2[nH]c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)cc2c1 1797750793 QMNCRUJKSCUFOE-VPTLXERWSA-N 462.510 0.992 50 20 JCGD Cc1cc2nnc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)c(C)n2n1 1798440343 IJMZYJKUACACDA-QDMKHBRRSA-N 463.502 0.305 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1c(Cl)ccc(Cl)c1O 1799734924 VTMNRBLMYODEAF-IVWMJMPLSA-N 479.125 0.896 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1800839354 DKLDMMQFBGMNPU-OCVGTWLNSA-N 455.321 0.336 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c[nH]c4nccc-4c3n1C)C2 1801011816 HRSYWMDZVOLUPA-VPTLXERWSA-N 481.557 0.582 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(I)c(O)c1 1801903961 JYPCAFILKVOTDV-BAESOJJISA-N 494.713 0.800 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c[nH]c2ncccc12 1802065720 JKNYRDOXPXWVTC-VPTLXERWSA-N 477.525 0.397 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)c1 1805130880 AVRDJVILJPNCKV-UHFFFAOYSA-N 484.383 0.929 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361513 IOMYIDFZFULYPF-NFBKMPQASA-N 496.336 0.976 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)C#CC(=O)O)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807453057 MWQJMVGXFKZWJT-HYBUGGRVSA-N 492.536 0.522 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CSc2ncccn2)[C@H]1c1cccnc1 1807572876 MNGXZZQAYXBWOW-OXJNMPFZSA-N 492.565 0.982 50 20 JCGD CN[C@H](CC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1)C(=O)O 1808414047 DPPBVXLULHFSBH-VFFUBVFWSA-N 483.529 0.284 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnn3cccnc23)[C@H]1c1cccnc1 1809743753 VSEYYBJYOWKZEV-OXJNMPFZSA-N 485.508 0.756 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810294350 JQYVLIRRBUEBPO-DUXKGJEZSA-N 465.558 0.884 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1 1810297689 CMJOCKGIWUWXEX-LIRRHRJNSA-N 462.470 0.209 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@@H]1c1cccnc1 1810305604 MZBQXHAFHKXWOE-NHSHWBJMSA-N 464.526 0.967 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=N/O[C@@H]2CCCCO2)[C@H]1c1cccnc1 1810358002 NXMCUJKSROSYPF-SGEINYERSA-N 474.562 0.989 50 20 JCGD CC(=O)N[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(C)(C)C 1815056520 CGEFUMARVLJYIN-AZUAARDMSA-N 469.351 0.946 50 20 JCGD COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n(C)n1 1815337041 JJHLZHSIBWJHLR-ZDUSSCGKSA-N 455.305 0.105 50 20 JCGD Cc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c(=O)[nH]c1C 1816115683 RPPPAVPRQIYVBM-OAHLLOKOSA-N 458.523 0.789 50 20 JCGD O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1 1816782643 SHUUQJQNRTXMPR-LLVKDONJSA-N 464.284 0.627 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3[nH]nc4ccncc34)sc2C1)c1ccc(B(O)O)cc1 1816857486 IORWWMRWIKVTPN-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD C[C@@H](NC=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2 1822898155 NMVZVFFSXYAOLC-ZBFHGGJFSA-N 487.586 0.536 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1 1824182405 AMYDUXRODWXKQT-IRXDYDNUSA-N 450.001 0.631 50 20 JCGD O=C([C@@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1827400564 XOFQDLBQMGADHY-GXTWGEPZSA-N 470.303 0.736 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CNC2=O)CC1 1827677170 KYWREOOAVLPYAV-CMPFEXHJSA-N 485.545 0.292 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3n(n2)CCCO3)CC1 1828610988 CLTCHSWYSOHPFH-OAQYLSRUSA-N 466.347 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)nc1)CCO2 1829513257 WPJLUCYAVCIGPV-HXUWFJFHSA-N 453.927 0.178 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1830544413 XMYRXLATDNOYHR-AOMKIAJQSA-N 495.418 0.871 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830734914 AFEBAAYOGWNIHR-FOIQADDNSA-N 454.886 0.452 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830738712 SGAIDXNGUAOGQI-DOWNOZBLSA-N 489.997 0.736 50 20 JCGD CO[C@@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551298 IARBWMBVYHBVPK-AUSJPIAWSA-N 463.959 0.610 50 20 JCGD Cc1cccnc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1832778118 AYWPVMDFPHRDSC-DEOSSOPVSA-N 482.541 0.091 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccnc(Cl)c1 1834194989 NFYAZAWLWQHVLO-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nnsc3C3CC3)CC2)CC1)c1ccc(B(O)O)cc1 1834798632 SMLFTIYOGAGZJQ-UHFFFAOYSA-N 483.403 0.594 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1835035408 UEBPTWBAQFOBSY-QHCPKHFHSA-N 462.547 0.067 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)ccc1C 1835931912 GNYGPNMXBYQSNY-VWLOTQADSA-N 495.341 0.017 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1 1837384956 MRHATQICXANFHM-GLJUWKHASA-N 463.373 0.324 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1837841359 BUACDXJCTTUJCH-CVEARBPZSA-N 461.401 0.751 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837870035 ZCTPLKBKOQIVAC-SFHVURJKSA-N 480.374 0.874 50 20 JCGD Nc1nc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cs1 1837891793 ZJFVMKZZMUNDBV-UHFFFAOYSA-N 458.349 0.331 50 20 JCGD C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839184945 IPEQDDWZDBCFEA-JKSBSHDWSA-N 489.997 0.902 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)CCOC1 1839191179 XVQRGMDXMXDLRL-PMACEKPBSA-N 496.388 0.930 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1839962943 VXBCETOZZYNXTA-QRWLVFNGSA-N 485.379 0.765 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1839965067 MCWCUKPJUSLRKD-HNAYVOBHSA-N 469.336 0.650 50 20 JCGD Cc1ccc(F)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182607 HLQZXHNDIDWLMC-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3csc(C(F)(F)F)n3)C2)C1 1840185352 LWKGCYFOFVHGGQ-SFHVURJKSA-N 493.508 0.605 50 20 JCGD CC#C[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccc(O)cc1 1840219533 QQHPBDBWXLOXFP-LEDOBFOHSA-N 464.946 0.945 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)C1 1840945453 XBALQTRFJDJNOG-ACJLOTCBSA-N 467.897 0.936 50 20 JCGD CCn1nnc2c1[C@@H](C(=O)N1CC3(CCCN3C(=O)[C@@H](O)CCl)C1)CN(C(=O)OC(C)(C)C)C2 1841350133 JJOLYALXZJBHSX-HOCLYGCPSA-N 496.996 0.935 50 20 JCGD Cn1c(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc2c1-c1ncccc1OC2 1843013488 OXOBIOVSMBHYLD-UHFFFAOYSA-N 472.310 0.790 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)[C@@H](F)C1 1847723903 KJIFINQKJQCONF-FYQPLNBISA-N 489.353 0.777 50 20 JCGD Cn1c(=O)c2c(ncn2CCC(=O)NNC(=O)Cc2nc(-c3ccccc3)cs2)n(C)c1=O 10600608 JHAZUPASEIZDFH-UHFFFAOYSA-N 467.511 0.337 50 20 JCGD CC(C)(C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)n1cc([N+](=O)[O-])cn1 726496741 IIGFUGSCXKKZBI-UHFFFAOYSA-N 494.530 0.328 50 20 JCGD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)C1 731214410 NBRTVZSAURJMOV-AEFFLSMTSA-N 460.535 0.668 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(S(=O)(=O)CCO)cc1 747571511 DYWRICJRJPGKDQ-UHFFFAOYSA-N 470.887 0.733 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2cn(C)c(C)n2)c2ccccc2c1=O 750663991 UFNNQYYUVADMTQ-UHFFFAOYSA-N 489.558 0.368 50 20 JCGD COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1S(=O)(=O)NC(C)(C)C 751206664 KZJZPVDHZRUELK-UHFFFAOYSA-N 452.489 0.556 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1 751426812 VVZVPPCUYYYFNG-SCTDSRPQSA-N 452.577 0.795 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)NNC(=O)c1csc(N2CCOCC2)n1 807117781 DAFLYYIGFOLQKA-UHFFFAOYSA-N 499.347 0.796 50 20 JCGD CCO[C@@H]1C[C@H]1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 916147852 HAGLMKKRLQYBEY-QZTJIDSGSA-N 482.541 0.636 50 20 JCGD COCCOc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cn1 916513054 SAGHQKOWNOYFBF-UHFFFAOYSA-N 479.563 0.264 50 20 JCGD COc1cc(C(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)ccc1C 918779268 JQAPWMVVEIFHDC-UHFFFAOYSA-N 464.486 0.792 50 20 JCGD O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919890073 ZKQWGMWVNOMGCD-LLVKDONJSA-N 453.546 0.244 50 20 JCGD Cn1c(C=NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)nc2c1c(O)nc(=O)n2C 920362383 ZPCGBFNEXQOZKS-UHFFFAOYSA-N 495.521 0.615 50 20 JCGD CCCNC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Br 1320186480 JRGWDVWEDUUEJI-ZDUSSCGKSA-N 463.354 0.723 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2 1778818219 UKVUTMOUAQVEHL-XMHISIORSA-N 451.549 0.109 50 20 JCGD Cc1cc2nc(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)[nH]c2cc1C 1778925874 CLAXMKYFBPASEP-QHCPKHFHSA-N 456.547 0.996 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC1(F)F)CCO2)NC(=O)NCc1ccccc1 1780969055 UODXDVPLASAMBW-UTKZUKDTSA-N 465.501 0.818 50 20 JCGD COCCOCCOCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cl)COC)C2 1782063846 KGGBUPZLINKCIX-WAOWUJCRSA-N 464.987 0.824 50 20 JCGD C[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)Oc1ccccc1 1782879882 SBEIZAJJKYZBSV-MZNJEOGPSA-N 467.526 0.986 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)NS(=O)(=O)CC)CCO2 1783343413 MWTYGAVLPKIPKB-HEHGZKQESA-N 454.387 0.318 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3c(n1C)-c1ncccc1OC3)CCO2 1783933886 KUKCDGWUOSIAGI-VWLOTQADSA-N 496.568 0.796 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783934223 BKZKRPJXJTYBRL-NRFANRHFSA-N 455.556 0.103 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(Cl)c3nncn3c1)CCO2 1783934730 LSDARKWRSXRSNE-FQEVSTJZSA-N 463.926 0.199 50 20 JCGD COc1ccc2c(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)c[nH]c2c1 1784149439 VBTVYVQCKLSMNE-OWSXEPHWSA-N 491.353 0.692 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)n1 1784295811 MVSMBQHYXGENQW-DEOSSOPVSA-N 466.542 0.773 50 20 JCGD COc1cccnc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1785242084 XYUQOQSNVVAPSU-XERREHJYSA-N 482.541 0.315 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1785567356 IZPPFOADPILRNA-QHCPKHFHSA-N 475.351 0.115 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(C(F)(F)F)n3)C[C@@H]21)c1cccc(B(O)O)c1 1786984431 GEXHRFTUXOFDIF-SNRMKQJTSA-N 491.275 0.616 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1787393249 BWNSMVWSADTTTE-AJNGGQMLSA-N 478.384 0.637 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)Cc3ccccc3)C[C@@H]21 1787507720 MJGCAXWGTFNYSP-BATJVERPSA-N 481.553 0.704 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1[N+](=O)[O-] 1788610354 YEVOQACBJDQNJE-LRQRDZAKSA-N 496.524 0.738 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCOC3)C[C@@H]21)NC(=O)NCc1ccccc1 1789727654 KMQHNZSLQFJXPP-CMOCDZPBSA-N 487.601 0.739 50 20 JCGD COc1cc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(F)c1 1790105940 LRRQOYNYURCIPM-YEWWUXTCSA-N 468.501 0.940 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21)C(Cl)Cl 1791294346 YDPICLVPVATHPR-WRZDFSGXSA-N 459.330 0.776 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCc2sccc2C1 1793898016 KUXNUGQJQIRPMO-VPTLXERWSA-N 484.582 0.008 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794108690 PAWLESJSXVMIMM-SMTWKSNJSA-N 483.363 0.613 50 20 JCGD CC(C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)ccn1 1795737394 YOMQIPQWAMXFDA-RMFSNUHRSA-N 451.332 0.576 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ncccn12 1797027025 CGVHNYXLBMQGCD-LOHQAQBBSA-N 464.486 0.067 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(F)cc(F)cc3[nH]1)C2 1797750507 DADIXDIOUXCCRN-OYHTYJOISA-N 484.463 0.962 50 20 JCGD COc1cc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(F)c1 1797753123 ULJZMGINTWNVRJ-SLAYPKMVSA-N 475.452 0.489 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccn2)[nH]n1 1798172022 WUJAOOUYXQXBEO-BSBFHTJNSA-N 490.524 0.809 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)CC1 1798439646 RPWJCCOJEJEEGN-RDSHKEJNSA-N 457.531 0.916 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnncc1C(=O)O)C2)NC(=O)NCc1ccccc1 1799869157 AEFLPIOBFLCGQO-BCDXTJNWSA-N 495.540 0.773 50 20 JCGD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2)N1CCN(C)CC1 1799968996 QTNCFNHYJJEBOF-SNJCGAMXSA-N 499.660 0.607 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cnc2c(c1)CCNCC2 1800245040 HNFKVZXSKQNYPT-YALNPMBYSA-N 455.328 0.664 50 20 JCGD O=C(CCc1cnc2[nH]ccc2c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1800845367 JTDVPYDAQJEOHQ-HATOLVCRSA-N 462.315 0.079 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCc2cnccn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368015 PKWKYJLAMOSBLP-XXBNENTESA-N 459.315 0.504 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCCn2ccnc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374063 HVEDYKDWTFTEAG-REWPJTCUSA-N 461.331 0.758 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375367 OMSDMWOKGDCBQN-QAPCUYQASA-N 461.230 0.191 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1807943245 DFICGQKELZXQFN-PVXIVEMSSA-N 489.334 0.558 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@@H](F)Br 1808661335 IOUGJKCBXXPLAK-BHYGNILZSA-N 464.100 0.772 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnc2ncccn12 1809328313 CCVZCMVYCLJNDD-RXVVDRJESA-N 470.298 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1)C(Cl)Cl 1813075711 IKHOMENYJUOFMU-FZMZJTMJSA-N 450.286 0.936 50 20 JCGD Cc1cc2nnc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)c4ccc(B(O)O)cc4)n[nH]3)c(C)n2n1 1817471948 YZCUPXVLNAZVAK-GOSISDBHSA-N 488.317 0.764 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc[n+]([O-])c1)CC2 1819792966 FORJWCQBDRWBKU-LBPRGKRZSA-N 453.484 0.315 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)Cc1cccnc1)CC2 1819797744 ZITYCQUSUGSYJV-BBRMVZONSA-N 480.554 0.332 50 20 JCGD CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)C(=O)N(C)C)[nH]n1)NC(=O)NCc1ccccc1 1820710471 UJHZGTKTSGUYAW-GOSISDBHSA-N 484.561 0.836 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(C)C(=O)C(=O)O)CC2 1825451453 LHGPDIJBVVUSOI-BDAKNGLRSA-N 461.338 0.772 50 20 JCGD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)nn1C 1827056240 BRDSRVYOYIRGNL-FQEVSTJZSA-N 454.336 0.656 50 20 JCGD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn2[nH]cnc(=O)c12 1829598788 AHPJSUVUFAQMKP-LJQANCHMSA-N 485.589 0.937 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829705994 NNBZILGMPMQBFD-YJBOKZPZSA-N 464.426 0.523 50 20 JCGD Cc1ccc(OCCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1830206567 NJZXZZCCIDVYEN-VWLOTQADSA-N 497.552 0.533 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1830543114 KEBFNNHUKDNOBG-ORAYPTAESA-N 470.320 0.911 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1830543939 IVIJASYROJOZPK-DJJJIMSYSA-N 484.326 0.969 50 20 JCGD COc1ccc2c(CC(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)c[nH]c2c1 1830814879 PIPOQZVZXLPDGC-KNQAVFIVSA-N 465.934 0.775 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1 1831875179 VAVOFCUYIKWHLN-HNNXBMFYSA-N 463.501 0.658 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnc[nH]3)C2)C1 1832549276 LBEHFVWBCMFFCA-JTSKRJEESA-N 499.996 0.931 50 20 JCGD O=C(C1CCN(Cc2ccccn2)CC1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833108895 PTHMWDSEDYLFKV-NFBKMPQASA-N 480.993 0.350 50 20 JCGD O=C(/C=C/c1ccsc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833138657 INEWCMCVJKJUPM-ZDUIWUOISA-N 456.329 0.211 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)ccnc1Cl)CCO2 1833252081 OOOIUWSPROKRJC-NRFANRHFSA-N 492.895 0.256 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)CC2)CC1)[C@H](O)CCl 1833310100 IAGRMTYLLWPMMB-LJQANCHMSA-N 463.966 0.840 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(C(F)F)c1)CCO2 1833324010 JTIOISYJJBMPEC-NRFANRHFSA-N 469.489 0.462 50 20 JCGD CCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1833419300 COSWVUNBNNSHNK-CNWVNXMSSA-N 487.605 0.607 50 20 JCGD O=C(CCBr)NC1CCN(C2CCN(C(=O)CS(=O)(=O)N3CCCC3)CC2)CC1 1834421868 POAJJXRJMZUAHG-UHFFFAOYSA-N 493.468 0.769 50 20 JCGD O=C(O)c1cnncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834823446 VNZFHEDFAGWSPF-QGZVFWFLSA-N 457.281 0.030 50 20 JCGD Cc1cnoc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737865 JKUQKAVJSHJYHU-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(F)c1 1835931844 DPQAZSQANVIMGU-KPPJJKTOSA-N 498.316 0.298 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3c3ccc(F)cc3)C2)C1 1835934031 KQMPTPPYVATWJN-OTNCWRBYSA-N 482.317 0.379 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4cccs4)on3)C2)C1 1835938449 VVJDHRMFVYXQES-QHCPKHFHSA-N 497.338 0.467 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1 1836339385 YIONIZLAHQQPGB-QGZVFWFLSA-N 471.986 0.998 50 20 JCGD O=C(c1nc[nH]n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1836354148 ZHHZVGZYNWZVQK-JXFKEZNVSA-N 478.347 0.881 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(F)c1 1836689735 PGZSPQOSJFLMGZ-RXVVDRJESA-N 458.914 0.823 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c2cc(O)ccc2n1 1836821456 DGDGHUVMUDDAOG-KNQAVFIVSA-N 463.918 0.919 50 20 JCGD Cc1oncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837508872 SGEBIDLABZTNLO-UHFFFAOYSA-N 456.503 0.908 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1837836220 LDJBQZNVGGYVTE-LBPRGKRZSA-N 470.301 0.493 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cnn4c3CCC4)CC2)CC1 1837921331 AGFSYUPNDLJWTM-UHFFFAOYSA-N 466.347 0.435 50 20 JCGD O=C(CCc1ncc[nH]1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922206 XVMPDHJCEWUWQY-UHFFFAOYSA-N 454.336 0.335 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1C 1838943163 SBGULGYUTZGZGF-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198376 CVRRZIPIXDICJO-YOEHRIQHSA-N 453.305 0.865 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1 1839203638 QOQMDVVALDGPCP-YVEFUNNKSA-N 453.305 0.723 50 20 JCGD O=C(c1ccc2nn[nH]c2c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839629874 SEVKUZUQOXHSJZ-YOEHRIQHSA-N 456.272 0.718 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cnnn3)C2)C1 1839743279 HNCXLGAGWWRRCT-QLKYELJLSA-N 473.440 0.015 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1)n1cnnn1 1839743807 WTXRJYSHAXKVET-SJBPYACQSA-N 487.467 0.576 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1840033855 SMQIJGVIRGXMQX-FKIZINRSSA-N 480.315 0.675 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4cnnc4)cc3)C2)C1 1840151891 QKIQVCCJVXMJAC-GHTZIAJQSA-N 463.922 0.591 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccccc3N)C2)C1 1840183835 CMGOOKROJHMENY-WCYCAPIHSA-N 459.547 0.111 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnccn3)CCO2)C1 1840455803 UFQBGEMJLSRCRJ-KXBFYZLASA-N 455.353 0.897 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc(F)c1F 1840704774 OWJUKNKMNKKWAL-HSZRJFAPSA-N 489.479 0.656 50 20 JCGD CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840914122 BGAMYBTUEZSZDD-DOWNOZBLSA-N 492.013 0.982 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)[C@@H](O)N2CCOCC2)C1 1844297654 ZYRIEEYMHWOFAD-PKOBYXMFSA-N 466.376 0.847 50 20 JCGD O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)[C@@H]2[C@@H](O)CCN2C(=O)OCc2ccccc2)C1 1846234466 VKOMIBXRNSKVBH-KSZLIROESA-N 465.934 0.562 50 20 JCGD COc1cc(N2CCC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)CCC(=O)NN(C)C)CC2)ncn1 1847667918 HZVHCTBEYGCFAE-ROUUACIJSA-N 473.578 0.276 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccs1)c(=O)n2Cc1ccccc1 14046751 XOKLEPVIXCSPJJ-UHFFFAOYSA-N 452.496 0.951 50 20 JCGD CCS(=O)(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)CC1 104995164 ZWTLPLSCSVDTNO-UHFFFAOYSA-N 457.505 0.070 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cn1C 109999201 CMKPRIREPQKSRC-UHFFFAOYSA-N 472.527 0.831 50 20 JCGD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CNC(=O)c2cccs2)c1 725740812 ICOOWMQIYSXVPV-UHFFFAOYSA-N 454.530 0.172 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(N4CCCS4(=O)=O)cc3)cc2)CC1 728213743 OYTSNRKWZVUWPK-UHFFFAOYSA-N 493.611 0.920 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)c1cccc(OC(F)F)c1 728750950 BKFRUEDSTACNSM-UHFFFAOYSA-N 463.445 0.761 50 20 JCGD CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1F 728845196 DMKQUONJANZHTC-UHFFFAOYSA-N 450.496 0.544 50 20 JCGD Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728847370 BYOHOBXEKNQCGR-UHFFFAOYSA-N 475.575 0.667 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1csc(N2CCOCC2)n1 730514547 JYRWSZVVELEZJR-QGZVFWFLSA-N 493.611 0.983 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(S(N)(=O)=O)c(C)c1 730893985 AYPMQSYYYJJVPE-UHFFFAOYSA-N 455.876 0.922 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1 744446930 PHIWIWKOKCKUOF-GOSISDBHSA-N 462.503 0.613 50 20 JCGD CS(=O)(=O)N1CCc2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc21 804541072 MRAZQJBUZKHYCQ-SFHVURJKSA-N 475.479 0.153 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1 912860961 QBDBCGLCGMCIPU-CYBMUJFWSA-N 467.475 0.896 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1 914279651 BWPUKIZCVMNPMU-UHFFFAOYSA-N 487.542 0.135 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCNS(C)(=O)=O)c1 916142159 JBTXDORARYVJFZ-UHFFFAOYSA-N 470.529 0.196 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCc3nnc4n3CCCCC4)nc2)CC1 916235274 JCEPEAANGHMVED-UHFFFAOYSA-N 477.595 0.204 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O)c1ccc2c(c1)OCCO2 918555541 QAEOKZQLAIXOLU-HNNXBMFYSA-N 487.490 0.856 50 20 JCGD O=C(COC(=O)COc1ccc2c(c1)CCC(=O)N2)NNC(=O)[C@H]1COc2ccccc2O1 928984963 WBDHFOMSEXVOPF-GOSISDBHSA-N 455.423 0.481 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(C)c1)C2 1778091582 WEXZAGJAOVUEHD-GULKHOJOSA-N 455.519 0.682 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c2ccccc21 1781329618 IBRMTSATLBJWCH-QFBILLFUSA-N 469.311 0.860 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)CC1 1781330636 ZVILOLVBIMRJIP-CJNGLKHVSA-N 470.361 0.178 50 20 JCGD O=C(COc1ccccc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781905413 HPUVAYCNUXLUEV-ZJSXRUAMSA-N 470.306 0.712 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4ccc(O)nn4)cc3)C2)C1 1782116543 ZFMZNFGXEMZJCJ-RUZDIDTESA-N 488.309 0.286 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCCN3C(=O)OC(C)(C)C)C2)C1 1783573802 VJKBQDJWLCWCLI-KOSHJBKYSA-N 495.621 0.979 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)CCO2 1783881573 SAQOURXOLCYMDV-OSAWLIQMSA-N 475.970 0.298 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#Cc3ccc(Cl)cc3)[C@H]2C1 1783919416 FRKBYEHVOXLKIM-NDXORKPFSA-N 481.940 0.984 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1ccc(Br)cn1)CCO2 1783935599 AHQXXFFHRZOCQF-HXUWFJFHSA-N 482.379 0.590 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1csc(C(F)(F)F)n1)CCO2 1783936014 ZVDWTVBZZIOWPW-KRWDZBQOSA-N 463.482 0.978 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)C3CCC(O)CC3)C2)C1)NC(=O)NCc1ccccc1 1784139137 YDSRHBZTNHICAN-BAWHURIHSA-N 487.601 0.714 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCNC(=O)C3)C[C@@H]21 1785079472 NOCPJXDYUFNRPN-WOYTXXSLSA-N 486.997 0.624 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ncn(-c2cccc(F)c2)n1 1785543678 FROKUZGBSYZIOO-SJWGOKEGSA-N 451.886 0.599 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)nc2ccc(Cl)cn12 1786983810 SYXDXQRPFZFGAP-VDGAXYAQSA-N 496.760 0.883 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS(=O)(=O)N3CCCC3)[C@H]2C1 1787505569 HHBGGKDCMLOAAP-VGWMRTNUSA-N 480.425 0.565 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791292961 DGVVDWOWGRZVRA-QZWWFDLISA-N 469.583 0.252 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1ccnn1 1793879248 SFNSKKLTPSHKDM-RBGFHDKUSA-N 470.958 0.561 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)cn1 1794905504 OEZMYQDMSGSPRR-HBCWATKFSA-N 457.443 0.771 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccc(F)cc1)C2)c1cccc(B(O)O)c1 1795737740 OSGRQPONQIKZDI-FAQVEIGNSA-N 456.279 0.178 50 20 JCGD O=C1CN(c2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)n2)CCCN1 1796362013 VPDWWJQUOVUEKI-GGNLRSJOSA-N 453.902 0.146 50 20 JCGD Cc1cc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)ccn1 1797748441 AWLYNOXJTKBQTF-UPHUGPLXSA-N 452.515 0.225 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1coc(Cl)n1)C2)NC(=O)NCc1ccccc1 1799094951 LXYAXCMFHSHMQL-HGKCTWBKSA-N 490.948 0.877 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1800642510 MIWISTYFGCVODT-FQLMCAECSA-N 485.404 0.655 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c[nH]c1C 1801010660 OPDVYZKARUVHOL-FEJSZKPUSA-N 491.589 0.395 50 20 JCGD COc1ccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)no2)cc1 1801011083 ACMVSILBDDZKSH-GPVSGQMNSA-N 485.541 0.926 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1F 1801503181 RIMWNBFPAUNGEW-MFKICJERSA-N 450.511 0.339 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807367895 OLBAUEMEPSZHBA-KNQAVFIVSA-N 496.373 0.996 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cncc(O)c2)[C@@H]1c1cccnc1 1810305307 JZAUESPWPJNFHR-MGPUTAFESA-N 461.482 0.814 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1810539855 GGTVPQBYCQVKAQ-YJBOKZPZSA-N 458.528 0.664 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1 1814649197 VMSZXZCTAABLMG-CQSZACIVSA-N 452.581 0.150 50 20 JCGD COc1nccnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1816156959 CPYPSRSKLIHHHN-MRXNPFEDSA-N 450.264 0.508 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470780 GWDZPPGWDNNTCF-KRWDZBQOSA-N 452.280 0.451 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])[nH]n1)c1cccc(B(O)O)c1 1817476621 NBYAUDMXCMGBKV-AWEZNQCLSA-N 453.224 0.341 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1 1819403731 CCNRIPJQTMYKHV-SFHVURJKSA-N 488.512 1.000 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)C1 1819793068 JPDVSFSAKLDLPG-YNEHKIRRSA-N 486.554 0.957 50 20 JCGD CC[S@@](=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797916 ONBYGVBXWQSYKY-AJHPHWTPSA-N 464.573 0.526 50 20 JCGD NC(=O)c1ccccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1821159778 XVJUCIAGRMVJSC-IBGZPJMESA-N 461.287 0.808 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3cccnc13)CC2 1826086460 WBBUORTVBFAJCI-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)no1 1827051768 DLEAITYQHNRVGC-NRFANRHFSA-N 482.346 0.326 50 20 JCGD CNC(=S)NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052108 OWLBSTYQDYPVAQ-LJQANCHMSA-N 460.409 0.084 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)c2cccnc2)CC1 1828923333 DYUJPIIQWSOAOW-NRFANRHFSA-N 493.568 0.743 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828925678 OTRRJKLOHOSLDR-LJQANCHMSA-N 473.578 0.291 50 20 JCGD O=C(COCCO)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829224044 YXWZXEYVLZAFAB-PGRDOPGGSA-N 483.949 0.047 50 20 JCGD O=C(c1cc(=O)c2ccccc2o1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830719279 BPCFGBSXDXJVIQ-HRAATJIYSA-N 450.875 0.463 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)n(-c2ccccc2)n1 1830727949 LGVMJIHEEJBXFX-UGKGYDQZSA-N 462.934 0.850 50 20 JCGD O=C(c1cc(C(F)(F)F)ccn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732818 WAHDXJAHJSFGDC-YOEHRIQHSA-N 451.829 0.770 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1 1833272123 GUPKQUCCIOTKJQ-JKSUJKDBSA-N 464.966 0.978 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3csc(N)n3)CC2)CC1 1834751252 QFTZXWBCBPDPJF-UHFFFAOYSA-N 472.575 0.223 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3c(C)noc3N)CC2)CC1 1835118229 JAECVBLSAMNXJT-JFLMPSFJSA-N 484.561 0.884 50 20 JCGD Cc1ccc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3cccc(B(O)O)c3)CCO4)ccc2n1 1835937109 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CNC(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839742385 WITSVXZTHXNHFJ-AGBQBWRISA-N 462.453 0.464 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1840032574 CMGVXYXKPFVYJG-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1840035412 QJCFUJMVQCTBHI-BBATYDOGSA-N 459.293 0.657 50 20 JCGD Cc1cccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)n1 1840182507 KFDLBQICZIZDBS-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(F)c(F)c3)C2)C1 1840183019 ZILNRPRAIGXWLS-QZTZHPFYSA-N 494.539 0.898 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840187597 MLZHDNNVPJKEJK-VBKZILBWSA-N 496.388 0.882 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840867557 XJYUJNSBAJWGLI-IERDGZPVSA-N 475.970 0.300 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)O2)C1 1843012927 UHLAXKLVYSIPSE-IBGZPJMESA-N 499.373 0.352 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccc(O)cn1)C2)NC(=O)NCc1ccccc1 1845038612 ZATVWIVFQQHACF-UHFFFAOYSA-N 452.515 0.950 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2 1846385910 JXLMYBSIMKBUQB-LBPRGKRZSA-N 456.469 0.720 50 20 JCGD Cc1ncc(Br)cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1848323736 MXVNISAZWXYDSB-ROUUACIJSA-N 458.121 0.962 50 20 JCGD CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1 10259431 GMSCTFPCCUKGDR-UHFFFAOYSA-N 468.561 0.374 50 20 JCGD N#Cc1ccccc1OCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 15978681 PQSIICIOQLMIEX-UHFFFAOYSA-N 472.523 0.738 50 20 JCGD Cn1c(=O)c2c(ncn2CCC(=O)NNC(=O)COc2ccccc2-c2ccccc2)n(C)c1=O 16232868 URXBDITXNIACDZ-UHFFFAOYSA-N 476.493 0.717 50 20 JCGD CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12 105565235 NFSGTFMPTAKTMX-OAHLLOKOSA-N 469.589 0.799 50 20 JCGD CN(C)N(C(=O)CNS(=O)(=O)c1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1 728178760 DNXUBOVWUAIXMP-LBPRGKRZSA-N 454.368 0.220 50 20 JCGD O=C(COC(=O)COc1cccc(NC(=O)C2CC2)c1)NNC(=O)[C@H]1COc2ccccc2O1 728323033 RMEPKEJRQFHAPM-LJQANCHMSA-N 469.450 0.945 50 20 JCGD CC[C@H](NC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(S(N)(=O)=O)c1 729229476 CVFMITCHYFHSFI-KRWDZBQOSA-N 461.548 0.822 50 20 JCGD O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 730515159 QEIWQDJXXZQNSH-UHFFFAOYSA-N 455.438 0.780 50 20 JCGD NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)CNC(=O)c3cccs3)c2)C1 731043270 DRLRVORDAFWXCE-QGZVFWFLSA-N 472.571 0.706 50 20 JCGD Cn1nc(C(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c2ccccc2c1=O 731050038 BSHNJONWGPAQHC-UHFFFAOYSA-N 458.818 0.686 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(CS(N)(=O)=O)c2)cc1OC 748970622 UHKGYWHZZKAKMW-UHFFFAOYSA-N 451.457 0.110 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1ccc(-n2cnnn2)cc1 751293598 BFEWJEYUGYOGLV-INIZCTEOSA-N 459.470 0.852 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)[C@H](C)O)cc1C 777289189 CGOGOSACUKTXIF-LIRRHRJNSA-N 497.957 0.989 50 20 JCGD CCn1c(CCC(=O)NNC(=O)CN2CCCC2=O)nc2cc(S(=O)(=O)N(C)C)ccc21 789856361 FYHDGXSKRPLZTB-UHFFFAOYSA-N 464.548 0.009 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(S(=O)(=O)N[C@@H](C)CO)cc1 915477106 BIEBKNCEPQRWIB-LBPRGKRZSA-N 499.929 0.626 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1 916517050 XAJOIOJHZCNZBS-UHFFFAOYSA-N 476.559 0.251 50 20 JCGD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)c1 916830530 FBNYZFRGYPHYKT-UHFFFAOYSA-N 468.919 0.973 50 20 JCGD COc1ccc2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)ccc2c1 1777894850 RSYWQLXFDPALSI-VWLOTQADSA-N 490.520 0.999 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCC(=O)NC1)C2 1778091351 BMHPIGCMHKIQBW-ZVJVYNAXSA-N 472.546 0.161 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c(C3CC3)c1F)CCO2 1779028190 GTRCSDUUBRUHHT-OAQYLSRUSA-N 457.466 0.182 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)C1 1779029733 XQUREFFIPIXVGK-XMMPIXPASA-N 477.477 0.549 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1F)C2 1779373492 WADYYKJWUXOEPP-XMSQKQJNSA-N 456.478 0.661 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)Cn3ccncc3=O)CCO2)C1 1780098849 WZFZGWNIIIYFEI-QFIPXVFZSA-N 485.453 0.221 50 20 JCGD O=C(CN1C(=O)C2(CCOCC2)c2ccccc21)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1780932977 PJCPKZQFQXAWIE-XXBNENTESA-N 491.972 0.511 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)cc3O)C2)C1 1781524830 MRRVHRODIIXUPB-OAQYLSRUSA-N 489.131 0.592 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1781901120 HTHDWAOXWOMABM-JXXFODFXSA-N 482.379 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1782212000 NJVLIKRVLILBJG-CJFMBICVSA-N 498.584 0.666 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1783351788 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482.541 0.315 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cncc(C(F)(F)F)c1 1789017143 YQTPJSSHVHWOBR-JVPBZIDWSA-N 477.248 0.687 50 20 JCGD Cn1c(=O)c2c(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](F)Cl)C[C@@H]43)csc2n(C)c1=O 1789703121 UFIBDGCXVBQWLQ-RKOGSIPDSA-N 486.953 0.355 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(O)cc1 1789884890 ODXLMYUDKIVSCU-VPPRVIDZSA-N 452.316 0.469 50 20 JCGD COc1ccc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1790137442 PPQKFKILMWRXQR-HSQYWUDLSA-N 452.316 0.591 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C[C@@H]21 1791293730 FVJAOJNCPGKTHV-OWQGQXMQSA-N 465.482 0.700 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)ccc12 1792977520 WORLLJJZDMPYRO-YALNPMBYSA-N 464.906 0.314 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)=NO2)C1 1793116200 IBYLURTUORUFKD-HLPPOEQASA-N 470.954 0.990 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095001 PHHKFXZCXYRITD-AMUINCDKSA-N 474.606 0.296 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])cc1F 1799490805 PXTNQOCLDRDHSD-KSPBDQMDSA-N 472.433 0.249 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(C(F)(F)F)n1)C2 1801011868 NAAQFHRJMJVGAK-QHBPRCKVSA-N 463.482 0.738 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)C2 1801436496 NWZKSFQKUZTIBP-WMTCKVMYSA-N 480.435 0.950 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2 1802339661 GESBOOBQSCTRBS-BMCPXHGSSA-N 481.594 0.370 50 20 JCGD N=C(N)SCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1807004430 VMFVVNPJVRIZLF-GUYCJALGSA-N 456.532 0.026 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)n1ccccc1=O 1807362152 URUGQGOODIPWAC-LLBVYWAGSA-N 474.326 0.504 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375459 OYBHYULFFIQCLG-YLJYHZDGSA-N 474.282 0.519 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)c2ccccn2)[C@H]1c1cccnc1 1813070853 LQLBPYAZBNJKSA-HSQYWUDLSA-N 453.547 0.555 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@@H]1c1cccnc1 1813075219 XZKDNBXVLJBECK-VGOFRKELSA-N 455.519 0.329 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339560 HBIAAPXZLOPVJT-CJNGLKHVSA-N 465.344 0.944 50 20 JCGD O=C(C#CC1(O)CCCCC1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344033 CVIHDERFCAOHJT-QGZVFWFLSA-N 467.356 0.747 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(-n3cccn3)nc1)CC2)c1ccc(B(O)O)cc1 1815344038 CXLWRGKCXNMZHT-KRWDZBQOSA-N 488.338 0.943 50 20 JCGD Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)ncc1[N+](=O)[O-] 1815354448 BTIMDWLUBSDGGG-CQSZACIVSA-N 481.299 0.974 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1Cc3ccccc3CN1)CC2)c1cccc(B(O)O)c1 1815354481 DZCAWXCXAUDRIJ-AZUAARDMSA-N 476.367 0.763 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cncn3)sc2C1)NC(=O)NCc1ccccc1 1815669109 MNGMJAFVLDAIEY-MRXNPFEDSA-N 497.585 0.693 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)c4cccc(B(O)O)c4)n[nH]3)nc2N1 1817474468 GTVRZJVFMKRGKQ-IBGZPJMESA-N 488.313 0.989 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3n(n2)CCCNC3=O)n[nH]1 1818977070 LDBILMPTALPTGA-MRXNPFEDSA-N 485.549 0.419 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1823748241 RCYLBXXKOAOWLP-PXDRNWIDSA-N 468.558 0.777 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCCS3(=O)=O)sc2C1 1824938751 GWMYLZLDDYHZEB-SMDDNHRTSA-N 457.578 0.005 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCNC(=O)C3)sc2C1 1826218646 DAYHIRLDUUGXMG-FIMJWLBGSA-N 471.543 0.715 50 20 JCGD CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1828888920 UBMYKVRDXUUSTN-XMMPIXPASA-N 465.315 0.452 50 20 JCGD CC(C)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](N)CN)CCN2C(=O)OCc2ccccc2)C1 1829044627 ONGBPKBQQANWAK-FDDCHVKYSA-N 480.009 0.990 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1830543635 WYZXYJUHQXUTTG-VLIAUNLRSA-N 494.346 0.191 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831871445 SHOVMNKZPKFJBW-WMZOPIPTSA-N 458.625 0.660 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc1C 1834797385 HSVQSBQVYODHSQ-UHFFFAOYSA-N 464.375 0.877 50 20 JCGD C[C@H](Nc1nccs1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800046 NRBJLCSGAVPCDA-INIZCTEOSA-N 485.419 0.509 50 20 JCGD Cc1cc(F)ccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835941843 RRKIEPGPJYPRKR-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD Cc1ccc(O)c(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1836248719 KLTRGNOVLMPYOI-UHFFFAOYSA-N 465.359 0.879 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836474101 SMWFTVBCKKVOSN-LXIYXOSZSA-N 498.346 0.019 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cccnc3[nH]1)CCO2 1837012531 XPRJSPHJQLHRBR-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD CSCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456316 KWJDHWZFMGZZNG-NRFANRHFSA-N 465.576 0.144 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCCC4)CC2)CC1 1837920099 AFPRHRUSOTVVIN-UHFFFAOYSA-N 480.374 0.825 50 20 JCGD O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838458079 NVJCWNVCIJATDX-MBSDFSHPSA-N 475.929 0.313 50 20 JCGD CO/C=C(\C)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054171 JMMYHJYHVWTSKA-SIAYCOCNSA-N 489.573 0.339 50 20 JCGD COc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1F 1839198359 YPZDNMYAQZRHHZ-GUYCJALGSA-N 464.263 0.990 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839744006 KBDCJZOOYCEXMN-WCPBPTQFSA-N 491.495 0.775 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)C2)C1 1840150132 GCUFVEIQFWLSAE-QVKFZJNVSA-N 477.986 1.000 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1 1840154656 BWCGJMKSLOCRGU-KPLVRAHFSA-N 464.950 0.463 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1840155880 FWNNIWADZHGPSS-HPRRLGSGSA-N 470.906 0.527 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc(O)cc3Cl)C2)C1 1840184739 CTZFJAFGDKCHOT-ILHLOOHCSA-N 494.976 0.888 50 20 JCGD Cn1c(=O)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nc2ccccc21 1840188625 UKGLTTCVQSHUOW-FQEVSTJZSA-N 469.325 0.807 50 20 JCGD O=C([C@@H]1CCCN1Cc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840313222 YOZBEPUOAUWVCI-SXWKCWPCSA-N 465.978 0.707 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841621898 SVRGSFCZKDIOOI-UHFFFAOYSA-N 458.563 0.451 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1841921534 YUFWIPVNUQQPFX-MJGOQNOKSA-N 469.347 0.653 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCn1c(=O)oc3ccccc31)C2 1844263500 LBSVWUZUKOJVFT-UHFFFAOYSA-N 464.482 0.500 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)C(=O)NC(C)C)c(Br)cc1Cl 728261906 YRSYXWVGOUOOSM-UHFFFAOYSA-N 456.702 0.723 50 20 JCGD C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728845471 IRURDNYOBJVCKC-DEOSSOPVSA-N 477.525 0.839 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Cn1cnc2scc(-c3cccs3)c2c1=O 729274887 GQCHDYBQNVABJF-VIFPVBQESA-N 455.543 0.272 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC3CC3)cc2)n1 762232607 RKLRLVOPXFRDAA-UHFFFAOYSA-N 452.514 0.439 50 20 JCGD CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 834791277 FQBRZEQNJYMXDL-LIRRHRJNSA-N 491.522 0.908 50 20 JCGD CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)S(=O)(=O)c1ccccc1 914780562 RAPVRWIQMIVYOY-UHFFFAOYSA-N 494.595 0.943 50 20 JCGD O=C(NNC(=O)c1ccn(-c2ccccc2)n1)c1cccc(S(=O)(=O)N2CCOCC2)c1 915063278 XEOOLBIGHQAJGX-UHFFFAOYSA-N 455.496 0.968 50 20 JCGD COc1cccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)c1O 919755562 CFZLYJYHNMEOLV-CYBMUJFWSA-N 452.489 0.868 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2cc(Br)c3c(c2)OCCCO3)c(=O)n(C)c1=O 921259092 WEBNNJADZNEBGQ-UHFFFAOYSA-N 484.332 0.645 50 20 JCGD Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nc2ccccc12 1777876428 IAPIVRBWQSTADA-VWLOTQADSA-N 459.311 0.980 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1 1778245214 JSASPKRIBWNGPP-CVDCTZTESA-N 451.483 0.132 50 20 JCGD Cc1ccncc1CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028210 HHCATYUYRASGKZ-HSZRJFAPSA-N 452.515 0.465 50 20 JCGD Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)n[nH]1 1780266405 VTRLUSHWPVQAQL-QHCPKHFHSA-N 469.546 0.508 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1 1781837912 LKTMADPJXKTDMU-QQNPRBCQSA-N 490.524 0.845 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3nccc3c1)C2 1782214064 AEVYGQVZKWCVMY-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD O=C(CN1C(=O)CNC1=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783019324 VXTOQGDNCJUCLZ-IIBYNOLFSA-N 493.358 0.374 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1783255104 SZLRBIDAPUTJGX-CTWQGKMFSA-N 451.951 0.919 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)N3CCN(C)CC3)C[C@@H]21 1783971519 BBZDYVWJASEGPA-ZBRFXRBCSA-N 459.429 0.633 50 20 JCGD Cc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)[nH]1 1784717006 BLZZBEWLYUQQFZ-ZJOUEHCJSA-N 483.573 0.658 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(-n2nccn2)c1 1786980886 CNTLMOZTFHOMDJ-HARLFGEKSA-N 489.341 0.163 50 20 JCGD Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(C(F)(F)F)c1 1786983391 QVJLIEYSJICKLC-QOKNQOGYSA-N 479.264 0.631 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cc(Cl)ccc4n3)[C@H]2C1 1787860893 VVTZKQIFZCPEFJ-ZVZYQTTQSA-N 476.965 0.954 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)[C@H]1SC(=N)NC1=O 1788762525 DMFFTYHZJUSMBW-SMSYFYOWSA-N 456.641 0.620 50 20 JCGD Cc1cc(F)c(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1790276458 ILQBLLSCVATMHH-QSFXBCCZSA-N 458.270 0.860 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)Nc2ccc(C3(NC(=O)[C@H](O)CCl)CCC3)cc2)N1 1791142669 ICKMFZQXBQJICK-GVDBMIGSSA-N 495.001 0.900 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccn1)C2 1793881212 VOQOOVXJTLPZCU-IVSAIRAKSA-N 455.943 0.605 50 20 JCGD CC#C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)c1ccc(O)cc1 1795736926 RCSLNAUZHZBCBZ-NAZDKBRTSA-N 476.338 0.472 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nn1-c1cccc(=O)n1C 1795934721 ZOERKIREHUCDDN-QOIOWGMHSA-N 477.949 0.336 50 20 JCGD CCc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1 1796440566 RLRYLHWVYQPYDD-KEMUROEHSA-N 452.515 0.981 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2[nH]ncc2c1 1797346038 SFCCCNNGPTUMNO-AJIUELFLSA-N 464.486 0.295 50 20 JCGD Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(C(F)(F)F)c1 1797750612 MIWQKQGSTFOVOI-DPIQGUFMSA-N 480.447 0.559 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1ccc(O)nn1 1801235181 UNZGCDQWHOKOBX-XTUBRDOVSA-N 453.503 0.887 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(C)c1 1801909142 BSSQADWPHXJUAZ-CWPLJXCYSA-N 481.509 0.297 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1COc2ccccc2O1 1804198968 YSPBVDJZHCGVEJ-WDJPJFJCSA-N 487.321 0.921 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1806039129 OXJMBSKMNMWIJG-UWJYYQICSA-N 461.287 0.193 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1806043046 IVMJBXATVCPEEA-MGPUTAFESA-N 476.497 0.512 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1 1806342234 LINRCELFQJQHGP-CXAGYDPISA-N 452.309 0.424 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1808714884 IUYFZRYRCRULIV-AZUAARDMSA-N 462.319 0.567 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc2n(n1)CCCNC2=O 1809676653 FUDHOQGUTOZODF-QGTPRVQTSA-N 460.922 0.331 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)CC2)C1 1809980695 PDTADEWEBTYJDU-FPOVZHCZSA-N 467.375 0.612 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1 1810101192 YCIONPIYHSNCFX-KYEXWDHISA-N 461.288 0.842 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1 1810301683 BYOYWSGJWNQTCD-HRAATJIYSA-N 465.514 0.022 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)/C=C/c2cnc[nH]2)[C@@H]1c1cccnc1 1810305593 MDMKEDJNPZUZQU-LMAONABESA-N 460.498 0.836 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc2cccnn2n1 1811268209 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NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551141 KENZYLCTDZOPJR-JTSKRJEESA-N 480.949 0.304 50 20 JCGD O=C(/C=C\C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)NC1CC1 1828789923 KCSSCZUKMQSZQH-KUFMOJEASA-N 453.348 0.435 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829026450 USWMBBMYFVWDBD-HTAPYJJXSA-N 493.373 0.208 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)COCCO)C2)C1 1829341117 XHQMGBQZRNGWLL-WMZHIEFXSA-N 497.976 0.701 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(OC)cc3)CCO2)C1 1830242872 VNRJLHOTSRTDRU-RXVVDRJESA-N 456.923 0.784 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c12 1830734965 BNXZSMYMXQDIFL-HRAATJIYSA-N 451.907 0.846 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c([N+](=O)[O-])c1 1830736228 SAPUYZBVQAOEDF-JXFKEZNVSA-N 485.877 0.051 50 20 JCGD CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830737661 HTOGLRGGLMNXQX-HYFFOGBASA-N 492.013 0.982 50 20 JCGD CC(F)(F)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831678898 GBNIPOHDIDYWGE-NRFANRHFSA-N 454.279 0.118 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CC[C@H](N)C(N)=O)CC2)CC1 1833263157 DHBWFWSFXQVGFR-CJNGLKHVSA-N 460.417 0.182 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1833713793 CKRAWVKYFWCWHB-GOSISDBHSA-N 463.044 0.306 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1833761683 FRKYURVFDDSIMS-SWLSCSKDSA-N 472.384 0.187 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C)no1)CCO2 1834223826 CHRGCTWRDGLRGF-VQYZLWMVSA-N 458.475 0.187 50 20 JCGD CO[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccc1 1834579007 GGJWSBXHFCTINB-DEOSSOPVSA-N 479.386 0.939 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797800 HSPWTKUFTGUXHA-JOCHJYFZSA-N 456.396 0.036 50 20 JCGD N[C@@H](CC(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)c1cccnc1 1834822481 PZAMNFUUCJDXKI-QFBILLFUSA-N 455.353 0.713 50 20 JCGD CN1CCN(C2(C(=O)N3CCOC[C@@]4(CN(C(=O)CCBr)CCO4)C3)CC2)CC1 1834824183 VIHDIRANKZASJY-LJQANCHMSA-N 473.412 0.008 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)ccc1F 1835931901 GDWTYVCWXKXQDE-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD Cc1cc(Cl)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835934447 SQVRJZMDQPZCOC-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD O=C(CCc1cccs1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935191 GBAFOXZLCVVYPF-JOCHJYFZSA-N 458.345 0.131 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835939980 RMNVWFCFFOLANC-RUZDIDTESA-N 466.343 0.296 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)no1 1835982703 PZENQCBGZBSJPQ-UHFFFAOYSA-N 454.336 0.416 50 20 JCGD O=C1NCc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Br)C4)C3)ccc21 1837152529 RSOLGEKRLHJFGE-DNVCBOLYSA-N 470.295 0.691 50 20 JCGD C[C@@H](Sc1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837230713 BBFWIGCAFJNQNH-ZHRRBRCNSA-N 490.412 0.679 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)NCc1ccco1 1837637203 WHQGTNXEUQDBGO-HYIIBOEBSA-N 488.310 0.599 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cncc(C(F)(F)F)c1)CCO2 1838181077 MTUIIVBVHGRQBL-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838418600 GEQKODBYRBTYDT-YJYMSZOUSA-N 454.936 0.843 50 20 JCGD C/C=C(\C)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054206 LQMDOSCIXLCWPU-QFUHNLMYSA-N 473.574 0.755 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)C1 1839109522 JXCKHYNTYUGXQH-CKNLXJGOSA-N 496.388 0.474 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3nccn13)CCO2 1839551598 CGQLKAXAJWVMEM-VNSNFZHPSA-N 493.524 0.538 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(Br)cnn3C)C2)C1 1840152943 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482.965 0.792 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)CCO2 1840945694 BAFPZNHHMJXNOE-YWZLYKJASA-N 493.960 0.656 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843011644 ZUPXRTQEHNLDFK-HSZRJFAPSA-N 475.326 0.533 50 20 JCGD CC(C)C(=O)Nc1nc(O)c2ncn(CC(=O)N3CC4(CCCN4C(=O)[C@@H](F)Cl)C3)c2n1 1843365982 VBVGWSXYRQBMAO-CYBMUJFWSA-N 467.889 0.864 50 20 JCGD COC1(CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CN(C(=O)OC(C)(C)C)C1 1843847091 YHGSGXIHTWPBME-UHFFFAOYSA-N 487.362 0.209 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(N3CCCOC3=O)cc2)C1 1845532675 ZOKCBHIXRLCGAQ-UHFFFAOYSA-N 463.299 0.844 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c([N+](=O)[O-])c1 1845536484 STGVIYKRGJOFGO-UHFFFAOYSA-N 482.453 0.511 50 20 JCGD O=C(COC(=O)c1cccc(N2CCCS2(=O)=O)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1 12887218 ONDRNGXUNRYHGH-UHFFFAOYSA-N 462.440 0.753 50 20 JCGD 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CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(S(=O)(=O)NCCOC)cc1 811274497 LIRJXVLNXSZKJK-UHFFFAOYSA-N 459.528 0.985 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(S(=O)(=O)N[C@H](C)CO)cc1 915477105 BIEBKNCEPQRWIB-GFCCVEGCSA-N 499.929 0.626 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CNC(=O)c2ccc(Br)o2)ccc1Cl 915789123 OAPDJWIWENBSSW-UHFFFAOYSA-N 479.696 0.534 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)cc2S1(=O)=O 916742334 FJXCXVDVHMDKJQ-LBPRGKRZSA-N 465.459 0.845 50 20 JCGD CCCn1c(CCC(=O)NNC(=O)NC)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 919877616 BQKVZSJKPHVYDT-UHFFFAOYSA-N 452.537 0.360 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1n[nH]c2c1CS(=O)(=O)C2 1777715439 MBCGZELFTADEES-HACGYAERSA-N 493.355 0.656 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)CC2)CC1 1778321100 JYDHGZSLGDAHCD-OFNKIYASSA-N 485.025 0.139 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2 1779031132 LTERSMHMVMDOPS-SFHVURJKSA-N 455.437 0.861 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3O1)CCO2 1779034041 JOOBMVDPFUISFJ-RDPSFJRHSA-N 465.510 0.522 50 20 JCGD COc1cc(C)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779036820 GOSGKSPCKVDWPJ-HSZRJFAPSA-N 453.499 0.759 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1779321165 YQAFJEYZVADADR-XNTKEIKESA-N 476.480 0.853 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1Cc3ccccc3O1)C2 1779372315 DXZGUKXHBILQPS-DNRQZRRGSA-N 479.537 0.816 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334024 UIXABVDXHLCKLY-USBNGQNGSA-N 454.293 0.350 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)cc3O)C2)C1 1781524928 SUMPGUDKLUGALS-OAQYLSRUSA-N 489.131 0.592 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782213977 FGLUXXONXSNQFV-YCRNBWNJSA-N 451.612 0.746 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1782996559 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O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726171 OPBGMPXISCDPHU-NQIIRXRSSA-N 480.905 0.606 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)nc1 1830733457 MWSORQNRPWBRLR-KKSFZXQISA-N 455.939 0.604 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cn1 1833429810 GPSKEAJFOZHBGJ-SFHVURJKSA-N 457.325 0.730 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C3=NN(C)C(=O)CC3)CC2)CC1 1833691000 DOFYQRVXFFYNKL-ZDUSSCGKSA-N 456.385 0.950 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nccc4[nH]ccc34)CC2)CC1)c1cccc(B(O)O)c1 1834800171 WKJOHPFDGIEFBS-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)Cc3ccccc3O)CC2)CC1 1835738137 HMYBLCIGZBJYHM-UHFFFAOYSA-N 480.569 0.819 50 20 JCGD CC1(C)Cc2cccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2O1 1835935523 IWOCCKZNOSVRGO-AREMUKBSSA-N 494.353 0.464 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835941526 NFLHDRCMUMBJMJ-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2 1836626341 JRWWQOGNYHIDTF-NHCUHLMSSA-N 499.490 0.673 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)CC1 1837079874 QKKKOLQNMOIBPD-XMMPIXPASA-N 494.353 0.819 50 20 JCGD C[C@@]1(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC=CCC1 1837460465 GJABFEHIKCMPFH-PKTZIBPZSA-N 457.531 0.502 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccc3F)C2)C1 1837460565 HFMLOMAZPNNQKN-DEOSSOPVSA-N 485.516 0.527 50 20 JCGD COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc1 1837919470 VMVXLXXEASEUTN-UHFFFAOYSA-N 467.331 0.696 50 20 JCGD CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)no1 1838124663 BKGLBCJXARAPEV-VCOZGABYSA-N 472.502 0.441 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)n1ccccc1=O 1838428471 BXVWOZVWECLHNO-GOSISDBHSA-N 475.590 0.781 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cc(F)c1)CCO2 1839003432 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CN(CC(=O)N1CC2(CCCN2C(=O)c2cccn3c(O)nnc23)C1)NC(=O)NCc1ccccc1 1843317177 UYZAOUCUDSGCIA-UHFFFAOYSA-N 492.540 0.598 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)cc2)C(=O)C1 1844960176 ASVNOQWBCMVPQR-UHFFFAOYSA-N 460.299 0.610 50 20 JCGD O=C1NC(=O)[C@@H](CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](Br)Cc2ccccc2)N1 1848131474 AFGDVGWDLRTKSV-WCVJEAGWSA-N 463.332 0.793 50 20 JCGD NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)c2)C1 731043245 DLFXKIOTUFFKBW-KRWDZBQOSA-N 456.503 0.237 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1)C(=O)N1CCCC1 748246664 FRPMCHSUIFFLKV-NSHDSACASA-N 493.405 0.681 50 20 JCGD C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C1=O 748530914 XNILLVJDDURWDN-UHFFFAOYSA-N 473.449 0.672 50 20 JCGD COC(=O)c1csc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 749150649 BTLSCXVKDOYCON-UHFFFAOYSA-N 489.553 0.179 50 20 JCGD CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 749174245 OHTGNUJBTNGXAD-YOEHRIQHSA-N 479.584 0.604 50 20 JCGD CC[C@H](C)C(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 751044326 VGBUQPGDPMQTDP-WMZOPIPTSA-N 480.587 0.753 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)CNC(=O)c3ccco3)C2)s1 751201066 FMLDTMRPPOVCJJ-ZDUSSCGKSA-N 454.530 0.628 50 20 JCGD Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)cc12 857742783 VYHNRFCECSCPAB-UHFFFAOYSA-N 492.521 0.604 50 20 JCGD CCc1cc(C(=O)NNC(=O)C[C@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)n[nH]1 914832739 WOBHCUAMORGBJP-INIZCTEOSA-N 465.532 0.699 50 20 JCGD O=C(CN1CCCS1(=O)=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 916148235 NPLZMAQDSLFUAH-UHFFFAOYSA-N 458.543 0.345 50 20 JCGD CN(C)S(=O)(=O)c1ccc(I)c(C(=O)NNC(=O)c2ccc[nH]2)c1 916160360 FQEYLTXFGAZPHT-UHFFFAOYSA-N 462.269 0.944 50 20 JCGD CCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C 916484124 TYEBREZASNEBPR-VHEJECIDSA-N 450.517 0.978 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 918540569 JWBWQEBJCUHGAI-SFHVURJKSA-N 486.616 0.826 50 20 JCGD CCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 918543741 ONMWPGOGVMRBEW-IBGZPJMESA-N 480.587 0.579 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1)N[C@H]1CCS(=O)(=O)C1 919886273 SCYDKNIFWNXRBU-HNNXBMFYSA-N 470.504 0.758 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1[nH]nc2ncccc12 1777911261 MMYMZUWKIPCDQU-WZONZLPQSA-N 463.303 0.079 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1ON=C(c2ccccc2)O1 1779260067 IZVHMVFTTYKFGV-DCEDVJGZSA-N 493.325 0.229 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1 1779508382 ARNRKRVRDMYZJG-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD CCc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)n(C)n1 1779624726 BJMUWHBXFUIONA-RUZDIDTESA-N 497.600 0.772 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1780097904 RDPXDCUGFBLXEN-HSZRJFAPSA-N 497.464 0.997 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]nnc3n1)C2 1780712804 DTVYLGYJTQRCNB-NXOUGTEYSA-N 472.333 0.176 50 20 JCGD CN1CCN(C2(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@H](F)Br)C3)CC2)CC1 1780773468 DPGFUAHSRSPWOC-JTDSTZFVSA-N 475.403 0.971 50 20 JCGD O=C(Cc1ccc(Br)nc1)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780875188 ZTIYYCCAVHPZAK-OAQYLSRUSA-N 488.147 0.210 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)C2)C1 1781116008 YQNVZUMTDTYMFZ-CMBDLQSPSA-N 475.970 0.298 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3c2NC(=O)C3)C1 1781351798 NRRZLDZAROVXFG-KBMIEXCESA-N 492.536 0.621 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1783349473 MELUWTAHPUNNHR-YJYMSZOUSA-N 468.352 0.634 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CSc3ccccc3[N+](=O)[O-])C2)C1 1783787121 ZBVRXDLNZWTYBR-OAQYLSRUSA-N 479.559 0.890 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1 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0.458 50 20 JCGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)cn2[nH]cnc(=O)c12 1789176687 PKHLVOVFRKSZPW-NHULGOKLSA-N 470.299 0.615 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ncccn3)C[C@@H]21)NC(=O)NCc1ccccc1 1789725145 ZPPIVZPWOCBWFS-ACRUOGEOSA-N 495.584 0.345 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cnccc4n3)C[C@@H]21 1791291302 QXHCPVMPCJQSDJ-ZWOKBUDYSA-N 454.531 0.596 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccccc1OC(F)F 1792031036 ZKIFVYPCOHUWNB-QSFXBCCZSA-N 474.269 0.875 50 20 JCGD COc1ccc2c(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)c[nH]c2c1 1793030580 NWOKMUUEYVKADR-RSQQPWMTSA-N 492.536 0.621 50 20 JCGD Cc1ncc(Br)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1794317989 OHSMFQBUMMZWOF-HBCWATKFSA-N 482.379 0.729 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C)c1)NC(=O)NCc1ccccc1 1794576510 GASPFJWNOWAMEM-VTYHHJSWSA-N 468.558 0.575 50 20 JCGD 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CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)no1 1799097983 YHRGHHSYTVAYAR-OPMZPASUSA-N 484.557 0.786 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1)n1cnnn1 1800437049 UJGRYEAHHHUPQQ-FWEDZOCSSA-N 477.363 0.830 50 20 JCGD O=C1CN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)Cc2ccccc2)C(=O)N1 1800437134 YLFQMBOMOFSNRC-RCJHGTSTSA-N 493.358 0.134 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=CCCN(C(=O)OC(C)(C)C)C1)C2 1801010589 JYMBENMETHFJRP-RMFSNUHRSA-N 493.605 0.516 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)nc1 1803141154 LSLLSKAJYZLZTJ-FHLIZLRMSA-N 466.947 0.799 50 20 JCGD CN1CCCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803172874 SUJCMZNEZXMJGT-YYWHXJBOSA-N 465.558 0.884 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803244254 YSJDDWUXKVOWHN-MLHJIOFPSA-N 484.981 0.963 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1803587520 HDZLUEMXMQRYPL-SYNHAJSKSA-N 467.592 0.141 50 20 JCGD Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cc1O 1804895957 WUPLRDVGLNXKST-LIRRHRJNSA-N 464.486 0.153 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ncnn2C)[C@@H]1c1cccnc1 1805276593 IKDLARRWVMKUDM-PVCWEEQBSA-N 463.502 0.664 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373830 CGLHMWYTGRMBFL-KNQAVFIVSA-N 477.330 0.238 50 20 JCGD C[C@](O)(C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(F)(F)F 1810294051 HTSHHARSYYUCHM-RISOHXOYSA-N 480.447 0.713 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1 1810302500 LDOAWIKHBYTUEK-BTYIYWSLSA-N 485.508 0.985 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1 1813032321 GTDMFQDDUVMKJP-LMCOJAPRSA-N 451.999 0.977 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1 1819403339 FSZFFNDDRVUCMH-MRXNPFEDSA-N 454.447 0.508 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1CC[C@H]2CCC(=O)N2C1 1820758631 KJNPMFGLXOJKHB-QRFRQXIXSA-N 479.346 0.796 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(=O)N(C)C)CC2)NC(=O)NCc1ccccc1 1822518918 XOXKOTFPGYHVFA-OAHLLOKOSA-N 487.586 0.490 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1 1823007310 LVSUWFGJAHZTRY-PEXQALLHSA-N 451.318 0.897 50 20 JCGD CC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551882 XAKLYNVPWXKOFZ-XMSQKQJNSA-N 480.949 0.174 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)nn1 1830543475 SPVFDBVZTVYZIT-FZKQIMNGSA-N 457.325 0.586 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832250954 BYKFHANHXWSOCI-QMTHXVAHSA-N 464.796 0.052 50 20 JCGD COc1ccc([C@H](O)C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1833181531 BUDZLDYROCQMCV-DEOSSOPVSA-N 495.385 0.294 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833263721 XSQAWQUQXDHOJF-CQSZACIVSA-N 495.422 0.901 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1ccnc1 1833375248 BFLGSISRNXNVBH-KRWDZBQOSA-N 453.352 0.009 50 20 JCGD Cc1onc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1C 1833605614 TWLGNTKCYAFTFZ-UHFFFAOYSA-N 454.336 0.470 50 20 JCGD CC(C)N1CCC(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1833696426 DCLUHQTUMACZCF-UHFFFAOYSA-N 484.450 0.672 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)/C=C/c3cccnc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797282 BTIDFBQIBUWUNV-FPYGCLRLSA-N 462.359 0.660 50 20 JCGD COc1nccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1F 1834799956 ILGNNWQTDOYTHW-UHFFFAOYSA-N 484.337 0.408 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n[nH]1 1834922717 FTKFPUQPELGFBK-UHFFFAOYSA-N 453.352 0.151 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835106436 YTXCMEUEHBEMLJ-MRXNPFEDSA-N 479.651 0.888 50 20 JCGD Cc1cccc(C)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939536 RSAYBSBNLGEAOL-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD Cc1nnc(CCC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1837172947 PFCAQASVOILLMG-UHFFFAOYSA-N 486.403 0.771 50 20 JCGD COc1ccccc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837456947 TZIBEIXROLMXOE-VWLOTQADSA-N 497.552 0.397 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c[nH]c4ccccc34)C2)C1 1837460042 RBXRDWBNWWAJKP-VWLOTQADSA-N 492.536 0.479 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccncc3)CCO2)C1 1839059341 DBUOVJRQXUDEKP-OINMWHHXSA-N 468.514 0.215 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C(=O)OC)cc3[N+](=O)[O-])CCO2)C1 1839461920 DAAOBAMWVAVXHY-IIBYNOLFSA-N 499.904 0.705 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1839964872 HFABWIZXAKFWFZ-RDTXWAMCSA-N 462.341 0.459 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1840054995 AUAQWAPBOMAYQC-AGKSTNPPSA-N 495.932 0.434 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)C2)C1 1840182299 FUGNIBYXCXGBKM-QHCPKHFHSA-N 499.609 0.119 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1 1840185539 SZRREXOCZTUQKD-XMMPIXPASA-N 476.574 0.755 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1cccs1 1840375811 IFNOSFYUANHBKN-QRQCRPRQSA-N 473.555 0.620 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(F)c1F)CCO2 1840718081 KPVGCHACTAJIGO-JOCHJYFZSA-N 478.232 0.168 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(=O)C3)CCO2)C1 1840831233 BVJIQRIXBQZHRD-KKSFZXQISA-N 473.954 0.554 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(=N)N)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2 1842872574 ONYOXKNMVRDZEG-CHWSQXEVSA-N 462.954 0.881 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)O2)C1 1843009796 JYUOXFINKNTESS-LJQANCHMSA-N 499.373 0.352 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)c(F)c2)C1 1846894569 MOEKAMJQKUZQSR-UHFFFAOYSA-N 454.524 0.419 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)c1n[nH]c(=O)c2ccccc12 14854985 MHDQLDHIJVYVIQ-ZDUSSCGKSA-N 473.486 0.924 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)c2ccccc2c1=O 17163698 FVQZIZCWLDMNIM-UHFFFAOYSA-N 462.466 0.661 50 20 JCGD O=C1Nc2cc3c(cc2/C1=N\NC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)OCCCO3 17372081 IAZPIIGAVMZAEU-UHFFFAOYSA-N 486.506 0.955 50 20 JCGD O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 728976090 YKEKWEDHQFLQCB-ZYHUDNBSSA-N 451.473 0.162 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 729047943 RWYCHRRWFBAIQG-UHFFFAOYSA-N 490.609 0.966 50 20 JCGD Cn1[nH]c(Br)c2c(=NCCNC(=O)NNC(=O)Cc3c[nH]c4ccccc34)ncnc1-2 729625088 NAMTVYGCUDRFNK-UHFFFAOYSA-N 486.334 0.966 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cnn(Cc3ccccc3)c2)c1 751261201 JEMNJCXIZCIWMY-UHFFFAOYSA-N 463.541 0.805 50 20 JCGD Cc1cc(C)c(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c(C)c1 763906367 QIVXMYDYHRAJBC-UHFFFAOYSA-N 482.584 0.978 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1 789857317 RARFWGLHUHTUQT-UHFFFAOYSA-N 499.593 0.577 50 20 JCGD COC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 912980600 UERWRGCWJNQPAG-UHFFFAOYSA-N 461.905 0.706 50 20 JCGD O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 913151626 RAXCLWYEZSKZNW-UHFFFAOYSA-N 498.558 0.740 50 20 JCGD CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)s1 916231956 BDMJQUSBNOQBAZ-UHFFFAOYSA-N 450.502 0.692 50 20 JCGD O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 921074474 RURMZBUOLPVCKB-UHFFFAOYSA-N 476.540 0.718 50 20 JCGD CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)n[nH]1 1777727462 AEWMAIYRTQHQAX-XMSQKQJNSA-N 455.519 0.412 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1 1777978663 ZAPNDQYIDLMCAM-QVGKIPNLSA-N 464.486 0.307 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](N)Cc1cccnc1)C2 1778091080 MTAOMOWJONVFIB-JLFDSKHCSA-N 495.584 0.599 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ncccn1)C2 1778091923 ZMIVGTNEEUKHGC-TWLABZOOSA-N 467.530 0.667 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)C1=O 1778711250 GAGVIHWMEICISR-KSSFIOAISA-N 454.252 0.955 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)C[C@H]3CNc4ccccc4O3)CCO2)C1 1779032718 WVNHTVZWKQFMCP-FYSMJZIKSA-N 480.525 0.392 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nc1Br 1779922520 NRQBGMOCQKLVLL-PXAZEXFGSA-N 462.728 0.896 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCC(=O)N1)C2 1780054307 JGJNTJLJEFQIIP-GEQKSPFYSA-N 488.497 0.926 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780887300 AJBJEEBBTSSQPT-XMMPIXPASA-N 474.363 0.568 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cccc4nscc34)C2)C1 1782414558 PXZOJLMGQVFWLC-JOCHJYFZSA-N 451.313 0.733 50 20 JCGD COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)ccc1F 1782917358 JIRHDHOVFXUPAC-ZJSXRUAMSA-N 470.306 0.955 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C[C@@H]1COc3ccccc3O1)CCO2 1783933137 CNXLNBBMKZXNCY-HXOBKFHXSA-N 460.531 0.419 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1F 1783934920 LTTXDGCWQUYEGH-QHCPKHFHSA-N 478.521 0.819 50 20 JCGD Cc1nnc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)o1 1787030968 SAQTXKPZYYKTBC-UFYCRDLUSA-N 499.572 0.246 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ccccc34)C[C@@H]21 1788610157 GWUJREFKBTZRQD-DCPHZVHLSA-N 463.498 0.240 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc([N+](=O)[O-])c2c1OCO2 1789287185 KBKWDZUWYJATDM-FATJJJSSSA-N 455.851 0.517 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(N4CCN(C)CC4)CC3)[C@H]2C1 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QXSLZLCPAUODJJ-PXNSSMCTSA-N 481.557 0.562 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)N(C)C)[C@@H]1c1cccnc1 1808407496 AKADTGXOXFBMMV-TYXIVBLQSA-N 482.545 0.493 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2nonc2c1 1809124992 CKQRXJMYQWIIAL-AVRDEDQJSA-N 471.282 0.931 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)CC2)C1 1809970036 ZOWPXTOCTPITLZ-FPOVZHCZSA-N 467.375 0.612 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1 1810303578 VZQGFQOEHKAXIK-IERDGZPVSA-N 485.508 0.756 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1 1812341159 AZDWISBQYOCRIW-UEENNCTQSA-N 490.524 0.478 50 20 JCGD CN1CC(C(=O)NC[C@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)[C@@H]2c2cccnc2)C1 1813608353 RTQAINIRZQJFHM-ZJSXRUAMSA-N 493.612 0.995 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1 1814770221 RQEKSXBWVCUCNL-BDAKNGLRSA-N 469.298 0.953 50 20 JCGD Cc1nnc(CCC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)s1 1815337990 YWHHHVUHWQTBLF-AWEZNQCLSA-N 471.373 0.841 50 20 JCGD CC1CCN(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1 1815350520 WWTVOFXDWUUPNP-KRWDZBQOSA-N 456.377 0.781 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)n1cccc1C=O 1815380938 DJZYFRLGMXZDFT-CJNGLKHVSA-N 466.328 0.924 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3nc4ccccn4n3)sc2C1)c1cccc(B(O)O)c1 1816649572 GOLQZCFGXWFVCW-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncn(C)n1)CC2 1817277364 RIISFHQXEMJDTR-DLDHGHKKSA-N 455.504 0.631 50 20 JCGD COCCn1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n1 1817471123 APIRBJVXQSSIIZ-LJQANCHMSA-N 466.307 0.552 50 20 JCGD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1SC(=N)NC1=O 1818097943 BHSCIZGSNREYRG-UXEPBGEESA-N 484.347 0.198 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1cnc2[nH]ncc2c1 1818948688 RXROHJKKTUPOQV-HNNXBMFYSA-N 462.300 0.634 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1820204798 LFUUVAACWKFLKU-XJKSGUPXSA-N 465.344 0.944 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1cnc2snnc2c1 1821276934 VZDULZZGFVIAMH-ZDUSSCGKSA-N 480.340 0.762 50 20 JCGD COCCn1nccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822413946 JDVLJDDYRWXKOW-INIZCTEOSA-N 460.539 0.932 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2 1826088064 QPSSKYSPLXUMPE-VIFPVBQESA-N 450.481 0.373 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827055020 NVVKLVSKZFDLKP-YADHBBJMSA-N 457.380 0.905 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923387 HZECCWBAYKGOAG-FQEVSTJZSA-N 458.563 0.787 50 20 JCGD COc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cn1 1830537734 NEDJMRKNIYHJMW-SCLBCKFNSA-N 457.325 0.586 50 20 JCGD O=C(C1CCN(c2ccccc2)CC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830610244 MFRZOSUNIHKKLL-OFNKIYASSA-N 465.978 0.959 50 20 JCGD O=C(CCCN1C(=O)c2ccccc2C1=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724742 BJUHWWVWJVBWGG-FDDCHVKYSA-N 493.944 0.119 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1 1831286515 XZWMBUXJQQNZGN-ROUUACIJSA-N 456.609 0.556 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832945798 AIRQZILMZNINOG-KSSFIOAISA-N 465.856 0.699 50 20 JCGD O=C(c1ccc(Br)nc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833256936 XAKLDRHECZCGJK-SJCJKPOMSA-N 480.718 0.653 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1 1833309443 VGNJDVKUKLSAKV-HXUWFJFHSA-N 486.034 0.804 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)CCO2)C1 1833726234 XBZPVISEMWLWIY-GAJHUEQPSA-N 493.992 0.495 50 20 JCGD O=C(Cc1cccc(Cl)n1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833880537 YXWFYXSPIPAQDA-UHFFFAOYSA-N 484.793 0.843 50 20 JCGD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1C 1834024050 PBMXVKKQQMZEOB-UHFFFAOYSA-N 464.375 0.877 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834799135 OYOHPMYZFGTGCX-GOSISDBHSA-N 467.379 0.318 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CN3CCOC3=O)CC2)CC1 1835116271 FCHYOYMTGQOQBI-WGOQTCKBSA-N 487.561 0.144 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1 1835323032 GNNCYOSCKXSQLW-GOSISDBHSA-N 459.425 0.098 50 20 JCGD CNCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835660439 ZOSQJNXASXENPQ-HRAATJIYSA-N 477.002 0.575 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC3CCCC3)C2)C1 1837456920 PVJDPNACAILFJM-HSZRJFAPSA-N 459.547 0.726 50 20 JCGD CC(C)Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)n(C)n1 1837457958 YMLUSYQHHWVWSB-DEOSSOPVSA-N 499.572 0.001 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc[nH]c4cc3F)C2)C1 1837459532 IFXMRUVUHDVUSP-XMMPIXPASA-N 496.499 0.689 50 20 JCGD Cc1cc(F)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461250 RJTCXCPSFBRVCA-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)n1ccccc1=O 1837686965 OEYXKNBTZQUMCE-UTKZUKDTSA-N 451.596 0.717 50 20 JCGD Cc1cccc(C)c1SCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837705799 IEKPZFZZQFHINK-VWLOTQADSA-N 498.410 0.846 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)N1C[C@H]2C[C@H]2C1 1838370517 PXOVBOKWRNRQKO-GBESFXJTSA-N 463.623 0.698 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838501479 GYVCHHGSYKMQFP-VQTJNVASSA-N 484.340 0.396 50 20 JCGD NC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1)c1ccccc1 1839199380 NMUVMLPGCADREF-TXPKVOOTSA-N 458.328 0.876 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1839964050 DLUSQPDMCSJYOH-IFXJQAMLSA-N 466.336 0.973 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1 1840153160 GBNMYEHNIRZWJI-YCRPNKLZSA-N 463.922 0.796 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1 1844263321 QUFYJOULELHUPK-UHFFFAOYSA-N 457.512 0.219 50 20 JCGD CN1CCC(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)CC1 1845038188 BUXHIEHVFJUYKU-UHFFFAOYSA-N 456.591 0.878 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CN1CCCCC1=O)C2)NC(=O)NCc1ccccc1 1845039333 FZFNDRXEJYENFL-UHFFFAOYSA-N 470.574 0.549 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)C1)NC(=O)NCc1ccccc1 1845074556 YTHUFSRUHSPKTL-RTWAWAEBSA-N 496.612 0.937 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 22193224 XMVPKYAOLKLSFH-FQEVSTJZSA-N 497.537 0.869 50 20 JCGD N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1 725873264 WAYYCZXQTSVXNA-UHFFFAOYSA-N 476.540 0.097 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1 726536756 FZOVSMGUNHQUNJ-UHFFFAOYSA-N 456.459 0.798 50 20 JCGD CCS(=O)(=O)CCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 727943846 SNVGTNWWHDWINZ-UHFFFAOYSA-N 460.559 0.928 50 20 JCGD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2=O)cc1 728846264 WCDWZZBQWIJUPK-QHCPKHFHSA-N 481.513 0.316 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)C1CCN(c2ncccn2)CC1 728846278 WWDGCTWHARYOSA-INIZCTEOSA-N 466.498 0.665 50 20 JCGD COC(=O)c1ccc(-c2ccc(C=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)o2)cc1 730569318 UQMNFTLOTDOKAN-UHFFFAOYSA-N 457.468 0.768 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccoc1 747184124 SRPKOWBUCPVILC-AWEZNQCLSA-N 463.921 0.476 50 20 JCGD COc1cc(N2C[C@@H](C(=O)NNC(=O)CNC(=O)c3ccco3)CC2=O)cc(OC)c1OC 751203040 ZFPZDSBPGXQKSC-LBPRGKRZSA-N 460.443 0.236 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)Cn2cnc3c(oc4ccccc43)c2=O)n1 761986356 PNEIZLFTQOCPAR-UHFFFAOYSA-N 455.452 0.841 50 20 JCGD COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c1C 768750341 XBPBOELYVIOYPA-KHAFMBKQSA-N 457.487 0.625 50 20 JCGD CS(=O)(=O)N1CCCc2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc21 804545330 WRYXPNXERUXLHG-IBGZPJMESA-N 489.506 0.543 50 20 JCGD CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cc2C[C@@H]1C 812546266 UIHDTMJCGLLOKK-JTQLQIEISA-N 486.959 0.908 50 20 JCGD CN1C(=O)c2ccc(S(=O)(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc2C1=O 861581081 ZUJYTGJEASNMAR-UHFFFAOYSA-N 492.535 0.320 50 20 JCGD O=C(NCCc1nnc2n1CCCCC2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 916235154 CWGHFTKCESMXNI-UHFFFAOYSA-N 475.575 0.976 50 20 JCGD Cc1ncc2c(n1)CC[C@H](NC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cn1)C2 916316712 JJAQEXDMJKUYNF-INIZCTEOSA-N 460.564 0.300 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(NS(C)(=O)=O)cc1 916380712 LZVNQNBXSGAYKH-UHFFFAOYSA-N 468.561 0.804 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 916649729 RCRFFGQWKXSORI-UHFFFAOYSA-N 488.526 0.002 50 20 JCGD CC(C)(C)C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 917181526 ONCISRAGUNSFSL-CYBMUJFWSA-N 453.970 0.615 50 20 JCGD Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919884354 IMCIPZPXJXVMFX-ZDUSSCGKSA-N 470.529 0.198 50 20 JCGD C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)COc2ccc(Br)cc2)cc1 1336957764 XSOSTMZOFLHODO-GFCCVEGCSA-N 486.344 0.948 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc(O)n1 1778035125 DWDAAIPEZPKNSU-AUSIDOKSSA-N 453.304 0.217 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CS[C@@H]3CCCCO3)CCO2)C1 1779032782 YIGKUANCJRDDRZ-WIYYLYMNSA-N 463.560 0.388 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)C2 1779375605 QDTQEAQWTQTNEN-DSDYNGPPSA-N 457.531 0.380 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Cl)nn3)C2)C1 1779429725 QRUZRSBSIQSYSS-VMHRPQTGSA-N 459.894 0.708 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]cc3I)C2)C1 1779544878 MEBSLSZORAGLJK-ZUZCIYMTSA-N 482.706 0.712 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779682666 HSYPYYFWLJNICG-JOCHJYFZSA-N 488.932 0.890 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(-c2ccncc2)[nH]n1 1779742186 BSKPEXLHMSNJLD-RCZVLFRGSA-N 489.341 0.593 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1 1780355866 RNFYIIZIHVEBEN-VCOZGABYSA-N 470.534 0.611 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnn3c1CCC3)CCO2)NC(=O)NCc1ccccc1 1780967920 DFABXJPCDYHXBD-RUZDIDTESA-N 495.584 0.619 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(C#N)c[nH]1)CCO2)NC(=O)NCc1ccccc1 1780969024 SIWKOOXNIXAHRJ-DEOSSOPVSA-N 479.541 0.676 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nc1 1780969363 YPUHODDPYHAYTH-RUZDIDTESA-N 496.568 0.880 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1781352676 FAEBIQYXUJNYLM-IIBYNOLFSA-N 473.643 0.944 50 20 JCGD O=C1CN(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)C(=O)N1 1783019159 TVYWNKTWIMGAMB-IERDGZPVSA-N 493.358 0.374 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)CCO2 1783538916 YVBVVQYKAYOJHE-CKFHNAJUSA-N 478.384 0.875 50 20 JCGD COc1cccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1C 1783637621 GENZLGNYJQULFK-XMMPIXPASA-N 452.316 0.370 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)COCCOCCOCCOC)C2)C1 1783685524 DISDXSDYORVURU-FXAWDEMLSA-N 495.411 0.686 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc(C)c1C(=O)O 1783934440 HUTHEEYORJMHMO-QHCPKHFHSA-N 460.531 0.818 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C[C@@H]21 1783968143 QULZHFVGCCTBMS-MNXVOIDGSA-N 467.324 0.042 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CNC(=O)OC(C)(C)C)[C@H]2C1 1783996384 YRHBRLYHZTVYBV-GVRJEKJASA-N 463.959 0.106 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CC(N)=O)[C@H]2C1 1784601353 SQLRMLNBEQQZTA-DTPILHQWSA-N 476.486 0.625 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3C[C@H](NC(=O)OC(C)(C)C)C3)C2)C1 1785516000 XQMYGLKUZGFWFV-QQMNAOGKSA-N 481.594 0.493 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CC(=O)N4)[C@H]2C1 1788263812 WJSKRUDHUIAEOF-IEZWGBDMSA-N 457.531 0.148 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4[nH]ccc4n3)[C@H]2C1 1788318700 ZPDDGDCHRCNMJT-RISOHXOYSA-N 463.498 0.469 50 20 JCGD COc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)ccc(F)c1F 1788609707 BTSHCFBVSPDVEX-IWEFOYFVSA-N 489.479 0.879 50 20 JCGD COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1C 1788610701 PMYZGNVGHXOYTB-JVPBZIDWSA-N 468.514 0.304 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc[n+]([O-])cc3)[C@H]2C1 1789095355 HPFZLHPIXIQSSY-QECDCCOMSA-N 454.487 0.047 50 20 JCGD Cc1c(Br)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)nn1C 1789362352 PLGFGTILAWUHOP-KKUMJFAQSA-N 499.410 0.457 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c([N+](=O)[O-])c1 1789966248 GAHYSQYNPARLDL-QRFRQXIXSA-N 491.545 0.499 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793879716 LYOVWAPJWFLQDD-XCQGWFOSSA-N 484.981 0.567 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(Cl)c1F)C2)c1cccc(B(O)O)c1 1795740621 DTHZCAMTSQSSPS-DBWKPXFBSA-N 464.661 0.815 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796192399 HMMDQWCARLOREO-RDGPPVDQSA-N 459.352 0.922 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)[C@H]1SC(=N)NC1=O 1796422539 NWUQROKHFITXEX-HDLKOFKZSA-N 461.382 0.409 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)OC(=O)NC(C)C 1799129646 ORXJMIJYTUFRKC-OZPPHJKRSA-N 490.561 0.623 50 20 JCGD CC(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800435309 BLJRGFYSKXZQNY-ZMMAXQRCSA-N 452.349 0.718 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)C1 1801014774 FQUOVJUZEBDOKZ-QKGCVVFFSA-N 480.389 0.998 50 20 JCGD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1ccnn1 1801341517 RXXRWTFAJAELEU-RSPOEFSDSA-N 468.562 0.824 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803138194 YGMJJVHDMRWJDR-LTIDMASMSA-N 470.954 0.573 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803140314 CCHAZZIVGJPPSQ-MNEFBYGVSA-N 480.974 0.941 50 20 JCGD CN(C)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1805108558 LDERHVHMPPVGRG-XXBNENTESA-N 473.342 0.856 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1806342595 OTVBLPWENHYTCK-HEHGZKQESA-N 452.309 0.471 50 20 JCGD CN(C)CC(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1806458211 AMYZRVYWVDILEU-ZJSXRUAMSA-N 481.601 0.995 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)CC1 1806935369 WSFBRPHHTKGCEI-UHFFFAOYSA-N 470.490 0.335 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)[C@H]2Cc3ccccc3CN2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365514 XMIDOEKLFMNYDQ-GPXOXTDOSA-N 484.365 0.796 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1808463749 HXZUFLHOZHPQHU-PGRDOPGGSA-N 459.547 0.970 50 20 JCGD CN(C)c1ncc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)o1 1810300430 YJEJHDIVSQDYPW-HNAYVOBHSA-N 478.513 0.768 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CN2CCSCC2)[C@H]1c1cccnc1 1813069021 SCQQGRKNLRWLRH-AVRDEDQJSA-N 462.620 0.509 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1 1813070948 ONRHEVUTOPABOS-HTAPYJJXSA-N 464.530 0.817 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCNC4=O)sc2C1 1818916189 OBOMEEQLWIQKBL-GFCCVEGCSA-N 488.574 0.072 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4nncn4c3)sc2C1 1819177705 BOJBEIWXGFZWDV-GFCCVEGCSA-N 477.510 0.724 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)N1 1821781154 ZLIBCKIFYUHZNF-ZGKBOVNRSA-N 498.993 0.182 50 20 JCGD O=C(CN(CCO)CCO)Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1 1822026450 HRBZAMBZRYDRSV-DOMZBBRYSA-N 450.309 0.379 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1825127824 WKHHUNOZCBJHCM-HXUWFJFHSA-N 469.307 0.405 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825815634 ZXKSZEVRJLOCGT-DOMZBBRYSA-N 488.375 0.962 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1 1826607512 BUAKKRQEHAYPNE-NSHDSACASA-N 455.504 0.049 50 20 JCGD CN1CCN(C2(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1827056826 XNIQNGGZMFIHRX-QHCPKHFHSA-N 482.434 0.380 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2n1 1830731510 KGQRMUHZTYJYBZ-YWZLYKJASA-N 452.895 0.241 50 20 JCGD COC(=O)CSCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831870882 IHRAKNKGMLVHAC-QGZVFWFLSA-N 456.609 0.885 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)cn1 1831951154 OWYVKXYRFLDEFO-LRULAXNGSA-N 484.513 0.294 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832251657 KUTRAGRJQBZUJS-YGRLFVJLSA-N 493.248 0.972 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833263720 XSQAWQUQXDHOJF-AWEZNQCLSA-N 495.422 0.901 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@H]1COc2ccccc2O1 1833715367 DWWDFDMWKPIBNQ-XMMPIXPASA-N 493.369 0.392 50 20 JCGD Cn1ncnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1833845435 PYDPBSCFOCDRGZ-UWJYYQICSA-N 492.374 0.891 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCC4)CC2)CC1)c1cccc(B(O)O)c1 1834800165 VTZLMRWUTFPQIY-UHFFFAOYSA-N 479.390 0.398 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@H]1Cc2ccccc2CN1 1835085831 YKWKHGVKGJGNGN-RUZDIDTESA-N 490.413 0.266 50 20 JCGD O=C(CSc1ccccc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835088947 STXMELQAGNFUNU-HSZRJFAPSA-N 470.356 0.229 50 20 JCGD COCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1835232048 CSEFITGVYANWDT-OAQYLSRUSA-N 465.459 0.627 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc2nccn2c1 1835413264 UNVDEJDEIFIRJC-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnn4ncccc34)CC2)CC1 1835736832 JGHJRWMXUVSJAK-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD O=C(c1ccc2occc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937118 PHIQPJKPYPQVNM-XMMPIXPASA-N 464.283 0.496 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cn4cc(Cl)ccc4n3)C2)C1 1835937173 QYJYTNNIGOTNCR-HSZRJFAPSA-N 498.732 0.051 50 20 JCGD O=C(COc1cccnc1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837112300 HPBKVQDXHZJHCD-UHFFFAOYSA-N 467.331 0.453 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccoc3Cl)C2)C1 1837459264 ALERHMVELADRIJ-HXUWFJFHSA-N 463.878 0.315 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cnc4[nH]ncc4c3)CC2)CC1 1837920435 YQACERHGWSWQIZ-UHFFFAOYSA-N 477.330 0.564 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(Cl)n1)CCO2 1837922720 KDFZEZWQJCOYDS-WMPMWDHYSA-N 489.920 0.334 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1 1838101524 UPHFSVGIMVIFQD-JFLMPSFJSA-N 499.576 0.452 50 20 JCGD CC[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838527386 PZHYJWQNICIUCI-LAUBAEHRSA-N 465.459 0.361 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(O)cc1)CCO2 1838969815 FCUPKNUMZVENGW-DZQSVEARSA-N 469.498 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)CCO2 1839032790 SONFVQPWDZIVLM-XMMPIXPASA-N 498.621 0.574 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1839036788 OQRJGXQQMIDGNE-GQWAEJPESA-N 459.877 0.935 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)nn3-c3cccc(=O)n3C)C2)C1 1839143715 GHJKZPOPZNOBES-HXOBKFHXSA-N 491.976 0.967 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3ccoc13)CCO2 1839587983 HRBZJPYFSSECAW-HSZRJFAPSA-N 458.515 0.876 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839652007 XTITVZABHFTVAS-HNAYVOBHSA-N 471.352 0.745 50 20 JCGD CN(C)[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccc(Cl)cc1 1839729325 CHCLFVUNGHPFDS-WFXMLNOXSA-N 474.385 0.999 50 20 JCGD O=C1CC[C@@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](Br)Cc4ccccc4)CCO3)C2)N1 1839801940 IOLUXFMWDDVFPX-SPEDKVCISA-N 494.386 0.728 50 20 JCGD C[C@@H](S)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1840159055 WKWLYPIDVRGGDA-TYILLQQXSA-N 466.000 0.893 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)ccc12 1843124395 LJYNHFZBNVZAEO-UHFFFAOYSA-N 476.298 0.322 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264094 DCRJBBAYTGZNSE-INIZCTEOSA-N 476.534 0.042 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccc(C(N)=O)cc1)C2)NC(=O)NCc1ccccc1 1845039537 ZCIVKOCEILJGMZ-UHFFFAOYSA-N 478.553 0.949 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCC(=O)NN(C)C 1847944017 DAPZAOZQVUZGRW-DRMAHVMPSA-N 469.583 0.489 50 20 JCGD C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 17517731 BBBOWBFJBIPMEK-UHFFFAOYSA-N 490.563 0.457 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(CN2C(=O)CNC2=O)c1 27193379 HAHCYHNHZQDCBL-UHFFFAOYSA-N 458.500 0.415 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1ccc2c(c1)OCCO2 28663349 OZACLMLCLWOFDM-UHFFFAOYSA-N 489.550 0.801 50 20 JCGD COCCCN1CCC(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1 727031129 KUNHIIYXEIMZKR-UHFFFAOYSA-N 455.581 0.447 50 20 JCGD CS(=O)(=O)Nc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl 728339735 RHAMYMODGOISCZ-MRXNPFEDSA-N 483.886 0.856 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl 728383429 QYOIHURZNCVVPF-QMMMGPOBSA-N 470.356 0.630 50 20 JCGD N#Cc1ccccc1OCC(=O)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1 729614814 PMWYPINOVURRIJ-UHFFFAOYSA-N 452.519 0.660 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 730821833 SXMCXXZKXLBUCN-UHFFFAOYSA-N 470.529 0.384 50 20 JCGD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NNC(=O)C(=O)N1CCCC1 748458290 XCZCKOMBDRAMEA-UHFFFAOYSA-N 470.509 0.395 50 20 JCGD O=C(COC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1)NNC(=O)c1ccc([N+](=O)[O-])cc1 915026525 ZUEBMXZFENCNEZ-UHFFFAOYSA-N 455.358 0.898 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1 916729020 JLLODKURSNKALQ-UHFFFAOYSA-N 460.556 0.836 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(C(=O)NNC(=O)Cn3nc(C)cc3C)cc2)n1 917392248 WGYURVQXBKOYSO-UHFFFAOYSA-N 466.502 0.236 50 20 JCGD O=C(COc1ccc(I)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886434 STBFBDVYFMPWJA-JTQLQIEISA-N 453.258 0.188 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 921247957 NYJHEQPVFOXJGC-UHFFFAOYSA-N 451.461 0.455 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(=O)n1O)C2 1778091855 UZIZTNQUDSNIHM-TUWUPGADSA-N 484.513 0.347 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnc3ccccc13)CCO2 1779030066 GIJWZWTWDSNXES-DEOSSOPVSA-N 460.494 0.991 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Nc3ccccn3)C2)C1 1779328195 VINBKUUWPHHWIW-GFIUEJLLSA-N 467.530 0.846 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1[nH]nnc1C)CCO2 1780096885 KXINMCFEZZDICD-FQEVSTJZSA-N 458.431 0.704 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1cccn1 1780969723 PIFOOXZLTBWUMG-CYFREDJKSA-N 483.573 0.620 50 20 JCGD Cc1cc2nnc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)c(C)n2n1 1781329151 ANCFCQVIFCJKFL-PBHICJAKSA-N 455.288 0.875 50 20 JCGD O=C1C[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)CN1 1783022316 KABDWNFYTFHHDR-FIKGOQFSSA-N 464.360 0.959 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783933032 OVAKQSWEKBRXDN-DEOSSOPVSA-N 474.558 0.609 50 20 JCGD Cn1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1C(F)(F)F 1786980205 VNBIAWHGCOYZGZ-JQFCIGGWSA-N 480.252 0.026 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)nc1 1786981854 MZAKZEUGFKONHA-JBACZVJFSA-N 481.358 0.521 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3n[nH]c4cc(Cl)ccc34)C[C@@H]21)c1cccc(B(O)O)c1 1786984751 FMHMUZURMFXWKK-OHEPNIRZSA-N 496.760 0.732 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C[C@@H]21 1787507608 IQPSGUXLBHOXEF-UIRXRCQNSA-N 498.584 0.501 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)Cc3cccnc3)C[C@@H]21 1787508828 KLDTZZHCYSHMBW-QNNUHGRASA-N 481.557 0.065 50 20 JCGD C[Si](C)(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)co1 1788589433 ZMKXNUPKTMRDGN-VDGAXYAQSA-N 470.407 0.412 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3COc4ccccc4O3)C[C@@H]21 1788611431 BFEFIASZMMWYDE-XWIOLROMSA-N 481.509 0.118 50 20 JCGD COc1cc(C#N)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1789255763 BJFCJUFPDJKWJC-HSQYWUDLSA-N 463.299 0.154 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3[C@H]4SC=C[C@H]43)[C@H]2C1 1790625749 ZYFVKSLQUNYTNJ-MDYHZDBPSA-N 457.556 0.975 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Br)nc3)C[C@@H]21 1791290684 KQGUSXSYGPTJTA-ULQDDVLXSA-N 496.406 0.739 50 20 JCGD CN(C)c1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1791469974 GSQDLDABOMBNGC-TZYHBYERSA-N 494.596 0.977 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)[C@@H]2C1 1792983486 JYOJGEXTVQVHLO-JUTUNNCASA-N 457.955 0.289 50 20 JCGD O=C(CCc1ccccc1Cl)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1795314271 ARYOLHHXZIIGLD-OPMZPASUSA-N 456.735 0.856 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@@H]1CN(Cc2ccccc2)CCO1 1796191568 YJGLIXAWRXOLGB-KIHHCIJBSA-N 477.370 0.519 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798524986 WUJQEHHWUUPPHV-FIIQBIKZSA-N 491.501 0.431 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(F)c(F)c2)CC1 1799064982 GNXVTXXVFWWXNY-VPTLXERWSA-N 470.281 0.580 50 20 JCGD Cc1noc(N)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799094771 JXSHUPQVXDFNQA-XEMDLRDOSA-N 485.545 0.115 50 20 JCGD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1)N1CCN(C)CC1 1799869843 QNAQYNSMZHPQQC-SNJCGAMXSA-N 499.660 0.607 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-c2ncc[nH]2)cc1 1801819808 FXRSXHPSFDHQIO-RMFSNUHRSA-N 454.531 0.653 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1C 1803287502 TZBPZQUNXPHOSX-WMZHIEFXSA-N 461.331 0.366 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@H](O)CN2)[C@@H]1c1cccnc1 1804241362 LZOWLUCVYHLHBP-HVMFNXBNSA-N 496.008 0.942 50 20 JCGD Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)o1 1807472017 XKLVHAIQBWLXQU-MGPUTAFESA-N 464.486 0.334 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807951278 YQHYSRJXPLIWOU-GWCFXTLKSA-N 451.274 0.331 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1 1812327068 QRKMARFGXWSNDK-ZHRRBRCNSA-N 490.524 0.528 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2C)[C@H]1c1cccnc1 1813070571 JLQAIVGAJLMNML-VGSWGCGISA-N 454.531 0.473 50 20 JCGD CCCNC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815109559 UHKSGUBWUGQKFY-GOSISDBHSA-N 455.324 0.702 50 20 JCGD COCCOCCOCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817474224 AUMRMKJDHCXBOZ-HXUWFJFHSA-N 488.350 0.465 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3nn[nH]c3C(F)(F)F)sc2C1)c1cccc(B(O)O)c1 1821642934 JIRIRLGJWQGAMD-JTQLQIEISA-N 480.237 0.499 50 20 JCGD O=C(c1cnc(C(F)(F)F)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830722843 HFNCRORWAWOBCV-MLGOLLRUSA-N 452.817 0.165 50 20 JCGD O=C(C1=NO[C@H](c2ccccc2)C1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731680 NSZJLHWBJUDTER-LQWHRVPQSA-N 451.907 0.560 50 20 JCGD CCOC(=O)C1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1831251681 HZRAGICDUOANNR-HXUWFJFHSA-N 456.348 0.943 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1831318130 MZFQJIJALFXCLI-RDTXWAMCSA-N 453.989 0.036 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3F)C2)C1 1832551101 AWEYYUPOWVLQFZ-YYQBIWNASA-N 463.934 0.933 50 20 JCGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(=O)[nH]c1C 1833390393 WGJGOWBSTMWUGZ-SUMWQHHRSA-N 461.288 0.147 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833599738 RLMLEVCDGXDEOQ-ACJLOTCBSA-N 490.376 0.339 50 20 JCGD Cc1c(F)ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1N 1834801195 TYJKOKNUPDHLAM-UHFFFAOYSA-N 482.365 0.895 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834824759 LRWLDXUISKGXTL-RDTXWAMCSA-N 480.356 0.071 50 20 JCGD Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c(C(F)F)n1 1835241800 HSLFISWGHNBKCZ-UHFFFAOYSA-N 489.332 0.537 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3CCCC4)C2)C1 1835933905 ILGIXHMQRDTYMQ-SANMLTNESA-N 478.354 0.629 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837458880 FWZCEUKUSWAAGU-JOPVOSQUSA-N 483.525 0.760 50 20 JCGD Cc1cc(C#N)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837460107 VLNPEFLWYHWCCZ-DEOSSOPVSA-N 478.509 0.249 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)C2)C1 1837711673 NIDOQUFUXLPUEH-JOCHJYFZSA-N 498.674 0.941 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)n1ccccc1=O 1837921143 FILAPRXKATZPFX-SFHVURJKSA-N 481.358 0.402 50 20 JCGD O=C1CC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)=Cc2ccccc2N1 1838443266 GXEZIGXLWZICTJ-AVRDEDQJSA-N 463.918 0.468 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)c(F)cc1F)CCO2 1839263011 NWLZXFCZZMTFOV-JOCHJYFZSA-N 494.687 0.682 50 20 JCGD Cc1cc(C#N)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839454055 QVVGXBJKBRTKME-QHCPKHFHSA-N 457.531 0.310 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(O)O)C2)C1 1839743655 IYLXMXSAPNPVDG-YWMGUWEJSA-N 480.315 0.123 50 20 JCGD O=C1C[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](Br)Cc4ccccc4)CCO3)C2)CN1 1839802452 XJTBXKSSTJPBKT-SPEDKVCISA-N 494.386 0.585 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1840031139 GJYWKUDWIKUTAT-KUHUBIRLSA-N 471.352 0.374 50 20 JCGD O=C(CCc1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840053365 ICWRHMBUTVUABD-DEOSSOPVSA-N 470.306 0.208 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1 1840184120 TUDCDNVQVRZLDS-HXUWFJFHSA-N 452.533 0.004 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840298972 KTHGIWCYYYREFU-AVRWGWEMSA-N 481.553 0.634 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1 1840802959 MWJYJXJXGJANFX-QRWLVFNGSA-N 463.959 0.611 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1841747583 ZRSUXJOQKJINKD-KRWDZBQOSA-N 472.546 0.972 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2 1843415031 CJSUIQMWMXPZRU-YFSHSUMMSA-N 494.552 0.503 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1nnc3cc(C)nn3c1C)C2 1843415902 AITPGRZAUXMDHP-ZVHZXABRSA-N 463.502 0.692 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cn3[nH]cnc(=O)c3c2C)C1 1844655883 FLBIGXULZYFEAG-VULFUBBASA-N 464.486 0.282 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)c1 25416638 VJZRDLUSDQDAHZ-LJQANCHMSA-N 494.595 0.941 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](C)S(C)(=O)=O)c2)cc1 107910551 MQNNZMQTVMIOHN-LBPRGKRZSA-N 455.514 0.690 50 20 JCGD CS(=O)(=O)Nc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl 728339730 RHAMYMODGOISCZ-INIZCTEOSA-N 483.886 0.856 50 20 JCGD COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728889374 FSVZGKJMLFQDHT-UHFFFAOYSA-N 462.532 0.079 50 20 JCGD CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 729341752 SCEODANPDFUGRX-HNNXBMFYSA-N 460.578 0.628 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 745992522 CWOJNKRFCSLRBN-UHFFFAOYSA-N 462.484 0.580 50 20 JCGD C=CCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1 762476768 RJPBVKWZARWQMY-HSZRJFAPSA-N 497.533 0.850 50 20 JCGD O=C([C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1)N1CC[C@@H](B(O)O)C1 864232597 ANRLWVBVOSRLIV-GHMZBOCLSA-N 451.173 0.987 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)Cn3cccnc3=O)cc2)cc1 915188069 NMFVDPZCLPSHIY-UHFFFAOYSA-N 469.523 0.834 50 20 JCGD O=C(Cc1csc(N2CCOCC2)n1)NN=C1C(=O)Nc2cc(N3CCOCC3)ccc21 915954163 ORERSVCAFLNUBL-UHFFFAOYSA-N 456.528 0.831 50 20 JCGD CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)Cn2nnc(-c3ccccc3)n2)c1 916112504 KHXRHRBXFOYGBF-UHFFFAOYSA-N 460.545 0.608 50 20 JCGD CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@H](C)C1)c1ccc(S(=O)(=O)N2CCNCC2)cc1 916373016 XUMIVOIUBWGLOP-KURKYZTESA-N 465.620 0.866 50 20 JCGD CN1CCN(CCCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@H](c2ccccc2)C1 916484501 AIXFFNXBIYBZHZ-NRFANRHFSA-N 463.546 0.985 50 20 JCGD O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 916516362 LXIVZWWNOFQIRS-UHFFFAOYSA-N 477.503 0.086 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3O)cc2)CC1 918358699 WZAPBQWYMHFJSO-UHFFFAOYSA-N 480.930 0.973 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(NC(=O)c2ccc(F)cc2)cc1)N[C@H]1CCS(=O)(=O)C1 919961264 ZHKXVRPHGKBCPO-HNNXBMFYSA-N 470.504 0.758 50 20 JCGD CCCn1nc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)c2ccccc2c1=O 934081200 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Cc1nc2ccc(F)cn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781275618 RDVCQUXNNNXIGJ-CJFMBICVSA-N 494.332 0.903 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](COC)NC(C)=O)C2 1781901490 OZDFLVYXOGOXOA-YYAJDYIMSA-N 462.385 0.825 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 1783576469 MGSURNYFCKGCIL-GAJHUEQPSA-N 481.594 0.589 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(OC4CCOCC4)n3)C[C@@H]21)[C@@H](O)CCl 1784091241 MAALGJQSTXANQH-CBVHJVASSA-N 467.950 0.832 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)c1ccccc1F 1784091985 BNDTYLUVMGAHCW-PZBJXUGBSA-N 469.941 0.756 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)c3cccn3C)C2)C1)NC(=O)NCc1ccccc1 1784612745 PSFWFNFTTYFXFS-VWLOTQADSA-N 496.568 0.384 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(Cl)c1 1785065947 WFEYYWWYJUZPMU-XJABCFGWSA-N 486.761 0.864 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCn3ccnn3)C[C@@H]21 1785079745 YCRKZGKTOIGFPA-QAETUUGQSA-N 484.985 0.780 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C)c1 1785275963 QXUIYHOLJNWAEV-XMMPIXPASA-N 466.299 0.219 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21 1788610310 WTEKNCCSDIGGNQ-PJODQICGSA-N 459.894 0.036 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1cnccn1)C2 1792871287 UGSAABWFZSBVEG-YMSVYLFOSA-N 468.352 0.216 50 20 JCGD CCOC(=O)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)Cc1ccco1 1792982856 SGOHAOUAJRGDKA-KPEUIFRASA-N 457.911 0.427 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2)[C@@H](O)CCl 1792984368 ZDMJLIZEFAYLRM-ABPHAOMWSA-N 450.845 0.333 50 20 JCGD COc1cccc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)n1 1794287852 ZGMWJYKJSDGMLX-BJWYYQGGSA-N 452.515 0.973 50 20 JCGD CC1(C)Cc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)c2O1 1796258967 CCRZMHROZPEMBU-RMFSNUHRSA-N 464.327 0.597 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1796839290 UUYNFXDVYZUOMH-FCGDIQPGSA-N 475.351 0.158 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccn2cn1 1797100378 ZCKYYIJBABXEIR-IHBLFXCCSA-N 463.498 0.672 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1797279262 HMZRLEWGRUSLKX-YJVQVXSTSA-N 463.934 0.525 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1 1797282431 PXSJPRADJJNTHW-KOCGSJPCSA-N 499.584 0.298 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2 1798439889 NBWVTDJGNJXQCI-CLLJXQQHSA-N 482.453 0.888 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)cnc2c1 1798440150 DSDBLKIMGHRCGP-MUJYYYPQSA-N 475.509 0.567 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccccc1O)NC(=O)NCc1ccccc1 1800569649 SNSAZJJGTKPLKE-GQEURGSBSA-N 495.580 0.871 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2 1800760263 LNQCEQCAMGOLGW-DNVSUFBTSA-N 480.319 0.665 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(OC)cc1[N+](=O)[O-])C2 1800977689 VMJXCFKANYPLMO-QHHYFVSCSA-N 455.895 0.989 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)C2 1801013210 XRIQAGTVSYIXHG-USGNIVHTSA-N 465.482 0.239 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803143035 RHMHFPYUIPYELD-UNQWWWNPSA-N 460.922 0.296 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)C[C@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1804347997 LSFBCPICNJATGK-CTASWTNQSA-N 466.336 0.859 50 20 JCGD CN(C)CC(=O)NC[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1806458208 AMYZRVYWVDILEU-URXFXBBRSA-N 481.601 0.995 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375175 PSEBVOOOKBSKET-AUSIDOKSSA-N 464.331 0.094 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc2n(n1)CCC2 1809982529 SFQVGPGLSRLSIC-AVRDEDQJSA-N 459.315 0.538 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)nc3sccn23)[C@H]1c1cccnc1 1813073844 OZQWJMFXSAGTRM-KKSFZXQISA-N 497.581 0.844 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCc2ncc[nH]2)[C@H]1c1cccnc1 1813273665 JWWXTTUCZPWGDV-IIBYNOLFSA-N 462.514 0.756 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1814218091 BOHBDZUHCLJGSG-LISAXSMJSA-N 497.980 0.456 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1 1814762065 LFYHTHWEVBEFKW-DTWKUNHWSA-N 469.298 0.811 50 20 JCGD CC(=O)N[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(C)(C)C 1815057168 HSXPKLIJEVLDOE-AZUAARDMSA-N 469.351 0.946 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1ON=C(c3ccccc3)O1)CC2)c1ccc(B(O)O)cc1 1815344426 ZIZLNOYKUNSMJR-AOMKIAJQSA-N 492.322 0.783 50 20 JCGD O=C(CCc1cnccn1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347504 AGPGWYONYLXEQY-HNNXBMFYSA-N 451.317 0.472 50 20 JCGD CN1CCN(CCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1 1817156638 ZYUUUOQKTOREMV-SFHVURJKSA-N 462.599 0.412 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3ncccn23)[nH]n1)c1ccc(B(O)O)cc1 1817471928 XDMXPUBTGRZCDX-KRWDZBQOSA-N 459.275 0.752 50 20 JCGD O=C(NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)c1cccnc1 1817473816 BGFUMVSFGXTQHQ-LJQANCHMSA-N 476.302 0.220 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(-c3ccccc3)on1)CCO2 1829595460 ZRGMRKCGCIZXOZ-DEOSSOPVSA-N 485.541 0.785 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCS3(=O)=O)C2)C1 1830544255 SGSDJDHTQJBHLC-JKIFEVAISA-N 467.382 0.051 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)c3cccc(Br)c3)C2)C1 1830733189 GEBYMGCKLNXSHG-JTDSTZFVSA-N 491.766 0.539 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733628 QJIMXEPUFLCBOQ-SIKLNZKXSA-N 465.909 0.973 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c(OC)c1F 1830733963 XHUXWRDTVFIVNI-XCLFUZPHSA-N 478.876 0.652 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C[C@H]2C[C@H]21 1830737681 GOKFUKDRCFAPKR-QTTDFFODSA-N 487.981 0.440 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830739069 XXQZAMSGMLWPKG-KKSFZXQISA-N 475.970 0.300 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2 1832366776 PUENBEUAWMUCSQ-DEOSSOPVSA-N 497.527 0.626 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)nc1 1833308278 OWHZBNZQRSVRKN-GOSISDBHSA-N 472.995 0.270 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833317922 PXKWZEHCUYYFJM-OAQYLSRUSA-N 471.606 0.355 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833399873 IPNKOZCVBJUFQD-QFBILLFUSA-N 459.952 0.573 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(=O)n3C)CCO2)C1 1833876327 OBPVLPRFNHMBER-IFXJQAMLSA-N 456.337 0.629 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CCc3cncnc3)CC2)CC1 1834842717 AXZSGIUYAFGDJI-UHFFFAOYSA-N 480.573 0.293 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ccno3)CC2)CC1 1835118351 SGSRCQBEFLNPDD-CVKSISIWSA-N 455.519 0.994 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)CCO2 1835351193 OTTRHHXQJXXIQF-JOCHJYFZSA-N 498.674 0.941 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835738065 AYWYZPGZHRWBJN-QGZVFWFLSA-N 482.589 0.636 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)Cn3cncn3)CC2)CC1 1835807696 DAZYCHJHFHGFJK-GMXNISCNSA-N 497.604 0.620 50 20 JCGD O=C(Cc1cncnc1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837196331 AQCRECUOTXQDIO-UHFFFAOYSA-N 452.320 0.011 50 20 JCGD CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)no1 1837456056 BFAUUNODRISUAT-QFIPXVFZSA-N 472.502 0.180 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919155 KKTOYICQWSCGJF-UHFFFAOYSA-N 462.428 0.830 50 20 JCGD CCOc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838885521 XWMOJOUPVWRHTH-XMMPIXPASA-N 483.525 0.468 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)[C@H]1SC(=N)NC1=O 1839152294 VDSKSDZVBCMFCU-MIFHMHLRSA-N 481.402 0.482 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1Cl)CCO2 1839323750 HVKAXESMTJSLHO-JOCHJYFZSA-N 491.907 0.861 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1 1840035198 JMIAKBRHHUQWOW-XIKOKIGWSA-N 452.309 0.811 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC[C@@H](C(=O)OC)C1)CCO2 1840148828 XSROFAZDANJCKL-PZTGFMGMSA-N 460.955 0.676 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccccc3OC)C2)C1 1840149482 QRWZIJKXNBEDNJ-KKSFZXQISA-N 456.923 0.784 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)C(=O)c3ccccc3)C2)C1 1840150336 IYLZJMXSSNSGLL-GCJKJVERSA-N 467.950 0.469 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3cnn4C)C2)C1 1840152367 GVFBPZVQPRONNB-DYESRHJHSA-N 450.923 0.897 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)[S@@](=O)c1ccccc1 1840186083 ZGRAZGRSDCCWHY-AZVZEQOLSA-N 494.614 0.012 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCOC1)CCO2 1840874445 IOOBJVZQAGCHRM-TUGUMKMLSA-N 461.519 0.003 50 20 JCGD O=C(Cn1cnc2cc(Br)ccc2c1=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841347971 GSLDVOPUGVVZFL-HNNXBMFYSA-N 483.750 0.962 50 20 JCGD COc1cc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc(C(F)(F)F)n1 1844683974 AFHFSOFXGMYVPE-UHFFFAOYSA-N 463.221 0.920 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1846330887 NDAYGKWIVZOVHE-KBPBESRZSA-N 481.999 0.118 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C2 1846385913 KIGJDVNHLORMLN-INIZCTEOSA-N 451.568 0.962 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](Cl)COC)C2 1847046107 XGBQANADDRQRKI-KGLIPLIRSA-N 461.943 0.900 50 20 JCGD CSc1nc(C)c(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c(=O)[nH]1 14236171 LFVBFAGKDMQVDM-UHFFFAOYSA-N 479.584 0.979 50 20 JCGD CCCC[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CNC(=O)c1cccs1 725741475 NTEBIUKESRZSFB-CQSZACIVSA-N 477.568 0.923 50 20 JCGD O=C(CNS(=O)(=O)c1cc(C(F)(F)F)ccc1Cl)NNC(=O)[C@H]1CCS(=O)(=O)C1 732307458 FLLNNVYMUHZKEI-QMMMGPOBSA-N 477.870 0.219 50 20 JCGD CC1CCN([C@@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 743333860 BIBJUJTZPAPADF-KRWDZBQOSA-N 467.592 0.772 50 20 JCGD COc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(OC)c1 746971263 VVQPYANTUSDLHQ-UHFFFAOYSA-N 492.554 0.911 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cnc3c(c2)c(C)nn3C)cc1 751260201 BAEPZOUDLUBRKP-UHFFFAOYSA-N 466.545 0.215 50 20 JCGD CCCn1nc(C(=O)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)c2ccccc2c1=O 822564761 TXFILEMIFGMREG-UHFFFAOYSA-N 462.466 0.933 50 20 JCGD COCCNS(=O)(=O)c1ccc(Br)c(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c1 860624831 GAWFMUCUELJKAX-LBPRGKRZSA-N 498.421 0.480 50 20 JCGD O=C(NNC(=O)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12)c1ccccn1 866668109 JTJRCROKHHTYSL-UHFFFAOYSA-N 457.468 0.431 50 20 JCGD Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1C 913154168 UBPAHCKFHVJVNE-UHFFFAOYSA-N 457.516 0.635 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=S)NCCN(C)C)N(S(C)(=O)=O)CC2 916125379 MLIRRHDXRXKMMR-HNNXBMFYSA-N 473.621 0.010 50 20 JCGD COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)[C@H]3CCS(=O)(=O)C3)CC2)c1C 919987543 YYJQTHYOYMRISQ-DTBYZMGXSA-N 498.627 0.319 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 920436373 ICZSWHYCJUWDJU-SWLSCSKDSA-N 470.548 0.015 50 20 JCGD Cc1c(NS(=O)(=O)c2ccc(C(=O)N3CC[C@H](B(O)O)C3)cc2)c(=O)n(-c2ccccc2)n1C 1331895157 JTUCEAVBCLSURS-KRWDZBQOSA-N 484.343 0.974 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1778057920 UKYVUMFTASKERT-QFIPXVFZSA-N 468.706 0.425 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c2n1 1779030244 LSBXOSDBOJVHOF-HSZRJFAPSA-N 478.513 0.102 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1779181210 YMXFLBPCRBDXLJ-FASAQXTFSA-N 458.346 0.661 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779216324 LDBPMODHSFHCAL-VWKPWSFCSA-N 484.985 0.876 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]cc3I)C2)C1 1779544863 MEBSLSZORAGLJK-BMIGLBTASA-N 482.706 0.712 50 20 JCGD COc1cc(OC)cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1780656868 KQEPZRALUMEXAI-QHCPKHFHSA-N 454.288 0.141 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3n[nH]c4cc(Cl)ccc34)C2)C1 1780945546 POAWYQOMCUXAHV-JOCHJYFZSA-N 476.965 0.962 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1 1781764149 NOCGDCNLSVCICS-NRFANRHFSA-N 457.223 0.171 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1781812462 DOJIWJSFZIGVGM-XOBIUNJKSA-N 471.470 0.381 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1 1781997409 UWRILRMJFYKUTO-ZOMKSWQUSA-N 468.414 0.612 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1782695616 RZGHKDCFVCVHFM-VQSMXTJRSA-N 460.579 0.928 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COCCNC(=O)OC(C)(C)C)CCO2)C1 1783881558 SACKGRITMFOVCR-MGPUTAFESA-N 463.959 0.611 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnc4ccccn34)[C@H]2C1 1784048776 DROWCVJXWFIMGH-WDSOQIARSA-N 456.547 0.230 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(F)ccc(F)c3F)[C@H]2C1 1784834280 YNALBQQXEIZKMK-YEWWUXTCSA-N 470.492 0.999 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4nc(O)nc(O)c4C3)[C@H]2C1 1785331306 RJVLXILIHOYNSK-RPVAFNKOSA-N 452.939 0.990 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@]3(F)CCCCC3(F)F)C[C@@H]21)c1ccc(B(O)O)cc1 1786979853 UPASXPBIUFMKIH-DBSRCYSRSA-N 468.281 0.877 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Cl)s3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980076 GKIBPYZGCHJVNY-WBAXXEDZSA-N 462.764 0.917 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(NC(=O)C4CC4)cc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981948 RRMHZLQEAHOEKB-VJBMBRPKSA-N 491.353 0.622 50 20 JCGD Cc1cncc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786984640 TXIVAHCOKWUKRW-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)N(C)C(=O)OC(C)(C)C 1786984802 LECZEPDXVDDGEJ-LQJIQPLVSA-N 489.378 0.215 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc2ccc(Cl)cc2nn1 1787358988 RRDLYMTYZLTJJQ-BPXKWBHBSA-N 494.744 0.870 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1788739800 NAAWSLWNWJLNJX-MEOCNFHCSA-N 474.562 0.405 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncon3)[C@H]2C1)NC(=O)NCc1ccccc1 1789088506 LBZVCXIKDFYALI-BZSNNMDCSA-N 471.518 0.009 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCN3C)C[C@@H]21)NC(=O)NCc1ccccc1 1789724794 NRSCCMFSQNVJSN-CMOCDZPBSA-N 486.617 0.407 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C[C@@H]21 1791251737 SXEZGCDGOBXDFN-VIQHNZTISA-N 477.002 0.462 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC(C(F)(F)F)CC1)C2)c1ccc(B(O)O)cc1 1795732863 NRGFNMBKIOAZFA-DPGWPDQOSA-N 468.281 0.938 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cscn1)NC(=O)NCc1ccccc1 1795802130 XFHZXVBXMRALEW-OPMZPASUSA-N 486.598 0.621 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NC(=O)c1ccccc1)C2 1796444498 WHVOUPSBMNRFBK-FTIUTAABSA-N 494.552 0.529 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1cc(C)cn1)C2 1796446134 MUQHTMXREFWLJL-DVVLQFQGSA-N 455.519 0.476 50 20 JCGD COc1ccc(-c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)n[nH]2)cc1 1796497611 PQBDHRMRKOWLBK-GPVSGQMNSA-N 484.557 0.662 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)cnc2c1 1797067445 IHTZYUVBWZXYRG-NOXHYTERSA-N 467.295 0.897 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1c(=O)n(C)c2ccccc21 1797171431 LIJQQSJZZUXIGK-ZTENYAIWSA-N 479.375 0.961 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)ccc1[N+](=O)[O-] 1801012307 UQLWYWAMEMYLFJ-YVWYUNDQSA-N 463.491 0.180 50 20 JCGD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1802107629 QNMYQJUBKIAARO-VVJJBPBLSA-N 454.343 0.127 50 20 JCGD O=C([C@@H](O)CCl)N1CCCC2(CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)CC2)C1 1805517319 BHKVKYZCXHEEKB-CJNGLKHVSA-N 452.939 0.824 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365838 ZGOGNVNYRKZZHE-KNQAVFIVSA-N 477.330 0.238 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807370436 FANONGPJOMMKHW-XTQVGHSUSA-N 473.342 0.977 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807376681 XEUKDCRSRMJLIE-OZOXKJRCSA-N 462.319 0.009 50 20 JCGD COCCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1808653408 QBUBGFOZCNBYSW-UGKGYDQZSA-N 477.330 0.238 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1 1810297683 CMJOCKGIWUWXEX-AUUYWEPGSA-N 462.470 0.209 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813074194 RBZRXXLFVLHMSI-CECAUBDESA-N 468.562 0.751 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1814169850 JEOLIQZFMAZBRV-AZUAARDMSA-N 467.331 0.670 50 20 JCGD NC[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccc1 1815159744 JMUSXUASVLOANM-ROUUACIJSA-N 464.356 0.791 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1)[C@@H](F)Br 1820937820 VJRGMHFVBXQJTA-IUODEOHRSA-N 450.309 0.379 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccc4ncnn4c3)sc2C1 1822501744 QENUXXNABBJUAZ-CQSZACIVSA-N 470.559 0.714 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3cnc[nH]3)sc2C1 1826567101 JWBBBPNUOAZGGJ-JRBALWBOSA-N 452.500 0.804 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1 1828831978 SZIPGWFXQKDQHA-QGZVFWFLSA-N 470.253 0.705 50 20 JCGD CCn1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c2ccccc21 1830723920 UVWKHQXWVVYJTM-DYESRHJHSA-N 450.923 0.726 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccc1O 1834045014 KTPYCYAURCYPIP-UHFFFAOYSA-N 451.332 0.571 50 20 JCGD Cc1scc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1C 1834538855 XKFRFWOIPYLYLR-JOCHJYFZSA-N 473.555 0.747 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3(C(F)(F)F)CC3)CC2)CC1)c1ccc(B(O)O)cc1 1834798647 URBFRWVTSGUREA-UHFFFAOYSA-N 467.297 0.894 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc4ncnn4c3)CC2)CC1 1835737845 HANWKUFDGHYYFC-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD CCSc1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835926587 TUIZHEVUIQTDAY-QHCPKHFHSA-N 485.371 0.257 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c12 1835931777 CDJRYKCQNRTXQI-VWLOTQADSA-N 493.325 0.240 50 20 JCGD O=C(C[C@H]1OCCc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934064 LQYTYRXLQIHMCW-ZEQKJWHPSA-N 494.353 0.141 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nc1 1836714882 AEBZGABJRORHFS-SFHVURJKSA-N 473.979 0.697 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCC4)CCO2)C1 1837088227 BXKLIVBERHXGOV-LIRRHRJNSA-N 455.353 0.930 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncoc4c3)C2)C1 1837459767 XFYFGCPRKFAOPR-QHCPKHFHSA-N 480.481 0.210 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1837836186 ZTDJYROMNRFZPZ-UHFFFAOYSA-N 465.560 0.561 50 20 JCGD COCc1c[nH]c(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1837919250 UPKSVKMIOBNOFG-UHFFFAOYSA-N 469.347 0.767 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1839243981 XETCMKUWVDMDJP-JXFKEZNVSA-N 455.895 0.535 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])cc1F)CCO2 1839278701 XWBWGRLJNVQPGZ-OAQYLSRUSA-N 481.481 0.177 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1[N+](=O)[O-])CCO2 1839357951 RYEWFVNXLCWQKJ-OAQYLSRUSA-N 481.481 0.177 50 20 JCGD O=C(c1c(O)cc(O)cc1O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839373017 RYGZHWOASMPUMG-RHSMWYFYSA-N 463.256 0.564 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839667407 NYKXLMNSBJKHIF-DJJJIMSYSA-N 459.330 0.460 50 20 JCGD CCN(CC)C[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839677188 IFGJQMYHELVCJG-PFUYJENESA-N 490.605 0.555 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC(=O)N3)C2)C1 1839743355 KTXRDJUDVVFIFB-ZGOLIUOYSA-N 474.464 0.607 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)cnc2s1 1840032606 DDVUIRLAUCNZEE-YJYMSZOUSA-N 499.387 0.918 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn2[nH]cnc(=O)c12 1840034305 HQDWDEMGWIMNOJ-ORAYPTAESA-N 482.335 0.184 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1 1840153679 XLJKMFYSFOKEKL-KUHUBIRLSA-N 463.865 0.567 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1 1840185010 DPYQQVIVXHHUAN-FQEVSTJZSA-N 453.927 0.178 50 20 JCGD O=C(c1ccc2nc(CO)[nH]c2c1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840187430 ABAKUYOIRKRPGK-LJQANCHMSA-N 457.314 0.929 50 20 JCGD COc1cc(Cl)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840743003 BEZHHHLYRJZIJE-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840798230 HEVTTZPOJUUDMZ-AVYPCKFXSA-N 496.026 0.299 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CCO2)C1 1840899372 KRKYOKAEUJKWED-WCYCAPIHSA-N 489.529 0.437 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc3cc(Br)ccn3n2)C1 1844148448 QFGUMCNVVLLYLB-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD C[C@@H](S)C(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1846368357 XSHXCMYPHHWQQP-QAPCUYQASA-N 491.419 0.324 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CCN1C(=O)OC(C)(C)C 1847157655 YPPWJTKCMISDFK-LPHOPBHVSA-N 471.363 0.829 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1 1847565512 SQGZGCOZCDIVBZ-LGNVQCELSA-N 457.955 0.812 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1 21191538 DHVIWDKGIORWAS-HNAYVOBHSA-N 491.522 0.216 50 20 JCGD O=C(Cc1ccccn1)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1 729535608 JIICTJXQGXSCRS-UHFFFAOYSA-N 467.467 0.868 50 20 JCGD COCCCn1c(S)nc2cc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)ccc2c1=O 730732697 NGQVXFDNDUBEGQ-CQSZACIVSA-N 454.574 0.828 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)C(=O)NC(C)C)c1 744447793 OLGBGMDPLZQCBU-UHFFFAOYSA-N 463.354 0.765 50 20 JCGD O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 745868051 VWAJNHCESIGYJU-UZLBHIALSA-N 499.549 0.017 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1cccc2cccnc12 747429164 ZAGAMPCOXIIUKZ-SFHVURJKSA-N 490.563 0.778 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1 747863180 CHBKCVBYTVWVPO-UHFFFAOYSA-N 464.548 0.397 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1 748246456 LEESXNBBYMFBCB-GJZGRUSLSA-N 466.560 0.745 50 20 JCGD O=C(NNC(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1 748718103 RFZGJCHMUDRUGH-SECBINFHSA-N 450.374 0.556 50 20 JCGD COCCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC 798148981 CFZYJFWVWOAKKU-UHFFFAOYSA-N 496.498 0.954 50 20 JCGD Cn1ncc2c(O)nc(CCC(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)nc21 829837001 WHRKACDKIVHMQY-UHFFFAOYSA-N 473.515 0.247 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1 916562095 KXZRLWNDOAAHIJ-UHFFFAOYSA-N 460.512 0.961 50 20 JCGD CC(C)N1C(=O)c2ccc(C(=O)OCC(=O)NNC(=O)c3cccs3)cc2S1(=O)=O 919540201 XYHGCDLSZSGSSU-UHFFFAOYSA-N 451.482 0.919 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F)N[C@@H]1CCS(=O)(=O)C1 919886594 SNMJJUQAXUSMQO-YPMHNXCESA-N 460.459 0.410 50 20 JCGD O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 921019974 OQNTVEKORHDNMA-MRXNPFEDSA-N 452.514 0.353 50 20 JCGD CCOc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1OC 1779034679 SKQADUWZFJUXNX-VWLOTQADSA-N 497.552 0.779 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)C(C)(C)C 1779371508 WLGDANVYJJGIGS-YDIMBITNSA-N 488.589 0.363 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1781242158 JQBZBHSYBDMHCU-HSZRJFAPSA-N 459.547 0.445 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3c(F)cccc3n2)C1 1781319997 GCBZJUKDBHQUBW-UZUQRXQVSA-N 474.537 0.974 50 20 JCGD O=C(Cn1cnnn1)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783021731 AFHZGDRWSJLHAV-LPHOPBHVSA-N 463.336 0.509 50 20 JCGD O=C(Cc1cccc([N+](=O)[O-])c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1783436758 RAYGBCWZYDJZDX-YYWHXJBOSA-N 467.287 0.111 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783934390 GEQSSGNECHUXNC-QHCPKHFHSA-N 459.547 0.219 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ncc[nH]3)C2)C1)NC(=O)NCc1ccccc1 1784269132 FKECWMANXHHWGM-XMMPIXPASA-N 483.573 0.518 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785076519 OWFUZGGDHUIKJX-QMHWVQJVSA-N 490.001 0.545 50 20 JCGD O=C(c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2 1785245626 NGRMEOQLKZWUOA-YLJYHZDGSA-N 489.953 0.685 50 20 JCGD COC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786424151 USXAELQMVGQLNT-UFYCRDLUSA-N 489.573 0.266 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)c(F)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978690 LNLCPZRUNFTRDO-JLMWRMLUSA-N 472.297 0.871 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978710 MVKYSVNXMSOOLW-CZIXKKEKSA-N 466.318 0.903 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4[C@@H]3O)C[C@@H]21)c1cccc(B(O)O)c1 1786982843 IVBZWRGIDOPDMS-GXWFBMCDSA-N 478.354 0.256 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(Cl)nc2n[nH]cc12 1787236637 PQTKKMPITXZBBU-KKXDTOCCSA-N 483.721 0.198 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]nc4ccncc34)[C@H]2C1 1787339443 KODPGSNRGSIPDA-VOSSUDFCSA-N 478.513 0.685 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)ncn3)C[C@@H]21 1787508866 XYUCXIIYFKVXOY-IOMCNPASSA-N 473.921 0.857 50 20 JCGD CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CS(=O)(=O)N3CCCC3)cc2)CCC1 1788641806 UZSHSDIGVYCULY-UHFFFAOYSA-N 479.603 0.919 50 20 JCGD CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1793449846 OGSKYIYHNRUFFC-YYIAUSFCSA-N 450.001 0.655 50 20 JCGD CC[S@@](=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793880381 XLSINXJEEZYQJF-YEQXBCCHSA-N 480.027 0.867 50 20 JCGD COc1cc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)ccn1 1793900276 YXCXTURVAWWLAS-ZMQIZJGTSA-N 482.541 0.746 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1795533094 LRDZKCQQKYNPFO-OREBXVKISA-N 481.391 0.175 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1 1795732952 RTUURBNUUZOORW-PHXJMUFTSA-N 464.327 0.382 50 20 JCGD Cc1ccc(SCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1797123414 HJKGHIHQNMXYDU-OPMZPASUSA-N 454.357 0.670 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ncccn2n1 1797379821 ISTYCSKPRISUSN-DHMDNZFNSA-N 464.486 0.067 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@@H]1CCCCO1)C2 1797751806 SNNWATXIKHZYJR-GTYSZEQSSA-N 463.560 0.148 50 20 JCGD CN1CCCn2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)cc2C1 1799347486 QKTRHDQIGISLQE-NOXHYTERSA-N 458.332 0.612 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1799417428 HBDSLHVSAITDGR-IRJINJETSA-N 497.600 0.505 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1C(=O)C=CC1=O)C2)NC(=O)NCc1ccccc1 1799865897 PJIQXFOAHBDZGV-ACDBMABISA-N 496.568 0.286 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1)C(=O)C(=O)O 1800437187 RXIOOQORJGQSON-DFGXFYAUSA-N 496.358 0.125 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(F)c1F 1800665629 CQSSXBJBZNXTHM-VTEUUUEMSA-N 459.453 0.409 50 20 JCGD COc1ccc([C@H](O)C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1 1802799968 ZHJCFWCGCBWJNE-ZTCOLXNVSA-N 489.337 0.823 50 20 JCGD C[C@](O)(C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(F)(F)F 1803991296 YDTGTVPDRHQRQN-KNBMTAEXSA-N 465.237 0.394 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360584 LHWTUXSCKZBZGM-QAPCUYQASA-N 479.220 0.187 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807364097 HRAABMHWJQHVFP-GCJKJVERSA-N 467.331 0.813 50 20 JCGD Cc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1807365411 XOJLVQJMEFXVNO-OXQOHEQNSA-N 451.267 0.565 50 20 JCGD CN1CCC(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1807367097 XGGFNPCBLLPLFK-RBBKRZOGSA-N 450.348 0.423 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807372973 LIIWIZBKLKRMHU-BPAFIMBUSA-N 469.303 0.643 50 20 JCGD CC(C)CNC(=O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808446707 BHPHUHPOHQUJSO-QFBILLFUSA-N 467.530 0.172 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1810240273 YOMKYNNFWDVTKP-QUYDJYOZSA-N 496.572 0.929 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810294327 JEDIXSBGBBGNIO-KKVAFCGZSA-N 467.530 0.314 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1 1811366713 PZFAOOFTLQSSHC-JTSKRJEESA-N 454.531 0.473 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1 1813069840 CRCFWSVFHUOBKM-MGPUTAFESA-N 469.502 0.262 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1CCC(O)CC1 1813193623 HTDXTHAPMQFYGI-CYGMFBECSA-N 451.332 0.632 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc3ncccn23)[nH]n1)c1ccc(B(O)O)cc1 1817471929 XDMXPUBTGRZCDX-QGZVFWFLSA-N 459.275 0.752 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1)c1ccc(B(O)O)cc1 1817474931 JHKLWJXUPQBACN-CQSZACIVSA-N 467.213 0.074 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4ncccn4n3)sc2C1 1819015669 ALSQVCLMSCFCFB-GFCCVEGCSA-N 456.532 0.785 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3ccnc(Cl)n3)sc2C1)c1cccc(B(O)O)c1 1820463198 VGDQZBNVCCZTLQ-LBPRGKRZSA-N 457.708 0.806 50 20 JCGD CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1)NC(=O)NCc1ccccc1 1820710994 IKTKDQXWWGIJNI-SFHVURJKSA-N 495.548 0.435 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822410407 IYDWZNPFJQHRSB-UKRRQHHQSA-N 456.569 0.456 50 20 JCGD O=C1C[C@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCN3C(=O)OCc2ccccc2)CN1 1828551851 WKHLLJBILULZJG-BSRJHKFKSA-N 492.960 0.174 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3nncn3c2)CC1 1828641947 CCDJOPKXDKWQEC-NRFANRHFSA-N 461.331 0.956 50 20 JCGD Cc1noc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)n1 1828927009 XSHGXUOJSCJMHT-GOSISDBHSA-N 455.519 0.853 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1829030093 POXHZHPLCSSMAW-PXNSSMCTSA-N 487.605 0.588 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CN1CCSCC1)CCO2 1829709725 DBZPELFXYWSMDN-QGZVFWFLSA-N 450.399 0.277 50 20 JCGD COc1ccc2nc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2c1 1830727892 JQVXQROMTCGMOJ-SIKLNZKXSA-N 463.918 0.913 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C1)CC2 1830736918 XUFYKKXGELJVRR-BOCKYXSRSA-N 466.962 0.856 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1 1831280799 BIBMUVQEVZCQFN-VQTJNVASSA-N 462.377 0.177 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnncc2C(=O)O)CC1 1831873116 AMKQEQZXVYXOEU-GOSISDBHSA-N 460.535 0.781 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1832208201 IKLVHTQWAADELW-FUHWJXTLSA-N 470.299 0.578 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC1CCN(C2CCN(C(=O)C3=NNC(=O)C3)CC2)CC1 1833727069 ZEJSAIMNPPUFKZ-KRWDZBQOSA-N 499.012 0.566 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1scnc1C1CC1)CCO2 1833732134 OEDNZGMPVXRJSZ-NRFANRHFSA-N 465.576 0.464 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3)CC2)CC1 1834191574 SIVCUAZBRTUYKL-JVWAILMASA-N 468.562 0.739 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3(c4ccc(O)cc4)CC3)CC2)CC1)c1ccc(B(O)O)cc1 1834798114 SUFGCRJMTRETAR-UHFFFAOYSA-N 491.397 0.989 50 20 JCGD N#Cc1ccccc1OCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834800430 GWJIVYUFIMMXKW-UHFFFAOYSA-N 490.369 0.502 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834823143 LEBZXHOQQBCBQT-KBXCAEBGSA-N 456.341 0.518 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]n3)CC2)CC1 1834950211 PJCGJHQRIGEEPZ-VULFUBBASA-N 455.523 0.124 50 20 JCGD Cc1ncoc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737157 PTRXXFPZKJRXRA-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnc4[nH]ncc4c3)CC2)CC1 1835737844 GZGNBKAKRHFZLM-UHFFFAOYSA-N 491.556 0.455 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836718476 ZAIWMVHIZXAOHO-MSOLQXFVSA-N 492.013 0.860 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3[nH]ccc3n1)CCO2 1836905722 VRHRMSBCXPOMFF-SWOYFSSUSA-N 493.524 0.767 50 20 JCGD Cc1cccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837456949 UAYFTINHOGZGMG-DEOSSOPVSA-N 482.541 0.091 50 20 JCGD CC#CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1837612865 OGQFDDUCJOBLSA-IGKIAQTJSA-N 490.365 0.634 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1 1837920034 DUGGYMXFAUBCHR-TZIWHRDSSA-N 497.401 0.380 50 20 JCGD Cc1nccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1837920155 FLFHLQFGVBKVRK-UHFFFAOYSA-N 452.320 0.391 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921126 CHFZKAKCNBZGEN-OAQYLSRUSA-N 458.364 0.552 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@@]3(F)Cl)CC2)CC1 1837922157 RNNWQANWSWXIOU-RXVVDRJESA-N 452.719 0.903 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1=Cc3ccccc3NC(=O)C1)CCO2 1838446200 ASJBELQLDAMSRE-VWLOTQADSA-N 499.568 0.242 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049412 WIZJSNYVCCGSHV-VQTJNVASSA-N 470.357 0.965 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C3CC3)C2)C1)NC(=O)NCc1ccccc1 1839054008 BJROZHFINSGITH-YHZGQTRVSA-N 485.585 0.755 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)NC(=O)NCc1ccccc1 1839054142 IQODYDJIQKPJPC-RXVVDRJESA-N 485.944 0.323 50 20 JCGD CCOc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1 1839198103 SYMIHAZMIRQKPZ-YOEHRIQHSA-N 461.288 0.636 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)c(F)cc1F)CCO2 1839262969 KTIOQZFNMQKWSX-JOCHJYFZSA-N 494.687 0.682 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622601 LMKXNNAFSDWYEC-UWJYYQICSA-N 498.422 0.962 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839935117 DNYFCKVUEHREIF-RUZDIDTESA-N 481.553 0.615 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)nn3)C2)C1 1839965944 PMPUPAVBUGBXSW-UGSOOPFHSA-N 457.325 0.729 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3C1)CCO2 1839991163 KQSFDSJKDNKKHB-GJZUVCINSA-N 478.354 0.242 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc2)CC1 1840774011 HWQITGCGUSWRMM-ZJSXRUAMSA-N 495.020 0.498 50 20 JCGD CN(CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)C(=O)OC(C)(C)C 1840910488 BTQBODIWPSZJSN-IERDGZPVSA-N 477.986 0.690 50 20 JCGD O=C1C[C@@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CN1Cc1cccs1 1841978768 ZLRYSTSZAJPPLT-QGZVFWFLSA-N 467.356 0.294 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)[C@@H](F)C1 1843013224 WIINRGZLARMGLI-MOPGFXCFSA-N 489.353 0.779 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)C[C@@H]2C1 1846105262 JTEUHEILWICWBJ-CJAUYULYSA-N 483.374 0.831 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2 1847090506 YZSXSEJOBOTRQH-JQWIXIFHSA-N 465.320 0.649 50 20 JCGD CN(C)N(C(=O)c1ccc(Br)c(S(=O)(=O)N(C)C)c1)[C@@H]1CCS(=O)(=O)C1 728178605 DLCJWUIKVLRZQH-GFCCVEGCSA-N 468.395 0.805 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cc3ccc(-n4cnnn4)cc3)cc2)CC1 728213517 DDUWIUUSVXIDTK-UHFFFAOYSA-N 456.532 0.284 50 20 JCGD COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)COc2ccccc2O)c1 730811905 HLWZANKZWNQMIU-HJWRWDBZSA-N 466.468 0.984 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNC(=O)c3cccn3C)CC2=O)cc1 747599198 PWFYURUYLYWPMK-OAHLLOKOSA-N 461.544 0.870 50 20 JCGD CC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 750301799 UMDKSAYTIRAEGB-RXVVDRJESA-N 480.477 0.746 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNc2nc3ccccc3c(=O)n2C)cc1 752906086 FCLKVUPMDVNGJE-UHFFFAOYSA-N 458.500 0.704 50 20 JCGD O=C(COC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)[C@@H]1COc2ccccc2O1 793940251 FBBUYUQZCUONBB-APWZRJJASA-N 453.451 0.566 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2c(Cl)nc(N)nc2N2CCOCC2)c1 873993903 YFGWRLSNNOXGFY-UHFFFAOYSA-N 467.939 0.563 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)c1 903881013 AUONOCAJXDRLCW-UHFFFAOYSA-N 482.540 0.785 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCN3CCOCC3)c2)cc1 912851755 CDKNMLJMBRRWDF-UHFFFAOYSA-N 462.528 0.979 50 20 JCGD Cc1noc(CCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 914839408 SRZGUHLKUASGMP-UHFFFAOYSA-N 451.505 0.112 50 20 JCGD O=C(CCNC(=O)c1cc(F)ccc1Br)NNC(=O)[C@H]1CCS(=O)(=O)C1 916374337 UHSXDDLDHZPWJO-VIFPVBQESA-N 450.286 0.290 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C(=O)O 917721047 OFLFJLGKTITZBV-UHFFFAOYSA-N 471.513 0.332 50 20 JCGD O=C(CCNC(=O)OCC(F)(F)F)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 918758989 LFLSPBMGWNPIQC-UHFFFAOYSA-N 466.438 0.911 50 20 JCGD Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)cc2)cc1 929085975 MWYCOEKSSOXPQW-UHFFFAOYSA-N 482.522 0.718 50 20 JCGD C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 1262595971 NPLVQYWCSUMBHL-GOSISDBHSA-N 489.598 0.319 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CNc3ccccc31)CCO2 1779030481 AUTKGBSBRYDBKI-MBSDFSHPSA-N 450.499 0.338 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779031633 UYEFXINYZMQYDM-OAQYLSRUSA-N 458.906 0.799 50 20 JCGD C/C(=C\c1cccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779033741 CRAVBNCGUQPMAT-LJJIPZOBSA-N 450.499 0.627 50 20 JCGD N#Cc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1Cl 1780191737 LFCZNPSWHFTAJT-QFIPXVFZSA-N 453.691 0.649 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn(C)n1)C2)NC(=O)NCc1ccccc1 1780559024 UGIPQCFYAQXCRM-PXDATVDWSA-N 497.600 0.894 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)[C@H]1CCCS1(=O)=O 1781656155 YJVIVXJJYQBWLH-NFFDBFGFSA-N 455.346 0.768 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1782162632 FRXAIIZSSNLWFR-DEOSSOPVSA-N 475.314 0.013 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccccc3n(C)c1=O)C2 1782214109 CRXQBHKWHPEUEB-KBMIEXCESA-N 498.584 0.434 50 20 JCGD COC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccccc1 1783877427 PMLPZPCSZOTYIS-KFGODFMUSA-N 453.923 0.663 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2)C(=O)C1 1783935035 MTZKWRFCHGXAHA-XMMPIXPASA-N 484.557 0.616 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3c(c1)NC(=O)CC3)CCO2 1783937306 RMRNNDOPKBGJCL-QHCPKHFHSA-N 457.531 0.388 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)[C@H]2C1 1783996388 YRHBRLYHZTVYBV-QMHWVQJVSA-N 463.959 0.106 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCNC(=O)C3)C2)C1 1784037339 DOJLTBJYZBPDRK-QRQCRPRQSA-N 474.470 0.490 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)C1 1784092066 GPOSQBPAFGPSLZ-QQCJEOGWSA-N 489.997 0.184 50 20 JCGD C=CCO[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1784504095 KVWFCIBMGWMLMB-GBAJDQEWSA-N 487.601 0.903 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cnnc4)cc3)[C@H]2C1 1786769755 SJESYSZDYZCTET-IHPCNDPISA-N 469.546 0.234 50 20 JCGD O=C1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](Br)Cc4ccccc4)C[C@@H]32)=NN1 1788557732 PBSBHHCOPCFEDX-CUSZFKRNSA-N 477.359 0.848 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS[C@@H]3CCCCO3)[C@H]2C1 1788644512 MGYGKLJDMMLZCI-PRIDNEQBSA-N 477.587 0.538 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)Cc3ccccc3)C[C@@H]21)[C@@H]1C[C@H](O)CN1 1789766354 WYKGOXJQZLYHJI-OROIIQQLSA-N 480.403 0.695 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cc(C)on3)C[C@@H]21 1790960457 HWXXVGCGBKOMJU-YXWQFLTLSA-N 471.352 0.866 50 20 JCGD COC(=O)c1ccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1 1792341935 SJSPKXWDKGIJCE-IHPCNDPISA-N 490.557 0.205 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)N1C(=O)OC(C)(C)C 1792432173 NBVLXRMGVMBFIF-CURYNPBISA-N 495.621 0.737 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793066510 XIDVKFLQKQWGMS-MQFRRQCYSA-N 493.369 0.168 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)C1 1795113246 QFPRTLIIGIDULZ-IVSAIRAKSA-N 490.395 0.997 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C#N)CC1)NC(=O)NCc1ccccc1 1795411560 YAUOMIAUROOQES-OPVJXMOQSA-N 454.531 0.226 50 20 JCGD Cc1occ(C(F)(F)F)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734117 DLVDDKFMUGGYBB-ZSBFGKGUSA-N 466.221 0.804 50 20 JCGD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[S@](=O)c1ccccc1 1796192961 FLLPKXQSEXXNGU-SNTIRWHOSA-N 454.357 0.815 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)OCCO2 1796791070 GSMILHJMPLIVQF-CHHXSIHESA-N 481.509 0.795 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)nn1C(F)F 1797752871 KRSONFNFNWIHMU-DRXBFXEBSA-N 463.445 0.102 50 20 JCGD Cc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)n1 1799095446 XAJQHDOAHXKAAQ-GQEURGSBSA-N 494.596 0.868 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 1799198597 WNJJQXRECKXHCZ-IJOLSIAMSA-N 490.395 0.587 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1799318506 LDLXJRHPUCFGBM-UJCHZGTJSA-N 467.950 0.738 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C 1799354463 RIDMOPQKGDVHHH-RMEBNNNOSA-N 478.384 0.635 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)C=CC1=O)C2 1800332513 SIQMEOYNTPAVTP-CQCLGFCYSA-N 484.459 0.776 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)C1 1803141918 VVDBPSAPYGSEJN-GFEQUFNTSA-N 496.992 0.915 50 20 JCGD COc1cccc(CC(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)n1 1806909763 AXJIBHMRKRUBMO-UHFFFAOYSA-N 451.332 0.858 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1(O)CCC1 1807359138 FJKLCKOPZMNYKD-LKUPVBHCSA-N 451.332 0.632 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2cscn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365725 WFHKLSBFHAVFRG-LAUBAEHRSA-N 450.329 0.780 50 20 JCGD CCn1nccc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810298371 IALKMJMFUINOTB-OXQOHEQNSA-N 462.514 0.930 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)s1 1810302495 KNJFQKPNOSRZGF-QRWLVFNGSA-N 480.554 0.802 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1 1810490319 STHKZEXKHZDPAB-XXBNENTESA-N 497.600 0.761 50 20 JCGD COCCOCCOCCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1812931574 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CN1CCN(C2(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)[nH]n3)CC2)CC1 1820795547 SGPBQTOGRFCPHQ-HXUWFJFHSA-N 480.378 0.175 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)NC2)CC1 1823836741 GHJQOMRTTVDEBF-LPHOPBHVSA-N 456.547 0.445 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(CCO)CCO)CC2 1825451736 PWVUWMGYNSNEAM-NEPJUHHUSA-N 463.398 0.515 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057399 DPRVDFSVRADRPY-DYESRHJHSA-N 465.363 0.890 50 20 JCGD CC(C)CNC(=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1827703528 FHJZYVYAZDVEPH-LJQANCHMSA-N 458.563 0.691 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829051226 SFWMZILWAXCRKC-LAUBAEHRSA-N 453.352 0.528 50 20 JCGD CC(=O)N1CC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCN2C(=O)OCc1ccccc1 1829356085 KIAFVOPSAOFOFX-QHCPKHFHSA-N 459.547 0.831 50 20 JCGD Cc1ccc(F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830071724 VTMXDBHGRKRBPZ-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3OC)CCO2)C1 1830232061 RZMICJLUJSBUQD-IIBYNOLFSA-N 456.923 0.784 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)C2)C1 1830538952 WIGDQHYKERLGBV-OVSNFEJUSA-N 491.408 0.276 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)C(C)C)CCO2 1830870579 XKKVDDWJNVLYNM-SIKLNZKXSA-N 479.486 0.607 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831646217 IGAPERXHQWPGSK-NGONFYQLSA-N 467.954 0.984 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833397054 REVALRBFLCJDRM-XLIONFOSSA-N 473.979 0.963 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)CCO2)C1 1833609027 ACJHNMPBXHUGCV-VBKZILBWSA-N 472.926 0.486 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C3(C#N)CC3)CC2)CC1 1834599783 NXFXRYNOMYEGGK-JVWAILMASA-N 453.547 0.996 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(Cl)c3)CC2)CC1)c1cccc(B(O)O)c1 1834799778 AVHYIYHMIIUTDB-UHFFFAOYSA-N 486.765 0.619 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835819057 SVSIUEIWKIVYSS-INIZCTEOSA-N 487.605 0.175 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1C 1836033406 VBYKHIYXSSBENF-UHFFFAOYSA-N 482.589 0.480 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)N1CCN(C)CC1 1836374922 ISDHEEYSARXJIS-YJBOKZPZSA-N 476.435 0.884 50 20 JCGD CCOc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1O 1837460177 WYIYVFJPRBMLII-XMMPIXPASA-N 499.524 0.173 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)CSCC(=O)O)CC2)CC1 1838102815 BDVWNNGRZBPNQC-BUVRLJJBSA-N 493.586 0.937 50 20 JCGD CCc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)nn1C 1838274735 FLSPPKFVLTXQHM-DZQSVEARSA-N 485.545 0.187 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1838468915 SEOUCVFCGIVXBW-HRAATJIYSA-N 465.938 0.809 50 20 JCGD COC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528124 GKSKZUZOHUQTRF-JOCHJYFZSA-N 493.469 0.543 50 20 JCGD CC[C@H](NC)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528346 SHPODOGOLLMVHP-AVRDEDQJSA-N 478.502 0.588 50 20 JCGD Cc1nc[nH]c1C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054031 CPLZNEQWSAMKDM-XMMPIXPASA-N 499.572 0.134 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)CCOC1 1839191182 XVQRGMDXMXDLRL-WOJBJXKFSA-N 496.388 0.930 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(F)c(OC)c1F 1839416934 QSFSJEJMLRILCR-RNODOKPDSA-N 478.876 0.652 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4cc(C)ccn34)CCO2)C1 1839602316 ACYDRACEOXTJHD-KKSFZXQISA-N 450.923 0.967 50 20 JCGD CCNC(=S)NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1839655183 JPNNIGCVXBAUES-IAGOWNOFSA-N 455.408 0.163 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839661163 OJUAETXWEWKSQC-FDDCHVKYSA-N 461.563 0.090 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C2)C1 1840152239 BZKSVRGEAJEHDJ-HRAATJIYSA-N 475.970 0.564 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(Cl)ccc3F)C2)C1 1840183506 IHWAILMTALHZSV-FQEVSTJZSA-N 471.917 0.317 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc(F)c1F 1840187256 PNPJBJFPRCLECH-QFIPXVFZSA-N 468.501 0.716 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)[C@H]1SC(=N)NC1=O 1840187654 PDTWCQLOVIAYGM-YNHOBRIKSA-N 453.348 0.049 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)n1cnnn1 1840479689 FOFSCHIKOAFEOU-SJBPYACQSA-N 487.467 0.576 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(F)c1F 1840700702 AIBGUXQNAHCMRE-QHCPKHFHSA-N 474.269 0.337 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)CNCP(=O)(O)O)C1 1842875068 YLWQXSOUPRSZAW-HNNXBMFYSA-N 474.292 0.921 50 20 JCGD O=C(COc1ccc2scnc2c1)NCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847563843 QXFAZFKGMQPPIR-YESZJQIVSA-N 480.974 0.983 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1847940395 VBDKUTUJWODKRD-QYZOEREBSA-N 457.336 0.651 50 20 JCGD C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C2=O 25416522 HNYQZFNECJWRLE-FPTDNZKUSA-N 493.586 0.835 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1OC 109593989 UIBAFYMVOZWUKN-UHFFFAOYSA-N 479.559 0.998 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CC(=O)N(CC(F)(F)F)C3)cc2)CC1 728215214 WXLPATYHCZWGPX-ZDUSSCGKSA-N 463.482 0.477 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1cccc(C#N)c1 728872985 SKBGPAQNFCYUKA-QTJNJRLBSA-N 490.563 0.713 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CNC(=O)OC(C)(C)C)c(=O)n2Cc1ccccc1 742275704 IMKWAYRMYPBQRS-UHFFFAOYSA-N 499.528 0.100 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)n1 759672110 CENSQELZTONUMW-UHFFFAOYSA-N 454.530 0.280 50 20 JCGD Cn1cc(/C=C\C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)c(=O)n(C)c1=O 810546164 QOELXTKCIJUIMG-KTKRTIGZSA-N 489.535 0.421 50 20 JCGD O=C(COC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)NNC(=O)[C@@H]1COc2ccccc2O1 848978618 KIUVOSXGUNBZQD-XOBRGWDASA-N 497.460 0.341 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc2c(c1)OCCO2 912980533 MZFUMEWOWWDFPX-UHFFFAOYSA-N 453.498 0.522 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)[C@@H]1COc2ccccc2O1 913416766 RRUKTSGLFJTCTL-SFHVURJKSA-N 463.468 0.114 50 20 JCGD CCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c2ccccc2c1=O 913571580 SZKRGAJYGVWQRV-UHFFFAOYSA-N 454.468 0.028 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@@H](CN1CCOCC1)c1ccccc1 914598259 UAPUKNVCLDPTTA-KRWDZBQOSA-N 460.560 0.997 50 20 JCGD CN(C)C(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 916250156 NYTVOOKPDMMEKQ-UHFFFAOYSA-N 489.554 0.554 50 20 JCGD 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N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)CN3C(=O)C=CC3=O)CCO2)C1 1782866777 JABIVNFYRLEVKU-PNOMZVSUSA-N 470.432 0.627 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)C1 1783865210 XEZCBAKUOUYRHN-NXHTTZLHSA-N 473.530 0.108 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1N(C)C 1783935698 XLNDTTOYSPPJMZ-QHCPKHFHSA-N 461.563 0.578 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784084285 PJGMMFNGOOMNJZ-DWBZUHSKSA-N 473.954 0.144 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(F)c1 1786979692 LNSUNBSOPHUMAE-HARLFGEKSA-N 484.333 0.740 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)nc4n[nH]cc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786979944 RTHRYFITRDBGPG-KKXDTOCCSA-N 483.721 0.198 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21)c1nc2c(=O)[nH]c3ccccc3n2n1 1788080342 UWDGVMOTKKURIV-LWWSYDQCSA-N 462.869 0.699 50 20 JCGD 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O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1csc(Br)n1 1796689185 TUZHPQNICFSCOG-JJLQDPRZSA-N 480.149 0.102 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1797179275 KMKPQNAXXCIHBO-VPEYGQHGSA-N 459.971 0.823 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)C1 1797816276 CTLBIUFOVOPAHA-RSPOEFSDSA-N 471.363 0.875 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)C2 1797954625 ZLQQFJAFTFTCPZ-FAQVEIGNSA-N 489.649 0.463 50 20 JCGD C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1799277230 VWGVYWQTBFGBQL-QPWUGHHJSA-N 475.398 0.717 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(Br)CC1 1799357021 HFMDZOKBGWACHP-NECFCHHASA-N 466.336 0.638 50 20 JCGD Cc1cc2[nH]c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)cc2s1 1799946955 CELAXCHEQJIHOI-YVWYUNDQSA-N 453.329 0.735 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1800202711 BOCWDNHACWQMTO-QIRZIZBZSA-N 457.300 0.480 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C)C2 1801010585 JPDXWONWWLBELO-JUZZZCAGSA-N 495.621 0.642 50 20 JCGD CSCC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1801027290 PCFUUYQVSJAITH-QOIYZWAUSA-N 481.527 0.837 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1805304857 JCIPDSSVHDTQOU-KXBFYZLASA-N 478.513 0.456 50 20 JCGD COc1cnc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(F)c1 1807369648 RDICOAJPGKFTDC-VGOFRKELSA-N 478.289 0.938 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)N1CCN(C)CC1 1807864930 FZWNBLJDDXTAPA-ZWCUEREDSA-N 494.600 0.036 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1 1808370252 AZQJIJWAAXIKGJ-KBXCAEBGSA-N 458.479 0.406 50 20 JCGD 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CN(C)C(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828931737 IDKDHWQWUKVLLY-VGOFRKELSA-N 480.949 0.126 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1830370637 OKMHIKBFZYQUKP-SFHVURJKSA-N 464.009 0.568 50 20 JCGD Cn1c(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc2ccccc21 1830433524 TVFUCAYUFXOBIF-SANMLTNESA-N 491.353 0.171 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CC(O)C3)CCO2)C1 1830577112 SIWKKJNNVCFVFJ-NHQSFPBPSA-N 475.970 0.346 50 20 JCGD CN1CCCn2nc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)cc2C1 1831042716 FNJPWFNIAHVHHO-DEOSSOPVSA-N 493.417 0.946 50 20 JCGD CCOc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833019319 KRUOGQAJCFHOEF-UHFFFAOYSA-N 480.374 0.659 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1 1833033215 SWZAVLZIDIOUHU-IFXJQAMLSA-N 459.952 0.188 50 20 JCGD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1834129557 HOZLKUAIWHQZQR-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD COc1cscc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835231582 ZSETXISSYUNNKP-UHFFFAOYSA-N 471.388 0.936 50 20 JCGD Cc1cc(C)cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835940026 TUVLCZRDSWFISX-AREMUKBSSA-N 480.370 0.686 50 20 JCGD O=C(Cn1cnnn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1836150334 MPYMGASAIJIJEX-FXAWDEMLSA-N 493.362 0.136 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1 1836842887 DTITXWORDWLHLH-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1839151510 UUGAPRIZEWBIAS-RBUKOAKNSA-N 494.397 0.791 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(S(C)(=O)=O)ccc3F)C2)C1 1840154957 LOEPIHAJEOHRNO-OXQOHEQNSA-N 492.953 0.553 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840186067 YWXFTJSULFIHMY-FDDCHVKYSA-N 462.547 0.283 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc(C)c1O 1840676539 YNJZACXPKINILK-DEOSSOPVSA-N 483.525 0.391 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1840889922 QDUVKKVVGLMWEH-HOYKHHGWSA-N 452.316 0.240 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CCSCC1)CCO2 1840924510 RHMDADOQMGGRAP-OLCUMFGGSA-N 477.587 0.720 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)N1C(=O)OC(C)(C)C 1843012731 KBJIXOPYLODGOY-LPHOPBHVSA-N 471.363 0.971 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843013214 VLBKOSGLAUZKOO-UHFFFAOYSA-N 469.347 0.751 50 20 JCGD O=C1c2ccccc2C(=O)N1CCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1848087877 QTYOTUBJKPRFCB-SFTDATJTSA-N 475.310 0.258 50 20 JCGD Cc1c(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC(C)C)n(Cc3ccccc3)c2=O)cnn1C 10126661 XPYXFYDDVLFNMF-UHFFFAOYSA-N 492.540 0.567 50 20 JCGD CCC1(CC)NC(=O)N(CC(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)C1=O 10166510 NWJJQWOCMXBMNF-UHFFFAOYSA-N 454.867 0.763 50 20 JCGD Cc1sc2nc(CS[C@@H](C)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)[nH]c(=O)c2c1C 17642332 YZOMOIFVODKOCO-QWRGUYRKSA-N 458.587 0.805 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1)c1ccc(-n2cnnn2)cc1 22193215 GQHYUDUYCAWBHV-SFHVURJKSA-N 455.500 0.667 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1 107910930 UXTPBKPNDUPPHR-QFBILLFUSA-N 491.522 0.704 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CSCC2=O)c1 725896542 KNQKLAOWAFEYIA-UHFFFAOYSA-N 464.525 0.790 50 20 JCGD Cc1ccc(S(=O)(=O)NCCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 728330975 WJMLJGHIALGZPF-IBGZPJMESA-N 491.522 0.584 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)Cn2cc(Br)c(O)nc2=O)c1 728529077 RUUXANWPEDRZBR-UHFFFAOYSA-N 476.081 0.944 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1 729274971 IHVQPCNJVLIUKS-IHRRRGAJSA-N 490.604 0.061 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)o1 748271835 HPPLEROTGSUCON-WMLDXEAASA-N 477.495 0.761 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)C1=C(C)C(C)(C)OC1=O)N(S(C)(=O)=O)CC2 748555429 FQYISBJKNCQMKA-HNNXBMFYSA-N 495.554 0.752 50 20 JCGD CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 788006148 SZRPJVUMPKVWJM-SFHVURJKSA-N 491.522 0.908 50 20 JCGD CC[C@H](C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CCOC)n(Cc2ccccc2)c1=O 818032172 RXVVWIXUUDUSQP-HNNXBMFYSA-N 456.503 0.248 50 20 JCGD NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1 915884744 VTYOULOUXDPFGH-UHFFFAOYSA-N 495.583 0.653 50 20 JCGD O=C(NCCc1cn2ccccc2n1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916247212 IWOPPWGWKCROMN-UHFFFAOYSA-N 472.527 0.542 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNC(=O)c2ccccc2Cl)c1 916263407 AMKKTQRZOLEXEE-UHFFFAOYSA-N 467.935 0.964 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2S1(=O)=O 916744307 QCURGTRACWMVTI-INIZCTEOSA-N 461.452 0.079 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)cc2S1(=O)=O 916746370 OMDODADCLKPMGE-LBPRGKRZSA-N 465.459 0.845 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CC(F)(F)F)CC2)o1 918366952 ZTCSHKHFLNHKHN-UHFFFAOYSA-N 455.411 0.957 50 20 JCGD CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 919779036 MURKNMSVVNKLKF-LBPRGKRZSA-N 458.500 0.547 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1)N[C@@H]1CCS(=O)(=O)C1 919883259 BOYBLVBHHSQBGC-OAHLLOKOSA-N 458.562 0.382 50 20 JCGD COc1cccc(-n2c(C)nnc2SCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 919885007 MFFDRXLUOFRBCB-LBPRGKRZSA-N 454.534 0.194 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919886119 UTVZQAYZAHXVNB-QGZVFWFLSA-N 486.616 0.701 50 20 JCGD O=C(CN1CCCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 920087626 PJMUHRZEECOWOI-UHFFFAOYSA-N 461.500 0.752 50 20 JCGD Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(F)(F)F 1317877929 BWIISLFYRQUGAH-MRXNPFEDSA-N 477.469 0.497 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)c(C)n2n1 1777784284 FPWKPAFDDNZTHX-YOEHRIQHSA-N 455.288 0.875 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(F)c1 1778283630 DEXSDBJVGNJYEV-DEOSSOPVSA-N 470.306 0.590 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1778784907 AFIDGBYZHRHVLY-UWJYYQICSA-N 494.457 0.028 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)COC4)CCO2)C1 1779032709 WEQMZULVCKAJIA-QHCPKHFHSA-N 451.483 0.473 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(NC(=O)C4CC4)cc3)CCO2)C1 1779037085 MZTJTXYMEOIZDS-VWLOTQADSA-N 492.536 0.791 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CS[C@H]3CCCCO3)C2)C1 1779084715 RYSYJTSMVJJLSM-RXVVDRJESA-N 463.560 0.388 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccc(F)nc1)C2 1779371127 GPNQODZITYTQDC-NTKDMRAZSA-N 484.532 0.980 50 20 JCGD COc1cc(OC)cc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1780656581 CRKCUQHLASIKTH-HSZRJFAPSA-N 454.288 0.141 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCCO3)[C@H]2C1)NC(=O)NCc1ccccc1 1783613062 IJSUQGBOOZUUSH-KJJMTIBFSA-N 487.601 0.881 50 20 JCGD O=C(/C=C/c1cc(F)c(F)c(F)c1)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1783717999 DHLFWKHGWPODFX-DPRDVKHUSA-N 474.244 0.941 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CCN1C(=O)OC(C)(C)C 1783939853 MNZRCWHFFNDTGS-LLJLJFOGSA-N 495.621 0.835 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1785106248 SXFMAWUHARQRTC-QHCPKHFHSA-N 466.498 0.401 50 20 JCGD O=C(CCc1cc(F)ccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785236658 SBDNOONIUYOCBF-NDXORKPFSA-N 455.295 0.127 50 20 JCGD Cn1c(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc2ccccc21 1786978678 JYWLWLQIEQAQIG-APTRMMRNSA-N 475.354 0.694 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)ccc(O)c3F)C[C@@H]21)c1cccc(B(O)O)c1 1786985118 MZJZGKHKMZXCJU-YEWWUXTCSA-N 460.242 0.257 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@]3(F)CCCCC3(F)F)[C@H]2C1 1788172774 WQSQQGVYWAETKA-DBSRCYSRSA-N 468.281 0.877 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21 1788476551 ZARZXAUNRRIEMX-WAXWJJBLSA-N 492.479 0.916 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccccc3)C[C@@H]21 1788610598 JVILNUBDRJNACZ-SNRMKQJTSA-N 451.483 0.161 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1 1788762760 VFAANRLKQJWMSE-VYOPWZLOSA-N 463.611 0.952 50 20 JCGD O=C(CCN1CCOC1=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1789137573 ZBJJBGDLIZXOJG-UHFFFAOYSA-N 451.288 0.956 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1 1791055051 GSBMODHQHCZBOK-DGTMBMJNSA-N 454.387 0.077 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)[C@@H]1SC(=N)NC1=O 1796422628 NWUQROKHFITXEX-HKLHZYFVSA-N 461.382 0.409 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)c(Cl)c1)C2 1797751679 NYGNIWDYVFKILA-DRXBFXEBSA-N 479.324 0.904 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1797820972 SUWYOVUQIHQOCH-FFGOWVMKSA-N 471.363 0.875 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1 1797956379 STMVNNBZCUAHCD-FSNPWBFUSA-N 485.654 0.655 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)nc1Br 1798388257 BNCOTRDSYQDLKM-IQOUGMIPSA-N 462.728 0.656 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nn1C(F)F 1798679432 NVLRTGQWJNSAAT-SUGIQXKYSA-N 477.472 0.924 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1)N1C[C@@H]2C[C@H]2C1 1799097243 KZXNBVWLHMUWCE-XYJUKOTESA-N 498.628 0.262 50 20 JCGD CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2 1799273485 IQQXFCFGFNVGTL-YMSVYLFOSA-N 460.959 0.362 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cc(Cl)ccc13)C2 1801011668 VJRLLNVWPUXNJZ-DBWKPXFBSA-N 462.938 0.793 50 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Cc1nnsc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808648056 RVNQKVDZQSJNJT-RHSMWYFYSA-N 466.527 0.873 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccc4c(n3)OCCO4)CC2)C1 1809967080 ROWBIXPWFYSSHX-UHFFFAOYSA-N 465.315 0.691 50 20 JCGD CC(C)(C)[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810293227 AZHCXTIDEAWLBR-AYOQOUSVSA-N 454.531 0.807 50 20 JCGD CCOC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1812466445 MJSDBGZVPCRULJ-VQIMIIECSA-N 480.525 0.743 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C[C@](C)(O)CC(=O)O)[C@@H]1c1cccnc1 1813065330 KIEKZJIFIVWHDL-GYXRGIKLSA-N 498.540 0.837 50 20 JCGD Cc1nc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c(=O)[nH]c1C 1813070763 LPXDCWVAQFFJQA-UWJYYQICSA-N 469.546 0.474 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813074198 RBZRXXLFVLHMSI-ZJBJCVSYSA-N 468.562 0.751 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 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CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737664 GOKFUKDRCFAPKR-GRJRYPSTSA-N 487.981 0.440 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2 1832219793 QAXZTYNFWHSXKF-NZQKXSOJSA-N 456.279 0.147 50 20 JCGD CC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549489 RVXNAMGNONIYCT-KKSFZXQISA-N 475.970 0.944 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(OC)n3)CCO2)C1 1832826961 ZZXBDXBPSWAOGI-UWJYYQICSA-N 455.939 0.733 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1833497076 WUVJAOIQLWDXNB-GTNSWQLSSA-N 457.281 0.028 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnnc(Cl)c3)CC2)CC1 1833891843 GYRIIXDMRWUJST-UHFFFAOYSA-N 486.964 0.628 50 20 JCGD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1834129674 UHGYDCUXTUWIEK-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD CN1CCN(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)CC1 1835402346 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1837919306 WYEXGWIJPAIRHY-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD CN1CCN(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CC1 1838286630 QGUQRCJWLSPJON-GOSISDBHSA-N 463.392 0.923 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202725 NUORXRZFSMAFCW-AEFFLSMTSA-N 485.347 0.203 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cc(F)c(F)cc4[nH]3)C2)C1 1840184341 HNIKFIOPAQEUQH-HSZRJFAPSA-N 493.511 0.889 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)C1 1840218781 PADUQNAQMSJPST-VHKYSDTDSA-N 479.933 0.349 50 20 JCGD C=C1C[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)N(C(=O)OC(C)(C)C)C1 1840252566 XVWYSQRDQIZVJI-JKSBSHDWSA-N 487.981 0.608 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840427029 RZGRBKVIKMEKBT-YEWWUXTCSA-N 460.300 0.996 50 20 JCGD COc1cc(CC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc(OC)c1OC 1841785951 SFPSQPIAITYMEG-UHFFFAOYSA-N 462.547 0.831 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCn2c(=O)oc3ccccc32)C1 1841988041 OOOMJBUBRFZELQ-UHFFFAOYSA-N 464.482 0.500 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)C[C@@H]2C[C@@H]21 1847573398 YHYHBUWTTBLCLE-JBDAPHQKSA-N 469.347 0.580 50 20 JCGD CS(=O)(=O)CCNC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O 729157103 URIKQGJZHBCEIA-UHFFFAOYSA-N 486.597 0.024 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 729276976 QEFYWFISQPENKM-CQSZACIVSA-N 482.584 0.326 50 20 JCGD Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2=O)c1 730767948 UMFRRENCMIBBDB-QGZVFWFLSA-N 462.466 0.908 50 20 JCGD COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)C(=O)N3CCCC3)c2)cc1 748245978 BIHRRUKOESBGNK-UHFFFAOYSA-N 460.512 0.904 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)cc1 750716995 VJYJOZCWICHOOZ-UHFFFAOYSA-N 472.520 0.587 50 20 JCGD Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nnn1-c1cccc([N+](=O)[O-])c1 818795992 SYLSOYLSYLITMS-UHFFFAOYSA-N 473.471 0.809 50 20 JCGD COCCN1C[C@@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1=O 914462333 LDECMDKRBTULFW-IBGZPJMESA-N 463.498 0.644 50 20 JCGD CN(C)S(=O)(=O)c1c[nH]c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1 915062788 GXHVZCXMNXONES-UHFFFAOYSA-N 483.572 0.514 50 20 JCGD O=C(NCCCOC[C@H]1CCCO1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916209344 KBFPRJJAPFSLLN-QGZVFWFLSA-N 470.548 0.237 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1 919474537 QPMXUUVVEBATMJ-HNNXBMFYSA-N 471.532 0.602 50 20 JCGD C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 919885803 RMCURLXQVIMJDH-HIFRSBDPSA-N 458.562 0.381 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1778380169 JABMKEUAOOWSFX-DJJJIMSYSA-N 468.352 0.491 50 20 JCGD Cn1ncc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)ccc21 1779031779 FTLHITNKTQDSGN-QHCPKHFHSA-N 463.498 0.329 50 20 JCGD CSc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1O 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O=C(C[C@@H]1OCCc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784398139 OESDXBCEVWQKDS-HCUBDLJJSA-N 478.354 0.664 50 20 JCGD COc1ccc([C@H]2C[C@@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1784429216 DMLGXSBKGTYORD-GXWFBMCDSA-N 478.354 0.772 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCn3ccnn3)C2)C1 1784532724 AHZPUYHEXDJGSH-OAQYLSRUSA-N 472.458 0.645 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2 1785575790 CQXUWVUERBQKHN-VWKPWSFCSA-N 457.955 0.987 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)C2)C1 1785726374 ZYQMZDCSQUQZNQ-CKJXQJPGSA-N 475.970 0.706 50 20 JCGD Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(C(F)(F)F)o1 1786982926 IBVIRUNDGBZKHZ-BPUTZDHNSA-N 481.236 0.589 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788142141 DWEZIXKNDKHGSF-HXUWFJFHSA-N 453.304 0.265 50 20 JCGD 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O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Br)cn1 1798031623 YPJYURCQLZMDAT-ZSBFGKGUSA-N 474.120 0.041 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)C(=O)OC(C)(C)C 1798439319 VXGRBXCFGOLSGP-QDMKHBRRSA-N 460.535 0.804 50 20 JCGD Cc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1[N+](=O)[O-] 1799328540 LMJLBCUKSMAWCI-OPMZPASUSA-N 467.287 0.029 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1 1805269693 WWNQQDCOPXAFHS-KUHUBIRLSA-N 462.470 0.209 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807363135 BDVGMUNSJFOVLU-UGKGYDQZSA-N 461.331 0.745 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(=O)c2ccccc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371209 RCXQMCIYNANFBG-IRLDBZIGSA-N 457.295 0.964 50 20 JCGD O=C1CN(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)C(=O)N1 1808651548 OIDADFSFXUUGEU-DFBGVHRSSA-N 456.272 0.330 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc2ncccn2n1 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CN(CC(=O)N[C@H]1CCc2nc(NC(=O)C3=NNC(=O)C3)sc2C1)NC(=O)NCc1ccccc1 1819670368 QAMGIESRVQCDFH-AWEZNQCLSA-N 498.569 0.277 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=N)N)CC2 1821304800 SEHIDRIACNZSDI-JTQLQIEISA-N 475.487 0.685 50 20 JCGD C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCS(=O)(=O)CC1)CC2 1825635457 GURNKVCPQWAPFX-MNOVXSKESA-N 479.422 0.569 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nn(C)c3c1CCC3)CC2 1826086036 LOQVILHIKUIUPQ-GFCCVEGCSA-N 459.576 0.964 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1 1829023833 BJXSQRTUCSQBQI-QGTPRVQTSA-N 451.955 0.814 50 20 JCGD NC(=O)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1 1829476744 VVALIDQFUZPXHS-OXQOHEQNSA-N 469.901 0.641 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1830539053 ZWAXMAQVVYWGOB-VLIAUNLRSA-N 484.347 0.954 50 20 JCGD O=C(CCc1nc(-c2ccc(F)cc2)no1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726692 TZLDVKFAGFVYAH-HTAPYJJXSA-N 496.923 0.864 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(F)c1)CCO2 1831899814 CDJLPOARGOYART-WGLQLPMYSA-N 472.477 0.425 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1833425627 LBFZXHJWAFMGNH-HXUWFJFHSA-N 454.549 0.200 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccn1)CCO2)NC(=O)NCc1ccccc1 1833988561 WKRQXJCMBIPTGV-RUZDIDTESA-N 496.568 0.498 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C(=O)c3ccccc3)CC2)CC1 1834382956 YAADLHDRZBCTHS-UHFFFAOYSA-N 478.553 0.753 50 20 JCGD COCC(=O)NC1CCN(C2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1834476363 OZEGVXNDVDXRKD-UHFFFAOYSA-N 474.606 0.551 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3(Br)CC3)CC2)CC1)c1ccc(B(O)O)cc1 1834798440 WHMKXKKKCBDOIQ-UHFFFAOYSA-N 478.196 0.479 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834824756 LRWLDXUISKGXTL-KBXCAEBGSA-N 480.356 0.071 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1834859636 PBCIFPACBHRHCB-UGKGYDQZSA-N 468.934 0.714 50 20 JCGD CC#CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835930658 SNJIQCJVVGBVTF-IGKIAQTJSA-N 490.365 0.634 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2 1836623923 AYEFFKPBWOEMGJ-LEWJYISDSA-N 484.280 0.354 50 20 JCGD O=C1NC(=O)[C@H](CC(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)N1 1837116041 XPHYKFOAHAURSG-AWEZNQCLSA-N 459.341 0.368 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1 1838051633 NMPPIUMLDJSOIT-QVKFZJNVSA-N 463.922 0.796 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN(C)C(=O)C(=O)O)CC2)CC1 1838729190 RHRAMMGJBRDZFN-OAHLLOKOSA-N 476.368 0.702 50 20 JCGD C[C@H](NC=O)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839743914 DOVWDFWZDQXBLM-CZPMCIAXSA-N 462.453 0.463 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839988492 SWQVMDDAAZRNKP-DYVFJYSZSA-N 468.320 0.658 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(F)c1 1840074534 YFVLNWMXQZSHOV-VQEXNLMWSA-N 498.316 0.298 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C2)C1 1840154343 TVDWFYVOBGXGMH-SBUREZEXSA-N 489.960 0.894 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3OCCc4ccccc43)C2)C1 1840182955 XLOQJGXPQRCJIK-OFVILXPXSA-N 488.585 0.520 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)on3)CCO2)C1 1840367678 FFLKBDAHUWQXKB-ZHNJOBQTSA-N 472.502 0.116 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)ccc1[N+](=O)[O-] 1840757157 QNAAGQPAFYHYLQ-DNVCBOLYSA-N 457.867 0.273 50 20 JCGD Cc1cc(Br)cnc1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1842558647 JVBNZBQWYHPMJJ-UHFFFAOYSA-N 458.121 0.963 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])C1)NC(=O)NCc1ccccc1 1843389388 MLHKKLWDRKPMJO-UHFFFAOYSA-N 470.490 0.481 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cccnc1C(N)=O)C2)NC(=O)NCc1ccccc1 1845038491 ISIXWCGCCJORSC-UHFFFAOYSA-N 479.541 0.344 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@H](O)c2cccc(Br)c2)C1 1845041670 ZFKFNNBQJXAYAS-QGZVFWFLSA-N 488.342 0.998 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@]12COC[C@@H]1CN(C(=O)OC(C)(C)C)C2 1847292349 SWSFOOQWXXBWIQ-KOAQGZTJSA-N 493.605 0.445 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1 11305239 VUFLBFILKNVPCN-UHFFFAOYSA-N 461.496 0.870 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Nc1cc(C)on1)c(=O)n2Cc1ccccc1 754573206 AWCHJIXQFFPWMX-UHFFFAOYSA-N 496.484 0.204 50 20 JCGD CNS(=O)(=O)c1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)ccc1OC 913391870 KAGQBERBSRZTGQ-UHFFFAOYSA-N 475.571 0.577 50 20 JCGD CN1CCN(c2ccc(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)cn2)CC1 916245522 GCJIDVYCWZDXRY-UHFFFAOYSA-N 460.564 0.271 50 20 JCGD O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1)N[C@H]1CCS(=O)(=O)C1 919884509 GZRZSXSJFBBAEB-ZDUSSCGKSA-N 488.494 0.897 50 20 JCGD C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 920050679 GFNXYDKCKMUELM-GFCCVEGCSA-N 469.451 0.810 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)c(C)c1 920297359 CMIJRJONWWLBBP-AWEZNQCLSA-N 468.557 0.803 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCCn1ccnc1)c(=O)n2Cc1ccccc1 920926028 RFBXTDBAQWWBSO-UHFFFAOYSA-N 478.513 0.252 50 20 JCGD O=C(CN1C(=O)CCC1=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1 1317697397 YOVKXMDAKGEUPF-UHFFFAOYSA-N 492.941 0.827 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)c1 1318107519 SPSGHWYOPXERAS-UHFFFAOYSA-N 476.559 0.450 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)ncc1[N+](=O)[O-] 1778248123 XEXUAXVSIJKZLR-NFBKMPQASA-N 482.302 0.419 50 20 JCGD Cn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)c2c1CCC2 1778670429 YIHFWFTVJDEFJL-NTKDMRAZSA-N 481.557 0.349 50 20 JCGD COc1nc(C)ccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372602 NHTHPUKRDFELRL-NTKDMRAZSA-N 482.541 0.838 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968147 AXNOHNYGWQZCFA-CJFMBICVSA-N 497.600 0.695 50 20 JCGD CS(=O)(=O)CC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1782864558 OFFKUDDKBOJNPP-WIRORWGXSA-N 453.467 0.746 50 20 JCGD CS(=O)(=O)CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783021910 DULARQCMXCIRBB-VQIMIIECSA-N 473.389 0.867 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ccc1[N+](=O)[O-] 1785179395 DCGYQHRVHJZVEL-JOCHJYFZSA-N 469.259 0.041 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CCNC(=O)c3ccccc3)C2)C1 1785329470 NMYPOKCZNWNZAM-QMFOPCRCSA-N 494.552 0.770 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1C 1786980104 JROONKRLQFQEER-RRPUWOKSSA-N 466.343 0.519 50 20 JCGD Cc1ccn2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)c2c1 1787371278 KIVTUERJSBHLMX-XJABCFGWSA-N 462.315 0.230 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3ccnc3)C[C@@H]21 1787508462 YJRVRHZVCBWCRG-KEMROHCCSA-N 469.546 0.777 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C(F)F)n3)C[C@@H]21 1788610932 BCYQZLZWVIQWTO-PJODQICGSA-N 463.445 0.184 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCS3(=O)=O)C[C@@H]21 1790963402 ACZSRSVZGLKXCW-YYFQZIEXSA-N 451.383 0.717 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc(C#N)c3)C[C@@H]21 1791286350 CHCZRPKQBDPHON-ACRUOGEOSA-N 455.559 0.844 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)C(C)(C)C)NC(=O)NCc1ccccc1 1792917864 SJVYOWRPBGBCAP-YHELAOLJSA-N 475.590 0.329 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc1 1792983534 LWZCVFDENZLTJW-HPNQWNLUSA-N 467.950 0.281 50 20 JCGD CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793116279 JQXBNUUEZKRXRL-TZZQQRSASA-N 459.971 0.985 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN(C)C(C)=O 1793747814 BQWCAFJYOQQLNE-VPTLXERWSA-N 476.486 0.592 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(S(C)(=O)=O)cn1 1794429319 YBKTVLWEASNVNC-OHTBPHCPSA-N 460.350 0.472 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc2n(n1)Cc1ccccc1NC2=O 1796188906 ZOAPPEBKECHECQ-ACDBMABISA-N 499.336 0.743 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@H]1SC(=N)NC1=O 1796426864 KLYFFYOHMYDNFL-ALMWHKAHSA-N 451.318 0.069 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)cnc2c1 1797607145 CQSLYFLXDYJZTJ-REPLKXPHSA-N 460.299 0.248 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-n2ccnc2)ccn1 1798727061 RWWVDBGJMJAECB-KFYWAZSKSA-N 490.524 0.605 50 20 JCGD COCCOCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br 1800762899 JTLVBRZIEUPUSM-CUSZFKRNSA-N 481.384 0.056 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)nc1C(F)(F)F)C2 1801011786 DCRAHJWLYQOTPT-DRXBFXEBSA-N 460.457 0.015 50 20 JCGD COC(=O)[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)NC(=O)OC(C)(C)C 1801018244 WRPZLJSZFXDOSL-GFQSEFKGSA-N 482.361 0.836 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(C(=O)OC)cc1 1802230299 PCJWWUVYJHXULR-HIRMHNASSA-N 454.907 0.695 50 20 JCGD CN1CCC(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1802570799 ZFYVUCKAMSRRPZ-RBBKRZOGSA-N 450.348 0.423 50 20 JCGD Cc1cc(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1C 1803287226 QGHYWKYZPGLGCT-XXBNENTESA-N 461.331 0.366 50 20 JCGD COc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1OC 1807360181 HWFPLOZCMHTJLD-XMSQKQJNSA-N 490.325 0.807 50 20 JCGD Cn1c(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cccc1=O 1807362288 JZBAMHLKVSGODC-GCJKJVERSA-N 460.299 0.094 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807615727 IJIQXEUZZOLQQT-TZIWHRDSSA-N 496.373 0.994 50 20 JCGD Cc1cnc2c(C(=O)NC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)cnn2c1 1809834950 IFKSLANRUCRMDF-SIKLNZKXSA-N 484.325 0.746 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809971355 SMGROJNMFAWEER-NSRYLYFRSA-N 457.336 0.740 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809974185 SCYMQEZVMRMUCW-UHFFFAOYSA-N 476.386 0.608 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1 1810295742 WZCKGKCNDPUVGJ-AUUYWEPGSA-N 462.470 0.209 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccncc2O)[C@H]1c1cccnc1 1810303233 QXQDPPBDCVXMRQ-QRWLVFNGSA-N 461.482 0.814 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1812408988 PYXNZGSWMJWEAL-LESCRADOSA-N 463.878 0.457 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@@H](CNC(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1 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CC[S@](=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403634 XQMKKXYYSNSKTF-KNTRGWTASA-N 461.548 0.873 50 20 JCGD COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)nn1 1820039726 YBBGQTNNGTXOMZ-QGZVFWFLSA-N 450.264 0.508 50 20 JCGD COCCOCCOCCOCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2 1825788639 GTAGSPUXMMNPAF-HIFRSBDPSA-N 479.983 0.351 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cc1F)CCO2 1830085456 QILSCWASJIGGHS-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD O=C(Cc1ccc(Cl)c(F)c1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830294849 SMPMSJLVJLBPIG-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830724774 BXVQFVIBHRTVNK-WQTXXOFMSA-N 489.997 0.832 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)C2)C1 1831657621 PICCTVFWOFZQIC-OPYAIIAOSA-N 469.970 0.321 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc[nH]n3)CCO2)C1 1831758253 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LUKWLUHLFHJPIM-UHFFFAOYSA-N 468.363 0.724 50 20 JCGD O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836717747 ITFHWRGXSDBRJH-INIZCTEOSA-N 474.967 0.050 50 20 JCGD Cc1onc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1C 1836987812 FWKVBIYFAFVVIS-UHFFFAOYSA-N 455.320 0.897 50 20 JCGD O=C1NC(=O)[C@@H](CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)N1 1837116396 BUAQPLQPVDPIFF-OCCSQVGLSA-N 463.304 0.274 50 20 JCGD C[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)Oc1ccccc1 1837459395 FDIPEGQTHHFKOJ-AVRWGWEMSA-N 497.552 0.613 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)nn1 1838757929 JFHGNLJERQPDCT-DYVFJYSZSA-N 462.320 0.794 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c[nH]1 1839054005 BDPNYTXIQAHADY-VWLOTQADSA-N 498.584 0.739 50 20 JCGD O=C(Cc1c[nH]c2ccccc12)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839070553 VWVSGNVGNDIYJR-RUZDIDTESA-N 477.326 0.160 50 20 JCGD O=C([C@@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1 1839199854 XBROGSNPYATYMZ-QKLQHJQFSA-N 470.339 0.848 50 20 JCGD COC(=O)N(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)Cc1ccccc1 1840083644 QKSAWZQJZDRRMV-AVRDEDQJSA-N 483.949 0.311 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2n[nH]c3cc(Cl)ccc23)C1 1845025814 XAZYLLSSWFAECW-UHFFFAOYSA-N 452.707 0.956 50 20 JCGD C=CCNC(=S)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1 725908594 JGHFYJDEWOQZCA-UHFFFAOYSA-N 467.617 0.993 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c2ccccc2c1=O 727976231 ODDGLKSNDKFTIY-UHFFFAOYSA-N 480.437 0.901 50 20 JCGD CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1F 728502618 OLTZLJFLMWGLRY-UHFFFAOYSA-N 458.493 0.919 50 20 JCGD O=C(CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)NNC(=O)c1cccnc1 746032815 DFMINZQYJLWOKB-UHFFFAOYSA-N 459.484 0.625 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H](C)c1c(C)noc1C)c(=O)n2Cc1ccccc1 749842724 JEOXGIZKDTWFFB-AWEZNQCLSA-N 493.524 0.984 50 20 JCGD C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 914631948 KTAYBVCBXDAERK-HSZRJFAPSA-N 495.448 0.898 50 20 JCGD COC[C@H](C)NC(=S)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 916125709 WBMHPFRBBFQGOT-SWLSCSKDSA-N 474.605 0.483 50 20 JCGD O=C(CSCc1ccncc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916734785 YLJUQBGUJQEEEU-UHFFFAOYSA-N 450.542 0.797 50 20 JCGD C[C@@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)ccc2Cl)C1 919886837 WLXSLPZQADTNHD-TZMCWYRMSA-N 493.007 0.892 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ncccn4n3)C2)C1 1777825892 ULLICZBBLARVRE-LHSJRXKWSA-N 493.952 0.700 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4sc(C)cn4c3=O)C2)C1 1777990926 ZCFXPIGFRRWBJB-AUUYWEPGSA-N 454.936 0.762 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3cnccc13)CCO2 1779032390 PZOGMCNNJQSTDJ-DEOSSOPVSA-N 460.494 0.991 50 20 JCGD Cn1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C(F)(F)F)n1 1779032759 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480.886 0.392 50 20 JCGD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)CNc3ccccc3OC)C2=O)cc1 825615146 KGRZJMXMCWAXJC-JOCHJYFZSA-N 455.471 0.730 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)C[C@@H](C)O1 912920243 ZTHAAQHMVJJBMC-ZIAGYGMSSA-N 491.408 0.764 50 20 JCGD COCCOc1ccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C 914876462 DIRCTNAYEQIOEH-UHFFFAOYSA-N 485.584 0.959 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C(C)C)N2CCOCC2)cc1 916254258 SGNJTTRKFQOKKD-SFHVURJKSA-N 455.581 0.303 50 20 JCGD C[C@@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 917900770 AZBRCCSHVNJCMO-CYBMUJFWSA-N 486.597 0.661 50 20 JCGD O=C(NNC(=O)/C(=C\c1cccs1)n1nnnc1-c1ccccc1)N[C@H]1CCS(=O)(=O)C1 920745121 HHMCIZSINSWRRD-LUYJPIOASA-N 473.540 0.917 50 20 JCGD CCn1c(CCC(=O)NNC(=O)NCC2CC2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 920859581 MPIKYKQLQPXZIU-UHFFFAOYSA-N 478.575 0.750 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)ccc21 1778611549 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COCCOCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2 1781383332 KZMZUXVINSAZDT-RXVVDRJESA-N 480.986 0.156 50 20 JCGD COc1cc(F)c(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1 1781710250 VLNKTINVWZDRGQ-NRFANRHFSA-N 454.474 0.790 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1 1782351825 DJFILZNMOQRKBE-PVPASAESSA-N 478.513 0.615 50 20 JCGD Cn1nc2c(c1C(=O)N1CC[C@]3(C1)CN(C(=O)[C@H](O)CCl)CCO3)CN(C(=O)OC(C)(C)C)C2 1782561122 VCSKRQWLHKLUSH-ZHRRBRCNSA-N 497.980 0.714 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)CO2)C1 1783455637 YTNGOLNQURZPDT-CKJXQJPGSA-N 487.981 0.442 50 20 JCGD CC(=O)C[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783829788 YEYZTFPISJZFTB-HOYKHHGWSA-N 473.574 0.778 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc4sccc4c3=O)C[C@@H]21)[C@H](O)CCl 1784085321 FNRNFPTZAQWNBC-HNKHHVNMSA-N 453.948 0.642 50 20 JCGD 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Cn1nc(C(F)(F)F)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731758 MLXGUUZJZYNPAB-MLGOLLRUSA-N 454.833 0.109 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830735669 LKGQVMNHSYYBMO-LPHOPBHVSA-N 457.867 0.279 50 20 JCGD COc1cc(N2CCC(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)CC2)ncn1 1830957510 LCPARZUCSVBBCX-NQIIRXRSSA-N 485.944 0.692 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@@H]1OCCc3ccccc31)CCO2 1831249174 FNTMKVGZIIIREL-SQJMNOBHSA-N 488.585 0.520 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCN(C(C)=O)CC3)C2)C1 1831650134 DKDJLBVWVKESTG-NQIIRXRSSA-N 458.987 0.014 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1831655313 VVPJAMTVUOCRFB-YCRPNKLZSA-N 463.922 0.567 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832043655 BJLLUEBPJWNWTC-STXHMFSFSA-N 461.943 0.052 50 20 JCGD Cc1cc(CCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccn1 1833745429 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CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1 1836894598 YFYLPHHUUVILCS-KUHUBIRLSA-N 466.336 0.973 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1837605842 FVAWJZCBIHKAHU-AVYPCKFXSA-N 498.378 0.082 50 20 JCGD Cn1cc(F)cc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919408 NONSZUQUXQWOBH-UHFFFAOYSA-N 457.311 0.770 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1cccc(Cl)c1 1839043408 WZSJJCVGXFVHDY-UEXGIBASSA-N 488.368 0.573 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3cccc(Cl)c31)CCO2 1839740746 SKPLQHONNKUWAL-NLFFAJNJSA-N 498.772 0.820 50 20 JCGD COC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839743968 HHJXDIZBQISVCK-AGBQBWRISA-N 478.452 0.684 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCOCCOCCOC)C2)C1 1839966520 HYDVGQVHRZIECN-YLJYHZDGSA-N 495.411 0.686 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1839967409 LPWXNFSCFZNBKJ-SJKOYZFVSA-N 494.433 0.477 50 20 JCGD COC(=O)C12CC(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCBr)C4)C3)(C1)C2 1840004197 GCMLPVMNTHUYJP-CTWPCTMYSA-N 459.337 0.571 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1 1840153310 KBAKIOMARGTDHW-IERDGZPVSA-N 451.907 0.505 50 20 JCGD Cc1cc(F)c(F)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185068 HDPLRTBXOCLEQD-QFIPXVFZSA-N 468.501 0.716 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1 1840186009 YNRLJEXTPQRZAI-FQEVSTJZSA-N 453.927 0.178 50 20 JCGD COC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)CCC1 1840616481 YDIUBLCRSMBHHT-VAHWYXDJSA-N 475.546 0.536 50 20 JCGD O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014293 UTSPGWGFJYKIAS-UHFFFAOYSA-N 457.299 0.381 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3c(n1)OCCO3)C2 1843415999 MVWBNPHFYKBWJW-AFUMVMLFSA-N 452.471 0.804 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844349017 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CCCn1nc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)NC)c2)c2ccccc2c1=O 109568012 UITMFFDPGJUEOA-UHFFFAOYSA-N 479.540 0.338 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC(=O)N3CCc4ccccc43)nc2)CC1 726281444 RSSWIAQLUJBEPV-UHFFFAOYSA-N 473.559 0.233 50 20 JCGD NC(=O)CNC(=S)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1 727066571 RGEOLMPDFTZVAQ-UHFFFAOYSA-N 454.600 0.764 50 20 JCGD Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)cc1C 729275371 OGPWZSGZBYNMAT-CQSZACIVSA-N 468.557 0.803 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=S)NCC(F)(F)F)c(=O)n2Cc1ccccc1 746397315 CCPBJPFFXJVFMF-UHFFFAOYSA-N 483.476 0.486 50 20 JCGD NC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cccc4cccnc34)CC2)o1 747463228 AKTYZJXVHKOPIH-UHFFFAOYSA-N 472.483 0.288 50 20 JCGD O=C(COC(=O)c1cc(I)ccc1-n1cnnn1)NNC(=O)c1ccccc1 781968024 JIKCXLWGDHZURG-UHFFFAOYSA-N 492.233 0.885 50 20 JCGD C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)C2=O 785981212 PPXAWWSVXZKQHB-XNVILDLWSA-N 474.470 0.018 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)cc1 789857898 KSFAEUVBKONCTN-UHFFFAOYSA-N 487.538 0.507 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1 906384289 GPQNTINWNFTFPB-UHFFFAOYSA-N 476.511 0.046 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@@H]1CCN(Cc2ccccc2)C1 915903082 WHPUVUBWHBZVGI-HXUWFJFHSA-N 487.582 0.926 50 20 JCGD CCCn1nc(C(=O)NNC(=O)Cc2cc(F)c(OC)c(S(N)(=O)=O)c2)c2ccccc2c1=O 916125002 QMYTWWZHFQWZHK-UHFFFAOYSA-N 491.501 0.605 50 20 JCGD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 917720620 YCNCECUGUKMPNR-UHFFFAOYSA-N 475.570 0.272 50 20 JCGD NS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(F)cc2Br)cc1 917755336 VLFBWRCOFOBBLA-UHFFFAOYSA-N 452.283 0.859 50 20 JCGD CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 919810603 PWRYEAKAGURFFP-UHFFFAOYSA-N 482.540 0.623 50 20 JCGD COC(=O)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n(-c2ccccc2)n1 1318271105 QAOJUSVFTHEISE-UHFFFAOYSA-N 471.495 0.984 50 20 JCGD COc1cc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1[N+](=O)[O-] 1779037109 OHXRMAVUXCJGET-QHCPKHFHSA-N 498.496 0.288 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)c(O)c3)C2)C1 1781697253 PJSDZRZXHOMNFM-OAQYLSRUSA-N 489.131 0.592 50 20 JCGD Cc1nccn1CC(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1782774379 OXNYMFXMRIARFM-XMMPIXPASA-N 483.573 0.368 50 20 JCGD O=C(CCNC(=O)c1ccccc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1783101183 DOVBAAZPBKARBC-JBYIUTFZSA-N 451.951 0.920 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(-c3cnccn3)c1)CCO2 1783934461 AMVZHBUMYUAILL-DEOSSOPVSA-N 466.542 0.960 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1 1784348300 DDYQDZQFTNWMHH-XAPDMKTOSA-N 467.530 0.479 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCOCC3)[C@H]2C1 1786736161 BZCDWKNSDUTBAM-QXDWZXEQSA-N 459.547 0.917 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc(OC)c1C 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RJCIXPYVVYORMD-KJBBBAAKSA-N 462.355 0.765 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1792251258 ZPMDOKQZPXWTJV-GTAWCEEGSA-N 473.574 0.158 50 20 JCGD CC(C)(C)OC(=O)N1CCC(F)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)CC1 1792529799 UKEWUHNEJVWESU-QKPAOTATSA-N 477.961 0.915 50 20 JCGD COC(=O)CSCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1793364932 FMTIBRFTJCHXCX-VTEUUUEMSA-N 495.510 0.630 50 20 JCGD Cn1nncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878377 ZBINRQOZUDRKKE-XFMPKHEZSA-N 456.931 0.150 50 20 JCGD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc([N+](=O)[O-])c1OC 1796189510 WLHIAOVWZZVGOG-BCDXTJNWSA-N 483.286 0.857 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(N2CCOCC2)cn1 1796190703 ABPPXYIFKBIZJW-ACDBMABISA-N 464.331 0.164 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799347536 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CN(C)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809968173 NKSQZYLTRXLHHC-UHFFFAOYSA-N 450.348 0.986 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)cco2)[C@H]1c1cccnc1 1810300598 ZIKNEXYSODQUSV-QRWLVFNGSA-N 462.466 0.667 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810305356 KHSFENKVLAVBFL-ZYSHUDEJSA-N 472.571 0.514 50 20 JCGD COCc1oncc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813071811 XIDGUWATECNQLI-IIBYNOLFSA-N 458.519 0.909 50 20 JCGD CCc1[nH]nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1F 1815355177 QQYKEJRUQRNDHR-GFCCVEGCSA-N 457.296 0.787 50 20 JCGD O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1 1816782244 MDGJYAVSXWUIBS-LLVKDONJSA-N 452.246 0.912 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc2c(c1)CNC2=O 1819367905 XMUORHOTPIDLDU-MRXNPFEDSA-N 476.323 0.606 50 20 JCGD CC(=O)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1825237466 RJRBYBNEVCYXGB-RCMPGLAHSA-N 459.532 0.715 50 20 JCGD C[C@](O)(C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)C(F)(F)F 1827049966 ARMNWJICGSFLTM-XLIONFOSSA-N 456.270 0.913 50 20 JCGD O=C(c1cnc2ncccn12)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052149 QFILQMGWZZFWGF-FQEVSTJZSA-N 461.331 0.956 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](N)CN)CCN2C(=O)OCc1ccccc1 1829050723 SLUDGSFBMRTONV-WJPUGNRLSA-N 496.406 0.508 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2 1829839696 MRMPZABHWVDKFL-XMMPIXPASA-N 464.327 0.168 50 20 JCGD COCCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549251 JPVSSBQDONVMAX-KKSFZXQISA-N 493.985 0.238 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834800303 CMYQMJIKYKKUJQ-UHFFFAOYSA-N 492.385 0.824 50 20 JCGD COC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835118315 NOSMPWOBDMHUDQ-WGOQTCKBSA-N 474.562 0.645 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1 1835212524 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1839323545 TYGJZSLHISNVEF-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1840154267 QVTUSOYANFTCNT-IIBYNOLFSA-N 495.920 0.002 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc(Cl)n1 1840184800 AQFKXICOBSFWKO-NRFANRHFSA-N 483.953 0.187 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1 1840184945 HYUYUCOWZYRKBW-HYBUGGRVSA-N 474.558 0.210 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)CCO2 1840313220 YOZBEPUOAUWVCI-MIZPHKNDSA-N 465.978 0.707 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840650328 JPTZPBTTZWKUFH-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1840889925 QDUVKKVVGLMWEH-UUOWRZLLSA-N 452.316 0.240 50 20 JCGD C[C@@H]1[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CCN1C(=O)OC(C)(C)C 1843012859 NPKNJFARAWUGLY-APWZRJJASA-N 471.363 0.829 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c1F 1843014197 JUNRNWJLHJHUAO-UHFFFAOYSA-N 454.263 0.813 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1843971573 PXAGCVCHAHSFQU-LPHOPBHVSA-N 471.363 0.686 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1 26736082 LLNUVDZNWVPZRM-UHFFFAOYSA-N 463.512 0.946 50 20 JCGD CN1CC(=O)N(CC(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)C1=O 725897103 VBKRRXDHHBDCSB-UHFFFAOYSA-N 479.902 0.796 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c(C(=O)OC)s1 726519418 HSOICWWNDQZKLL-UHFFFAOYSA-N 488.496 0.970 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=S)NCC(N)=O)ccc1Cl 727078315 VREGCAOHTGIHRR-UHFFFAOYSA-N 471.948 0.744 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H](Cc1ccccc1)NC(=O)OCc1ccccc1 729275829 RZGMOLBSMJYEML-CRAIPNDOSA-N 462.528 0.609 50 20 JCGD COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(C)c1 747691745 HYQVAZDKOYGJOK-UHFFFAOYSA-N 455.514 0.655 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)c1 748466183 WBJPYMFYMXOUGK-UHFFFAOYSA-N 489.602 0.488 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=S)NCCc2cccs2)cc1OC 838848262 RUHAEDXCUJMSOT-UHFFFAOYSA-N 458.587 0.782 50 20 JCGD CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)(c2ccccc2)CC1 849201258 KLPFEFMMLZNGQZ-UHFFFAOYSA-N 483.554 0.807 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@@H]3COc4ccccc4C3)nc2)CC1 916199373 NUMCMIUSKOUMML-MRXNPFEDSA-N 460.560 0.895 50 20 JCGD CCS(=O)(=O)NCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 916516669 NIXIXXRGILYHBS-UHFFFAOYSA-N 483.572 0.048 50 20 JCGD CNC(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 916603583 SKEHCKPXRXRARS-UHFFFAOYSA-N 475.527 0.211 50 20 JCGD Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 920424831 KIFMFUVMKGQAGP-YBEGLDIGSA-N 458.479 0.873 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1)NC1CC1 920822440 OCYISOBNOXEIGI-UHFFFAOYSA-N 451.549 0.804 50 20 JCGD N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 921160721 SENZOPUAIZCABT-UHFFFAOYSA-N 464.529 0.246 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 921175868 QBJPQSVFTPKJIL-SFHVURJKSA-N 475.479 0.272 50 20 JCGD Cc1cnc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)cnn2c1 1779019083 FIHOEUSAHZVBLG-HYBUGGRVSA-N 477.330 0.159 50 20 JCGD Cc1ccncc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028212 HHCATYUYRASGKZ-QHCPKHFHSA-N 452.515 0.465 50 20 JCGD N#Cc1ccc(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779037387 ZGCLIXJGPDXCRZ-QFIPXVFZSA-N 452.446 0.453 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)N1C[C@H]2C[C@H]2C1 1779372696 XOBYPYKWGFUXAH-IQHXESNCSA-N 470.574 0.153 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1cccn1 1780969731 PIFOOXZLTBWUMG-NTKDMRAZSA-N 483.573 0.620 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1782036647 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C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C[C@@H]21 1791061100 RJBVYELXIRUTGY-MCZMQQNQSA-N 464.357 0.593 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc1 1792983513 LFDQURCRJDCQCA-LORHWOILSA-N 458.964 0.212 50 20 JCGD Cc1nn[nH]c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1795977285 HSBOKWFLKWQHKC-XFMPKHEZSA-N 456.931 0.448 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccnc2c1 1797055811 YXNZFFSGTVWHNW-YVWYUNDQSA-N 461.482 0.145 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(C(F)(F)F)(C1)C3)C2 1797748628 NKLSAPJBPXCYGL-OSWFJYAVSA-N 467.448 0.621 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](c1ccc(Cl)cc1)N(C)C 1800306630 BFYLDADNTAGCOZ-WOSNLTMFSA-N 480.009 0.905 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC)C2 1800971240 RLKPPXPXWPLYNU-RGGMIXCSSA-N 477.986 0.758 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc(Br)nn3c1)C2 1800975789 TXLUXGUVVUITNR-QVHKTLOISA-N 486.754 0.949 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(OC)c(O)cc1[N+](=O)[O-])C2 1800978756 JEAHXKAKICUORG-QTFJUKGGSA-N 457.867 0.766 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccnc3)[nH]n1)C2 1801011897 RDARZAPISVQBTR-VPTLXERWSA-N 455.519 0.048 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1802879955 OLJQKGBMTLZTIB-PWIZWCRZSA-N 467.530 0.314 50 20 JCGD C[C@@](O)(C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1)C(F)(F)F 1806483832 MJFCHUQVWMBYFZ-GOSISDBHSA-N 457.453 0.843 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807359525 ALTAXVXRIATCBE-GZWABDKCSA-N 457.361 0.240 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363857 PUHUMDUSFYPNJS-XMSQKQJNSA-N 488.309 0.561 50 20 JCGD COc1nccnc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365134 XDWPIAJSIFJETG-YLJYHZDGSA-N 461.287 0.193 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373950 VKRZUBGSATUWMG-GCJKJVERSA-N 472.310 0.494 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=N/N2CCCCC2)[C@H]1c1cccnc1 1810290428 XLRZUKHKQJLRHN-RCBCJABQSA-N 457.579 0.932 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1 1810303468 SHLLOWZWLMZYJL-QRWLVFNGSA-N 482.932 0.950 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810323691 IAORBHWAFVBLIE-HZUJVAHNSA-N 489.540 0.690 50 20 JCGD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1 1811205410 KWCPIFWZKQNNLQ-DYESRHJHSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1nn[nH]c1C(F)(F)F 1811559161 ZNJCPSXQZOUUNB-PBHICJAKSA-N 488.235 0.532 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1812863237 FYKBPHIAHQYABI-CORIIIEPSA-N 463.269 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1813071095 NCZKDJGNFOXOFF-BTYIYWSLSA-N 456.503 0.580 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1 1813072975 IJBCJLNQZWSQAJ-IFXJQAMLSA-N 458.479 0.406 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1 1814644628 WIHYNXBVWLKISZ-ZDUSSCGKSA-N 473.559 0.090 50 20 JCGD COCCn1nccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1818248230 DWFQYGKBJRZASE-SFHVURJKSA-N 466.307 0.552 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1 1822699346 ARVBCJBYANCAOJ-PMPSAXMXSA-N 451.915 0.472 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)C3(Br)CC3)sc2C1)c1ccc(B(O)O)cc1 1823024226 QKQKEYBYXFBRHG-GFCCVEGCSA-N 464.150 0.976 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1 1825864770 TWVKWRTWQHQHGE-GFCCVEGCSA-N 471.543 0.380 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1C 1830543324 PUQKIBUXCWWAIT-UGSOOPFHSA-N 459.341 0.530 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725772 RSEQSBXLNYIDSW-IIBYNOLFSA-N 469.922 0.317 50 20 JCGD O=C(c1cn2c(Cl)cccc2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728268 RHDQCXGLJQOPPQ-LIRRHRJNSA-N 457.314 0.657 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc(C)c(O)nc3=O)C2)C1 1831660121 YHCKQHGNSRRDOZ-MGPUTAFESA-N 456.927 0.121 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)CC1 1831870817 GXVCHHSNBFMRNV-RBUKOAKNSA-N 497.637 0.865 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2 1832166255 KYAYJVXMRBRKFW-GLQYFDAESA-N 461.275 0.930 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832252112 QVFKKGJXXAIUCP-RNCFNFMXSA-N 479.221 0.581 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833028269 MULCNTOBONPYHS-XLDJFRKUSA-N 468.938 0.467 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1 1834423385 JCTBVBLQRGCPTG-UHFFFAOYSA-N 460.417 0.716 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cn4ccccc4n3)CC2)CC1)c1ccc(B(O)O)cc1 1834798573 MADQDLPWZDKESM-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD Cc1nc(C)c(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)o1 1834801089 KLKCQEPOCNDMQV-UHFFFAOYSA-N 454.336 0.470 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1c(F)cncc1F 1835994900 BTTZOKUKFCBRBL-UHFFFAOYSA-N 472.301 0.539 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836717925 FLBKFFVVOLOANG-GOSISDBHSA-N 493.948 0.890 50 20 JCGD COc1ccc2oc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc2c1 1836818834 QCNKTERUJUHADC-RUZDIDTESA-N 494.309 0.505 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3ccc(F)cc13)CCO2 1837042648 IGKZSSBYOGWUHE-JOCHJYFZSA-N 476.509 0.145 50 20 JCGD Cn1c(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cccc1=O 1837378997 SGVFJDJMQKQQCC-UHFFFAOYSA-N 482.541 0.310 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1837715195 BULLXENFFKBXTN-FQEVSTJZSA-N 480.619 0.678 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920041 FQOPNTJZVBTIDI-UHFFFAOYSA-N 482.346 0.107 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921758 YBRISVWEEAVCGN-KRWDZBQOSA-N 459.352 0.780 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)nn1 1838829525 CULNOMKQGCHVSE-IFXJQAMLSA-N 471.352 0.976 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)C1 1840153760 ZCCAXUYUYUQUGU-HYFFOGBASA-N 489.997 0.954 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CSCC(=O)O)CCO2)C1 1840190418 WPSZQJLIZXCMPF-LRDDRELGSA-N 453.355 0.292 50 20 JCGD Cc1ncncc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038909 HIIBEPSVMIEYII-UHFFFAOYSA-N 451.531 0.948 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(NS(C)(=O)=O)cc2)cc1 10890990 LPTKWCZCUFHBSQ-UHFFFAOYSA-N 454.530 0.448 50 20 JCGD O=C(O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 13345706 IOGGJIQVTMDXPD-UHFFFAOYSA-N 453.498 0.793 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1 16786193 XAWQBVVZYNMZRB-NSHDSACASA-N 496.405 0.675 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)c1cc(Br)c[nH]1 26228491 SJLCICPAFHZTHK-UHFFFAOYSA-N 463.335 0.841 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1 26687727 MSDHNDIGGXLCMM-UHFFFAOYSA-N 496.542 0.366 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccn(C)n1)N(S(C)(=O)=O)CC2 727484619 PMLOZVGWZCGFCH-HNNXBMFYSA-N 451.505 0.147 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2c(Cl)nc3sccn23)cc1 728502963 VMIVTVXUTZFZNW-UHFFFAOYSA-N 477.977 0.988 50 20 JCGD O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 729620558 YTYZGPCWEDBKMD-IAGOWNOFSA-N 451.549 0.278 50 20 JCGD COCCCNC(=S)N(C)NC(=O)C1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1 731652069 JPGLQBPWGKWYAX-UHFFFAOYSA-N 453.590 0.833 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNC(=O)c2ccc(C#N)cc2)cc1 747214474 HNZSHMZIQDSDQX-UHFFFAOYSA-N 457.512 0.780 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccc(Cl)s2)cc1OC 750216658 LIWYDOZRRXIFOB-UHFFFAOYSA-N 491.931 0.701 50 20 JCGD Cn1c(CC(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)nc2ccccc21 751289853 HHEPESSBMQGGMC-UHFFFAOYSA-N 455.540 0.807 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)NCc2cccs2)c1 788024395 XFVYWZFHIILLJB-ZDUSSCGKSA-N 457.555 0.422 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNS(=O)(=O)c2cc(C)ccc2C)cc1 913500071 LDPBGAOITMMECX-UHFFFAOYSA-N 482.584 0.358 50 20 JCGD Cc1nn(-c2ccc(F)cc2F)c(C)c1C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O 915957694 RENXCPDNIQZBKV-UHFFFAOYSA-N 463.470 0.802 50 20 JCGD C[C@H](CN1CCCCC1)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916461502 HDYQCPJXEVPFRF-GOSISDBHSA-N 481.619 0.845 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)COc3ccc(F)cc3)CC2)c1 919838923 UNVHPBBLNKZNIL-UHFFFAOYSA-N 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CN1CCC[C@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549059 DBAICYUETYHFNA-PNLZDCPESA-N 489.013 0.669 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccco3)CCO2)C1 1832660509 ZBURNMOYTPVFJP-VCOZGABYSA-N 471.470 0.053 50 20 JCGD CN(C)c1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1 1833365213 OLWRBFUCRXLSCB-YJBOKZPZSA-N 459.316 0.908 50 20 JCGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)c(=O)[nH]c1C 1833386317 VQSZBIWUVRUNTQ-BUXKBTBVSA-N 471.352 0.488 50 20 JCGD CC(C)n1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1C(=O)O 1833608917 ZMTPKLSKHQFPQX-KDOFPFPSSA-N 491.314 0.923 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1 1833895858 KDZDGSDKLCSLHA-FZKQIMNGSA-N 459.341 0.842 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccn1 1834801428 IEVQDVJSHFIZIC-SFHVURJKSA-N 464.375 0.750 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834826514 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O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cccc(O)n3)CC2)CC1 1837471871 DJCDGNLMWRTIMJ-UHFFFAOYSA-N 453.304 0.393 50 20 JCGD O=C1NCCn2nc(C(=O)N3CCC(OC4CCN(C(=O)[C@H](F)Br)CC4)CC3)cc21 1837581933 CYGXIOYPKWQOII-INIZCTEOSA-N 486.342 0.929 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccncc3O)CC2)CC1 1838394016 KQNJHOISGBVDMN-UHFFFAOYSA-N 468.514 0.712 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3nccnc3C(N)=O)CC2)CC1 1838509551 HAZAQOVXRXJMLO-GFCCVEGCSA-N 468.352 0.971 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc[nH]3)C2)C1 1838526823 DWSKYUCDLJEOMM-OAQYLSRUSA-N 473.442 0.627 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(F)cccc3F)CCO2)C1 1838995851 RDUQKJTZYUDKMV-HSZRJFAPSA-N 489.479 0.276 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(F)c1)CCO2 1839003433 HZGAWNZKCOMBPH-OAQYLSRUSA-N 454.474 0.408 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1839148508 ZODJJIHMIWJEJO-IFXJQAMLSA-N 456.883 0.230 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Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)nc1 1794090901 OFRMSAORNMRLPT-VPTLXERWSA-N 452.515 0.225 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1nccs1)C2 1796440712 ZZIBOYGYIULLSM-POGLLOKHSA-N 473.559 0.667 50 20 JCGD CC[S@@](=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1797604085 NBTVWYUJHMMDPH-YEQXBCCHSA-N 480.027 0.867 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1F)C2 1797754038 PYNCRBKSWWNSPV-VTEUUUEMSA-N 457.462 0.106 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](COC(C)=O)OC(C)=O)C2 1800642062 UKRCHEYMJCXUQR-DGADGQDISA-N 463.325 0.244 50 20 JCGD CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1806293136 LJKLIOULCOVQJO-JQTWLFPRSA-N 451.288 0.200 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCN2CCCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362931 KRHISKFDJKRILB-XUZZJYLKSA-N 464.375 0.957 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1n[nH]c2c1CCCC2 1808042607 KQCKINNNJLWPBH-JPYJTQIMSA-N 473.342 0.997 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808358929 QQFDXBSGEQEIPA-PUHATCMVSA-N 473.342 0.046 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809973220 ARUWVVVRYGYQOD-SFTDATJTSA-N 468.359 0.967 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C[C@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1812864179 GDJHPOZTLOALTH-DNVSUFBTSA-N 452.309 0.469 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C[C@@](C)(O)CC(=O)O)[C@@H]1c1cccnc1 1813065333 KIEKZJIFIVWHDL-KBUCJNJASA-N 498.540 0.837 50 20 JCGD COc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815339629 KOMHHMFJOYDLSP-CYBMUJFWSA-N 453.289 0.161 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc(O)n3c2CCCC3)[nH]n1)c1cccc(B(O)O)c1 1817476599 LUCYUZDLPOONBE-KRWDZBQOSA-N 478.318 0.948 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)NC(=O)OC(C)(C)C)[nH]n1 1822415072 AEILNSGUQLWJFZ-KBXCAEBGSA-N 481.554 0.618 50 20 JCGD O=C(Cn1nccn1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551286 LYKTWYJTUFQCMS-PGRDOPGGSA-N 490.948 0.330 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1830538992 XZHBTLUVWQOONR-KZULUSFZSA-N 458.309 0.594 50 20 JCGD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726869 UWWOCEQRESWWKH-XLIONFOSSA-N 455.895 0.584 50 20 JCGD O=C(COc1ccc(Cl)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726934 XEVAVOQRUGRLJO-VQIMIIECSA-N 465.305 0.914 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733488 NLBRMQHBANYRCH-HNAYVOBHSA-N 459.858 0.712 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1830885771 KMBUBVPLAYDWBH-YJYMSZOUSA-N 484.377 0.522 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1 1832209191 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CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837636865 PPLKQGRVQLNEIC-HAYFENEFSA-N 453.923 0.926 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837715347 LRMDNYQXCMJJIY-OXQOHEQNSA-N 451.600 0.585 50 20 JCGD O=C(c1cc(=O)n2[nH]cnc2n1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1 1837918371 OFPKOIOEUNECPT-UHFFFAOYSA-N 457.318 0.834 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccn4nccc4c3)CC2)CC1 1837919336 ZKFPXENUCODFEH-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD COCCn1nccc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919390 LSQWJHHXXHWWCJ-UHFFFAOYSA-N 484.362 0.135 50 20 JCGD N#Cc1ccccc1OCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920822 HYQYDEHQJNNBCW-UHFFFAOYSA-N 491.353 0.929 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1 1839414918 HPTMQSKZTVWIBU-VQIMIIECSA-N 457.867 0.624 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839765614 YMNKJSVHBXRUAS-BVZFJXPGSA-N 484.333 0.454 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(=O)n3C)C2)C1 1839963887 ZPRCIZICLBHFHO-KUHUBIRLSA-N 456.337 0.629 50 20 JCGD CC(C)[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1840106405 FWANFFHDUAFVTH-GSHUGGBRSA-N 492.013 0.982 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cccc(Cl)c3)C2)C1 1840183289 XIJJCFNVDKZQLO-QFIPXVFZSA-N 482.965 0.548 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)cc1 1840185606 SVDRXRWBBYPJJN-XMMPIXPASA-N 460.575 0.757 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cc(Cl)n3)C2)C1 1840186034 ZGUUSDPLKACPFP-HXUWFJFHSA-N 488.372 0.831 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cl)COC)C2)C1 1840909349 YDJUBUPCXJPVDO-HOIFWPIMSA-N 487.981 0.613 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C[C@@H]2C[C@@H]21 1841359406 SHJHGOBIKOTPLI-WDSOQIARSA-N 469.347 0.581 50 20 JCGD Cc1cc(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)n(-c2cccc(=O)n2C)n1 1843132522 CQHVXXCBSVAIGI-UHFFFAOYSA-N 469.546 0.069 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2 1843415787 MFIRBWWTYQTAHO-VSWHYLHOSA-N 489.577 0.566 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)SCC(=O)N3)C2 1844264239 XRRZRWDCOBZEBD-UHFFFAOYSA-N 466.523 0.860 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2 1844692396 RUIWDDAPSGCFRB-UHFFFAOYSA-N 481.425 0.382 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2)cc1 9931156 KEZJYRKHZRSTCI-OAHLLOKOSA-N 451.526 0.992 50 20 JCGD COc1ccc(-c2nnc(S)n2CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 21967639 QZCSGZPAXCKDRF-UHFFFAOYSA-N 475.556 0.997 50 20 JCGD C=CCNC(=S)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 725908555 HBCPPTKFFXMHSB-ZDUSSCGKSA-N 469.010 0.103 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=S)NCCS(C)(=O)=O)c1 729157957 NLCYFTTWLNOYIS-UHFFFAOYSA-N 486.597 0.650 50 20 JCGD CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)N2CCOCC2)cc1 745992995 RLPOHPOLRWROSS-INIZCTEOSA-N 460.578 0.558 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)C(=O)N3CCCC3)ccc2Cl)C[C@@H](C)O1 748246947 IHDLLVCLTZWYMY-BETUJISGSA-N 472.951 0.521 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)[C@H]1COc2ccccc2O1 762930175 PBALNJMBKRGJIE-LJQANCHMSA-N 489.506 0.615 50 20 JCGD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2=O)cc1 770392521 WEYOYQKLWLKDPG-QFIPXVFZSA-N 454.439 0.695 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc3c(c2)OCCO3)o1 915063606 YUQZBJSJSJTEHG-CQSZACIVSA-N 493.494 0.842 50 20 JCGD CCN1CCN(CCCCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1 916506019 SNJNHEMRTQGEKK-UHFFFAOYSA-N 468.624 0.364 50 20 JCGD COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(OC)c1 918236103 WANCGHNHPFSDBO-UHFFFAOYSA-N 478.527 0.869 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2cccs2)c1)N[C@@H]1CCS(=O)(=O)C1 919886328 VOSKRMWNTXKZSC-CYBMUJFWSA-N 472.570 0.358 50 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CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1785588128 IZSUCOHMLREHJS-FKAQHNMISA-N 457.955 0.814 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-c4cnccn4)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981110 SQNQJAIKHRCOIZ-SSPYTLHUSA-N 486.337 0.731 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1F 1786981951 HVDXGLVUQPCNEH-JLMWRMLUSA-N 470.306 0.350 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3n[nH]c4cc(Cl)ccc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786981963 SMIRDVZTPAMALI-OHEPNIRZSA-N 496.760 0.732 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(Cl)cccn34)C[C@@H]21)c1cccc(B(O)O)c1 1786984319 COIIDALSYSHDRB-KNBMTAEXSA-N 482.733 0.575 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3)C[C@@H]21 1788610626 MYGHBAHYSBQZCL-YSSFQJQWSA-N 453.499 0.357 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C[C@@H]21 1791254071 MDWRNKNSYYWJMU-WOYTXXSLSA-N 477.986 0.496 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792981900 YWELIXGDVSABAF-WUUQAYSMSA-N 459.971 0.823 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)n1)C2 1793879833 GIXLVNUIYKJHSC-WJNVRWDZSA-N 485.925 0.223 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccc3n1)C2 1797750945 WKWLIKCCBQDKGQ-VTEUUUEMSA-N 461.482 0.145 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 1801049809 GORCELYLMYKGEE-LBZHBENTSA-N 490.395 0.731 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)C1 1802236197 LUUMLBOHNYJOPM-KHMAMNHCSA-N 494.358 0.902 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803164782 SUJCMZNEZXMJGT-IOMROCGXSA-N 465.558 0.884 50 20 JCGD N=C(N)SCCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807121563 DOKIDEKDGLOBBJ-QFBILLFUSA-N 455.349 0.098 50 20 JCGD Cc1ncc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1810298595 KEXFJRHWJTUMMA-OXQOHEQNSA-N 460.498 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1 1810303347 QSIPRVMAWJXFFG-IIBYNOLFSA-N 485.508 0.756 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccn(C(F)F)n1 1810906816 IROAFPWGSADTBX-VQIMIIECSA-N 469.257 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnc3c(c2)CCNCC3)[C@@H]1c1cccnc1 1812380460 GIHOIPOLMSXPAQ-CPJSRVTESA-N 493.612 0.857 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2nn(C)c3c2CCC3)[C@@H]1c1cccnc1 1813071755 WEQUAZYBUSXKRA-UZUQRXQVSA-N 467.574 0.996 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)COc2cccnn2)[C@H]1c1cccnc1 1813388183 XETUOOKFUDGFIH-HRAATJIYSA-N 476.497 0.269 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)CC2)c1ccc(B(O)O)cc1 1815336816 FRGCGNFQIAQAMO-NVXWUHKLSA-N 496.398 0.840 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1(Br)CC1)CC2)c1ccc(B(O)O)cc1 1815343698 JQXIBZDMUIRCKE-GFCCVEGCSA-N 464.150 0.976 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360562 JCKWKFQJFKXCDF-INIZCTEOSA-N 476.327 0.334 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)C(F)(F)C(=O)O)n[nH]1 1815564870 ACMJBVITIUTUAK-CYBMUJFWSA-N 486.187 0.751 50 20 JCGD Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)ncc1[N+](=O)[O-] 1817621199 AZAYLURUMZPTAC-CQSZACIVSA-N 481.299 0.974 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)[nH]n1 1819402130 OTVATEFMIBIDJU-MRXNPFEDSA-N 479.457 0.516 50 20 JCGD O=C(/C=N/N1CCCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1819774758 UHVBNTZMCKWDSU-OHHQFBAHSA-N 455.349 0.520 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819801731 RMKJGUPWRHYTSB-QWHCGFSZSA-N 468.543 0.900 50 20 JCGD CCOC(=O)C1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CC1 1827060600 RTNBJYWFXFNKBK-HXUWFJFHSA-N 456.348 0.943 50 20 JCGD Cn1cnc(C(=O)N2CCN(C(=O)OCc3ccccc3)[C@]3(CCN(C(=O)[C@H](O)CCl)C3)C2)n1 1828667157 CJEGVDBPLGEVLA-VGSWGCGISA-N 490.948 0.481 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)no1 1828990273 YEDADMPCYUAGJE-HXUWFJFHSA-N 497.556 0.645 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](N)CN)CCN2C(=O)OCc1ccccc1 1829050546 RCLGDHXFLCIQOZ-WMZHIEFXSA-N 491.665 0.576 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(C)C(=O)CC3)C2)C1 1830535859 VIJOVPHHOUGBEX-SCLBCKFNSA-N 459.341 0.082 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1 1830540131 OPUFORLGQAPPRN-HBUWYVDXSA-N 463.373 0.181 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1 1831449221 JFBRRTMWQJQHQH-MLGOLLRUSA-N 453.355 0.132 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1831656696 HRSLYDRPICEMKW-QRWLVFNGSA-N 470.910 0.620 50 20 JCGD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832172878 ZQQPIZMXXLKEGM-FXAWDEMLSA-N 455.895 0.584 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(C(F)(F)F)c1)CCO2 1833794950 ANGJIIGHPLQENI-FQEVSTJZSA-N 487.479 0.543 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834823738 HHNGYNPOWVINTJ-OAQYLSRUSA-N 499.358 0.691 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1 1835185037 GMGOWYDJFNDDHK-MJGOQNOKSA-N 462.927 0.760 50 20 JCGD CO[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1835283554 YAPAJVWELCPITM-GBXCKJPGSA-N 483.525 0.143 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3n[nH]c4c3CCCC4)CC2)CC1 1835736956 MVIMJTDJWVVDSG-UHFFFAOYSA-N 494.600 0.786 50 20 JCGD COc1ccc(Cl)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1835933899 IJCLVSKISNLQKU-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4sccc4[nH]3)C2)C1 1835937185 RIXVCJASWOYIBM-QFIPXVFZSA-N 469.328 0.293 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccncc34)C2)C1 1835939384 PBJLWLMMJYZWFE-VWLOTQADSA-N 475.310 0.298 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835941165 JODSFMRCCOKRML-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD CCOc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cnc2c1cnn2C 1836378259 UWRCLJLHARQHRQ-HRAATJIYSA-N 481.937 0.037 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3ccccc13)CCO2 1836944282 GWMZCPMHDKGGPQ-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837025079 JQGMKQLAOZLGFC-UHFFFAOYSA-N 491.357 0.424 50 20 JCGD O=C1NC(=O)[C@H](CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)N1 1837116393 BUAQPLQPVDPIFF-GXTWGEPZSA-N 463.304 0.274 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nn1 1839201886 MORLPDRCIRNVMX-CXAGYDPISA-N 462.320 0.794 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)[S@@](=O)c1ccccc1 1839674183 ODDKUSWCNAIHPV-WKLFCCHUSA-N 494.614 0.012 50 20 JCGD COc1cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc(OC)c1OC 1839804675 VZILPYALSZCDQT-UOCOXSSCSA-N 498.960 0.782 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1839965177 PQUNAAKBDISSKT-ABAIWWIYSA-N 475.258 0.722 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)C(F)(F)F)C2)C1 1839966365 CDQPJFGDYUKTBM-ABAIWWIYSA-N 474.274 0.295 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(F)(F)F)c[nH]3)C2)C1 1840183987 MVYGNQYORMNAJI-LJQANCHMSA-N 475.468 0.477 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1 1840185219 NSAXDSRKAKJCJR-DEOSSOPVSA-N 484.557 0.520 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014996 XGELMNFYUPARCL-QGZVFWFLSA-N 465.315 0.498 50 20 JCGD C=C1CC(C(=O)N2CC3(CCCN3C(=O)[C@H](Cc3ccc(B(O)O)cc3)NC(=O)OC(C)(C)C)C2)C1 1843428639 HPQDMCMDZHZMIV-NRFANRHFSA-N 497.401 0.972 50 20 JCGD O=C(CNC(=O)c1ccc(F)cc1F)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 10124880 JOPXYVNDOZXESA-UHFFFAOYSA-N 466.466 0.940 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)CCNS(=O)(=O)c1ccc2c(c1)OCCCO2 24586050 UFAVERXFUPTPMS-UHFFFAOYSA-N 473.511 0.934 50 20 JCGD O=C(NNC(=O)c1cnn(-c2ccccc2)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1 28195624 FELZXVXKCPQFIF-UHFFFAOYSA-N 455.496 0.968 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)CCc2nc3c([nH]2)c(=O)[nH]c(=O)n3C)cc1OC 115855587 UPJNJBJNFQZCOP-UHFFFAOYSA-N 458.475 0.531 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)COc1ccc(C#N)cc1 726000211 MVRAKFRKZARCMD-SFHVURJKSA-N 492.941 0.971 50 20 JCGD COc1cc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)ccc1OC(C)C 726710571 GVYPSKHQQGCRDF-UHFFFAOYSA-N 485.545 0.955 50 20 JCGD O=C(CNC(=O)NCc1ccc(Cl)cc1)NNC(=O)c1csc(N2CCOCC2)n1 727365486 GIWNQSAUVDJANK-UHFFFAOYSA-N 452.924 0.894 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)C1CCN(c2ncccn2)CC1 728856498 SQQMJXVKADRWIJ-UHFFFAOYSA-N 494.599 0.487 50 20 JCGD CN(C)C(=O)Cn1cc(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)nn1 747785606 WGFDPTKAVBWNKO-NRFANRHFSA-N 461.526 0.754 50 20 JCGD COc1cc(N2C[C@H](C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cc(OC)c1OC 914437959 TXSMUQAAKKSHAJ-KGLIPLIRSA-N 455.533 0.558 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@@H]1CCN2CCCC[C@H]12 916638401 FXAIXBNEQFIYCR-QZTJIDSGSA-N 451.549 0.278 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2C)cc1 917721070 OXWJZUGEIFOHIK-UHFFFAOYSA-N 489.597 0.337 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)c1ccccc1C2=O)N[C@@H]1CCS(=O)(=O)C1 919884490 GVQZEZAMJANQKY-GFCCVEGCSA-N 463.493 0.195 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1)N[C@H]1CCS(=O)(=O)C1 919886717 ZCSQACAODLAXNM-LBPRGKRZSA-N 496.970 0.397 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1 920825265 IRECQPMTSYLJNL-UHFFFAOYSA-N 493.405 0.681 50 20 JCGD COC1(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CN(C(=O)OC(C)(C)C)C1 1778136405 MQSIBVPCJSAXBG-FOIQADDNSA-N 475.970 0.442 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032431 JUJJAXRNSOORLY-QHCPKHFHSA-N 469.546 0.782 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1 1779054367 IQIUOQRFSQXLOB-BSXCZMPLSA-N 468.518 0.241 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1779181212 YMXFLBPCRBDXLJ-MJXNMMHHSA-N 458.346 0.661 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1779955102 ZWKWNVVZOVQIQV-PWYGXMRTSA-N 497.537 0.334 50 20 JCGD CNC(=S)NCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780774543 CTTSOQSCLRIBKY-PVXIVEMSSA-N 453.378 0.675 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1)NC(=O)NCc1ccccc1 1780970641 WEEALFSGRTYESS-SQJMNOBHSA-N 487.601 0.979 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782210061 CIAKZGKUPNEUQJ-SPYBWZPUSA-N 461.401 0.904 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)NS(=O)(=O)CC)CCO2 1783343418 MWTYGAVLPKIPKB-XEZPLFJOSA-N 454.387 0.318 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1 1783419583 RAMQWXNKIRZSHE-DEOSSOPVSA-N 465.510 0.306 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)CCO2 1783868600 IXLPOEURZLIXNN-OBUYZQBDSA-N 467.950 0.250 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785539848 QWNKLVGZCZVKCQ-BDJLRTHQSA-N 464.407 0.708 50 20 JCGD N#Cc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1Cl 1789268050 OOVJATNSEVMKBZ-VDGAXYAQSA-N 467.718 0.799 50 20 JCGD CNCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726573 AROPKQQIZWUFGO-ACRUOGEOSA-N 474.606 0.312 50 20 JCGD COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)n1 1794529571 YFYTWNCQNAPLJV-DHMDNZFNSA-N 454.487 0.427 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CCN)NC(=O)OC(C)(C)C 1795584875 WCMMMAVPKHFPMR-UXXRCYHCSA-N 477.400 0.602 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccncc1C(F)(F)F 1796625212 FEDOQQXRTBEKJA-DPIQGUFMSA-N 478.431 0.616 50 20 JCGD Cc1ccc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)ccc2n1 1797008179 GCXKPFCKTDDQAS-JHDGKUDLSA-N 459.311 0.740 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1797849306 ZUVAWZVROISZQV-WGPDIRSBSA-N 453.499 0.893 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2 1798442167 ZXSGDTMWRBABBO-OVYGPGRDSA-N 454.531 0.338 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@](C)(Cl)CCl)C3)cn2[nH]cnc(=O)c12 1798467725 VWUFGJFBUGZFPG-MAAUKKLOSA-N 456.330 0.771 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1C)C2 1798522711 PPJKKCPGZZCTEQ-ZDUSMZPESA-N 460.487 0.818 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1799249970 WWUXFPNZYCPNMI-LBKYZSNHSA-N 491.969 0.022 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ncnn2C)[C@H]1c1cccnc1 1805276594 IKDLARRWVMKUDM-YCIBLXSWSA-N 463.502 0.664 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1807373324 BLDFHFDNXOZKCD-URXFXBBRSA-N 475.358 0.985 50 20 JCGD O=C1Cc2cc(C(=O)N3CC[C@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)ccc2N1 1807376603 VFSNUQPYXSOWSS-NTKDMRAZSA-N 484.321 0.889 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ncon2)[C@@H]1c1cccnc1 1808417809 QPZBNTGTHRFRQZ-BDGUZBFISA-N 450.459 0.918 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813419024 YGILUCVZVFRAEH-ZWCUEREDSA-N 455.563 0.993 50 20 JCGD C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1 1814783814 UGAQXWXIPCXLDN-UKRRQHHQSA-N 460.373 0.719 50 20 JCGD COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)nc1 1817875604 XAYQNDDOKRTBFU-AWEZNQCLSA-N 452.301 0.766 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1 1818110379 DHHKRAHYQZWUFI-DXRSZSRVSA-N 477.547 0.971 50 20 JCGD CCOc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cn1 1819793676 RBRIZVWKQFIETA-LLVKDONJSA-N 482.526 0.870 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1)C(=O)C(=O)O 1822869295 IAMIHWZYYYVKCL-ZKANADHPSA-N 451.332 0.834 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1 1823046053 BOAZZMQSJZLUBL-RSNLOSSFSA-N 471.543 0.810 50 20 JCGD CCOC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1 1824860158 PBUWQHGCURRDLQ-AWEZNQCLSA-N 457.317 0.392 50 20 JCGD COc1nccnc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050306 MEBJSRGJYNXQRM-IBGZPJMESA-N 452.320 0.712 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525561 SFMWMTGDYIFXET-IIBYNOLFSA-N 453.923 0.767 50 20 JCGD Cn1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)cccc1=O 1828926061 ZHMQXXCUMZFYTE-LJQANCHMSA-N 466.542 0.931 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(-c3ccccc3)on1)CCO2 1829590520 KRVUHSPHSOIITF-VWLOTQADSA-N 491.309 0.405 50 20 JCGD O=C(CCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)Nc1ccccc1 1830668363 SHLQGQGATUVFGX-PGRDOPGGSA-N 467.950 0.852 50 20 JCGD O=C(C1CCN(c2ccccc2)CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830719836 LXQZEHKCBLCKRQ-NFBKMPQASA-N 465.978 0.959 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831872030 ZSWQVIVAMVKOFP-SJLPKXTDSA-N 473.640 0.307 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1832004578 HFRVPVJWDAZDEP-STXHMFSFSA-N 479.933 0.613 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)c(C)nn1C)CCO2 1833705430 DBZSQDLCKHJGIU-IBUSPFOHSA-N 489.508 0.072 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(=O)n3C)CCO2)C1 1833869510 KIUMNNWVJGMAKI-AUUYWEPGSA-N 456.337 0.486 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3C(N)=O)CC2)CC1 1833921011 NLHKHNASRJAJNW-QGZVFWFLSA-N 451.955 0.620 50 20 JCGD CCc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1Cl 1834905810 SSHUEGQARMIEJI-UHFFFAOYSA-N 487.797 0.804 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C3(C)COC3)CC2)CC1 1835116238 CUPOSZUBAODLQL-WGOQTCKBSA-N 458.563 0.729 50 20 JCGD CO[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1835283555 YAPAJVWELCPITM-RDPSFJRHSA-N 483.525 0.143 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCOCC3)CCO2)C1 1835420032 UMMDGOUEIQFKRE-VAHWYXDJSA-N 475.546 0.394 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835738063 AYWYZPGZHRWBJN-KRWDZBQOSA-N 482.589 0.636 50 20 JCGD O=C(c1cccn2c(O)nnc12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836718496 YZIQGULQLZHQCZ-MRXNPFEDSA-N 451.911 0.647 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1836919797 SWOYMKMLGLPOOA-HNNXBMFYSA-N 465.942 0.832 50 20 JCGD N#Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(Cl)c1 1837460137 WETDEVMKUHFASG-HSZRJFAPSA-N 498.927 0.594 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1 1837460158 WOELLTBRSTWSAZ-QFIPXVFZSA-N 475.452 0.347 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)C2)C1 1837460583 HLVLMUNXHDADPX-VXEMUYFQSA-N 471.558 0.581 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1 1837710464 ZJZICVNACVVSGW-NRFANRHFSA-N 464.595 0.962 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1 1837760214 ZBVHDLGYIZCCLD-BFUOFWGJSA-N 471.352 0.778 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc4nccn4c3)CC2)CC1 1837920400 UFUYBDFBBDHWHJ-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD O=C(c1cc(Cl)ncn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1838259194 SUILBDFYBWEWBA-DOMZBBRYSA-N 451.680 0.891 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C3CCC(O)CC3)CC2)CC1 1838395305 BJSBYCGVCUCKTA-UHFFFAOYSA-N 473.574 0.848 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nc(C)c(C)s1)CCO2 1838407019 MUUQSOJKJBKBKM-IBUSPFOHSA-N 488.570 0.964 50 20 JCGD COc1cccc(OC)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838882005 GILORDFYRKEAGJ-XMMPIXPASA-N 499.524 0.086 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)cc1)CCO2 1838960328 IMHYEIVNHCHTJW-NRFANRHFSA-N 452.939 0.783 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(F)CCC3)C2)C1)NC(=O)NCc1ccccc1 1839054871 NMEGBMQSXCMLMX-QHCPKHFHSA-N 491.564 0.681 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2)C1 1839141942 YOVKIAVPTGOLHH-MRUHUIDDSA-N 477.986 0.736 50 20 JCGD COCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200256 FCDXEQQWHYOANH-CZUORRHYSA-N 450.261 0.582 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1 1839371877 TXHYYAZKPXSPPN-BUXKBTBVSA-N 473.320 0.904 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ccncc13)CCO2 1839508845 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C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830719304 BUHPHRRFZSTQCL-BXTJHSDWSA-N 463.959 0.203 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C1CC1 1830719937 PDSBCIZLLPMJHU-HYFFOGBASA-N 489.997 0.736 50 20 JCGD COc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(OC)c1OC 1830724787 CJCRICIZBSADDG-KSFYIVLOSA-N 486.949 0.311 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnccn3)CCO2)C1 1830961038 VUPNEXOSIRDGMP-HTAPYJJXSA-N 497.980 0.608 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831158843 DWINSMCTEFBXPL-XDHUDOTRSA-N 499.593 0.936 50 20 JCGD O=C1CCCCN1CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1831765625 OPMWFBZHZCWBKM-OAQYLSRUSA-N 455.364 0.612 50 20 JCGD CC(C)c1csc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)n1 1833282064 TWJYTPCVDRPVBB-QFIPXVFZSA-N 473.360 0.330 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOC3=O)CC2)CC1 1833386090 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1837537706 QODHUPJWCPOQAD-UHFFFAOYSA-N 455.519 0.345 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920424 XGMXZDHDCQKVHR-NRFANRHFSA-N 486.403 0.005 50 20 JCGD Cc1nc[nH]c1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838143228 MTYIVLQLGPWMMR-UHFFFAOYSA-N 455.519 0.643 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)CCOC1 1839191219 AGDHVSQQJTWHRU-JSNMRZPZSA-N 479.933 0.661 50 20 JCGD CN(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1 1839201149 XMYXFRSAJKOTLD-YJBOKZPZSA-N 459.316 0.908 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1O 1839426702 IWGMXTJUQSGFKX-XMMPIXPASA-N 499.524 0.173 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839767666 UVHJNTDPGCFNQU-MHECFPHRSA-N 478.565 0.834 50 20 JCGD COc1ccccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839954337 NJMFCZSTBNGLJI-DEOSSOPVSA-N 483.525 0.006 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1839965141 OBOADNDGRDLNHN-BDJLRTHQSA-N 460.285 0.561 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840182251 AKVGBSAOWXEFSL-WATLYSKOSA-N 488.585 0.628 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4occc4c3)C2)C1 1840184471 PFAMRSVXBAQYQX-HSZRJFAPSA-N 458.515 0.876 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cc(Cl)c1)CCO2 1840709998 SQFBXKMXRYUWRQ-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD C[C@H]1Oc2ccc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cc2NC1=O 1844729346 FHDFGDHLXCRAJE-CYBMUJFWSA-N 464.482 0.535 50 20 JCGD O=C(COC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 9362717 XHWRDDAQJNXGPL-UHFFFAOYSA-N 490.494 1.000 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1 23723083 LRJDKUMBEHFBRK-UHFFFAOYSA-N 479.511 0.995 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2cccc(-n3cnnn3)c2)c2ccccc2c1=O 60060275 QOILLOALBCWTRH-UHFFFAOYSA-N 454.472 0.406 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c(Br)cc1Cl 728261168 OLLHUKJWRAXMCK-SSDOTTSWSA-N 489.753 0.633 50 20 JCGD O=C(COC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)NNC(=O)[C@H]1COc2ccccc2O1 728344541 WLJKXFRLUDKZEZ-MRXNPFEDSA-N 459.367 0.510 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1 744446655 HIXLLUBUVNGHBR-VXGBXAGGSA-N 460.940 0.424 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNC(=O)N3CCOCC3)CC2=O)cc1 745995841 DXLJABVRVBPBHL-OAHLLOKOSA-N 467.548 0.143 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC3CCN(CC(F)F)CC3)nc2)CC1 747309869 UNTRNEGJHGZTNZ-UHFFFAOYSA-N 461.539 0.373 50 20 JCGD COC(=O)c1c(C)cccc1S(=O)(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 747407900 YLRYNIHMEVETMG-UHFFFAOYSA-N 461.905 0.706 50 20 JCGD O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)c1nn(-c2ccccc2)cc1O 789852771 GVMQEBSKORACRI-QHCPKHFHSA-N 460.450 0.732 50 20 JCGD N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 913600752 GYMATVOTIFUVOM-UHFFFAOYSA-N 491.551 0.082 50 20 JCGD NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=O)Cc1cccc2ccccc12 914604425 TYMKQWFJXDNJKF-UHFFFAOYSA-N 454.464 0.785 50 20 JCGD CN1CCN([C@@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c2cccs2)CC1 915902657 YYNAUBIYNKWULW-KRWDZBQOSA-N 455.548 0.657 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 919684194 JYJOVWNXENYJBA-QGZVFWFLSA-N 474.605 0.357 50 20 JCGD CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 919886602 XSYINDQMUNQRKM-HNNXBMFYSA-N 472.589 0.771 50 20 JCGD Cc1c(NC(=O)CSCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c(=O)n(-c2ccccc2)n1C 1115817077 NXVXBXJMAJFOHL-KRWDZBQOSA-N 495.627 0.648 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1 1778574079 UYMUQUKKMLTCFR-SJUCLPJRSA-N 494.508 0.595 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1 1778739952 WEKZOIJSTZESDN-WGLQLPMYSA-N 464.486 0.307 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1 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JCGD CN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793115448 ODVCROGAHXYUHL-QEOTZNIISA-N 489.013 0.986 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCNC2=O 1794974861 LPJCWLMATQXXIH-YJMBJCRISA-N 496.474 0.715 50 20 JCGD Cc1noc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN(C)NC(=O)NCc2ccccc2)C3)n1 1796256273 SMLXESNVVLEGPQ-REPLKXPHSA-N 469.546 0.905 50 20 JCGD COc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1 1796441516 MLLIGMADYDJZQS-DHMDNZFNSA-N 454.487 0.427 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)C2 1797748462 DXIQNMNOCNRSLH-GSFSLZFCSA-N 479.537 0.184 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)ncn1 1798308408 BCGCRQXHBANOPQ-IZJYNLIKSA-N 459.894 0.467 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097155 FSOYFHGLDGKYKU-DMUMMCEESA-N 481.981 0.176 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cc(C)c(O)nc1=O 1801972203 MISYKIKEHCURIO-XFMPKHEZSA-N 457.325 0.020 50 20 JCGD N[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccn1 1807161955 DFVNPLTUDFNFDH-NYVOZVTQSA-N 459.315 0.176 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363743 PLLXJHLZSUPHCM-GCJKJVERSA-N 470.298 0.438 50 20 JCGD O=C(CNC(=O)c1ccco1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807588569 PTZNBGGLLFWQTC-AVRDEDQJSA-N 476.298 0.104 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1 1808414368 IBAHBTRGHZTCSU-ZOCUSQIASA-N 465.514 0.500 50 20 JCGD COCc1oncc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808820763 GSKZPXHZYPJAPW-DYESRHJHSA-N 464.287 0.529 50 20 JCGD Cn1cc(CCC(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)cn1 1810021969 OTFBRCYLCAJXDD-UHFFFAOYSA-N 453.547 0.896 50 20 JCGD O=C(C/N=C/c1ccco1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810389940 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Cc1nnc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)s1 1817475612 VNVAZOHOCJEXLW-INIZCTEOSA-N 454.321 0.798 50 20 JCGD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)n1ccccc1=O 1819570686 PLFNUSHCAPQTFR-KXBFYZLASA-N 463.303 0.818 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826086481 WOZBSXOVYIJWQH-SUZBBLJPSA-N 488.574 0.562 50 20 JCGD CC(=O)c1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n[nH]1 1827055732 DEVIXGBEASXKQH-OAQYLSRUSA-N 452.320 0.839 50 20 JCGD CN(CC(=O)N1CCC([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)CC1)NC(=O)NCc1ccccc1 1828863916 HPTAVMWLSUUXLQ-OAQYLSRUSA-N 497.600 0.828 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc2)CC1 1829693840 YFMUXKIPTRSWNF-NZQKXSOJSA-N 480.993 0.108 50 20 JCGD COC(=O)C12CC(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)(C1)C2 1831602425 KAINRHGGMUFJJJ-NWSMCOELSA-N 468.359 0.943 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)CC1 1832288464 LXTBQFWGWCVWKE-ZXSRHQFASA-N 469.550 0.988 50 20 JCGD CN(C)c1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1 1833365209 OLWRBFUCRXLSCB-MAUKXSAKSA-N 459.316 0.908 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1 1835350855 DPMJEWDLOQOEIV-IBGZPJMESA-N 479.382 0.893 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737476 XNRYJHLZVRRKBK-KRWDZBQOSA-N 495.584 0.733 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1Cl 1835926148 HOLQIWPZMJFOFJ-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CCOc1ccccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931149 HLARLZSUWHHMJI-XMMPIXPASA-N 468.315 0.149 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835932211 UEYYWBGGWIRBNT-WHTWLKBESA-N 480.326 0.158 50 20 JCGD Cc1ccn(C)c1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836193283 ZNPFJVJSRDQSHD-UHFFFAOYSA-N 452.364 0.512 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836718195 JSAUTCPODGEBOH-INIZCTEOSA-N 468.963 0.968 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccccc4n3)C2)C1 1837458787 BYOUQSJSBUXLDF-DEOSSOPVSA-N 491.508 0.012 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)CCO2 1837471563 OGBMLICNKAAOEI-KXEAFHOWSA-N 494.378 0.324 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1oc(C)nc1C)CCO2 1838004126 YNFVUTUVPAQTFI-BHSKHCGUSA-N 472.502 0.495 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1sccc1Cl)CCO2 1838224324 LWWABVAATNIUMA-FQEVSTJZSA-N 479.946 0.784 50 20 JCGD O=C(c1cnc2snnc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1838508923 DUXBVQNUHBLBPL-WBMJQRKESA-N 474.312 0.847 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](NC(C)=O)c1ccc(F)cc1)CCO2 1839040019 OUCBUELOCGDNJW-JQVVWYNYSA-N 485.940 0.713 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1C 1839404262 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O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840887178 YMEPWYUPHFFJJZ-VQIMIIECSA-N 459.858 0.333 50 20 JCGD O=C1C[C@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)CN1Cc1cccs1 1843013260 ZVTPSNSPIIMZCA-KRWDZBQOSA-N 467.356 0.294 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015664 SPAZBOPWMCWPCM-ROUUACIJSA-N 475.326 0.531 50 20 JCGD O=C(CN(CCO)CCO)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1 1845942513 LXRBCSDNXJWVQO-SFHVURJKSA-N 468.392 0.483 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CO[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)C1 1846142236 JZRMBZLITASZID-FGTMMUONSA-N 493.605 0.445 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1846330655 NDAYGKWIVZOVHE-KGLIPLIRSA-N 481.999 0.118 50 20 JCGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CNC(=O)[C@]23CCN(C(=O)OC(C)(C)C)C3)C1 1847101815 QAUNFBZEMFBLQB-KXNSMUHISA-N 499.008 0.817 50 20 JCGD O=C(OCc1ccccc1)N1C[C@@H](O)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847568029 KOYLYGQCGKVTQM-VMXHOPILSA-N 465.934 0.560 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1 14337141 XFFRTSOXEPAMAY-UHFFFAOYSA-N 483.550 0.877 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)c3nc(-c4ccccc4)n(-c4ccccc4)n3)cnc2n(C)c1=O 46773345 LSBRYRYKJQJHQA-UHFFFAOYSA-N 496.487 0.955 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2C[C@H](O)CN2C(=O)c2ccc(F)cc2)cc1OC 725956417 UGFDCVGDJSJUMM-IRXDYDNUSA-N 489.456 0.423 50 20 JCGD COCCCNC(=S)N(C)NC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c1 726077538 YXDFBBDHTPZCBG-GASCZTMLSA-N 458.606 0.972 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=S)NCC(N)=O)cc2)cc1 727063670 IYIRXGYKCWNDKA-UHFFFAOYSA-N 451.530 0.480 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cc(C(C)=O)c[nH]1)N(S(C)(=O)=O)CC2 731761074 QKMAGJRUWZOHMF-KRWDZBQOSA-N 478.527 0.945 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)n1 759999582 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50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839428666 RQBMXZCDMJUFDO-HNAYVOBHSA-N 459.858 0.712 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1839726331 IKIITWWWBPJSNM-UGOOHZPOSA-N 488.585 0.928 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1 1839774868 WEQWSUJWKIVVCK-YLJYHZDGSA-N 460.955 0.630 50 20 JCGD CCC(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1839828890 WOGDPSUGQASDAY-VBKZILBWSA-N 461.943 0.554 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCCC3=O)C2)C1 1839966702 NPMVRDODDPZBSY-DNVCBOLYSA-N 460.369 0.629 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1840153554 SGBXNTVXUDSODL-GQANSBOFSA-N 469.922 0.162 50 20 JCGD COc1cc(C)cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840184961 GNEYUBGPSOVOLI-QHCPKHFHSA-N 462.547 0.447 50 20 JCGD CCSc1cccnc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185932 WNTOVLHOTKTDJS-QFIPXVFZSA-N 479.603 0.637 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCc1cccc(O)c1)CCO2 1840268251 NKZYIIWLDUPOSQ-HSZRJFAPSA-N 462.547 0.154 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1840289826 NZYRKFDYNQPMBJ-RCDCFZSISA-N 477.917 0.903 50 20 JCGD CCO/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1840310704 HMBUYDBUGQYBHV-XJCKULRNSA-N 489.573 0.339 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840716817 UMSHEHRLUDZOEP-HOYKHHGWSA-N 471.558 0.757 50 20 JCGD O=C(C1CCN(c2ccc(F)cn2)CC1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012133 GWXKTSGIURHBDE-UHFFFAOYSA-N 466.322 0.634 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263492 KMBSXBFUBOEJQT-UHFFFAOYSA-N 465.510 0.922 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1 1847822603 PDMRQSSSQMYHOF-WDSOQIARSA-N 479.603 0.215 50 20 JCGD O=C(NNC(=O)c1ccc(N2CCCCC2)c(S(=O)(=O)N2CCCCC2)c1)C(=O)NC1CC1 9890269 IHOVJFRVJYKHDV-UHFFFAOYSA-N 477.587 0.891 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 9930986 ZRSWJCFLASDYKE-QGZVFWFLSA-N 469.585 0.158 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccsc1)c(=O)n2Cc1ccccc1 10161647 AJIUCZKEKZMLOE-UHFFFAOYSA-N 482.522 0.577 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 10214415 OHCFRDXTNKGLOQ-HNNXBMFYSA-N 495.535 0.090 50 20 JCGD O=C1COc2ccc(S(=O)(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc2N1 24259156 FCCGLYVOBKAISO-UHFFFAOYSA-N 480.524 0.425 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3C(=O)CCC3=O)cc2)cc1OC 104489246 DPCKMLMLKMBLKD-UHFFFAOYSA-N 455.423 0.975 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)COc1ccc(C#N)cc1 726000920 QVPCPDOOLVIVBS-GOSISDBHSA-N 492.941 0.971 50 20 JCGD CN(C)c1cccc(C(=O)NNC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)c1 726073280 FKNBMGWPAJCQPD-WMZOPIPTSA-N 466.947 0.991 50 20 JCGD CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 726088001 AGMZISIHWHMEST-UHFFFAOYSA-N 455.518 0.236 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3cccc(C#N)c3)cc2)CC1 728828371 VGGWKZKYKUORSS-UHFFFAOYSA-N 455.496 0.486 50 20 JCGD O=C(CCn1c(S)nc2ccccc2c1=O)NNC(=O)C1CCN(c2ncccn2)CC1 728889743 ORENBPMYHAHQGQ-UHFFFAOYSA-N 453.528 0.929 50 20 JCGD COc1ccc(OCC(=O)NNC(=O)NCCN2CCN(C(=O)OC(C)(C)C)CC2)cc1 744896211 RTGLJZZOSYRYER-UHFFFAOYSA-N 451.524 0.957 50 20 JCGD CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 749344304 IZCQNNUUICYMHG-UHFFFAOYSA-N 471.536 0.176 50 20 JCGD COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 749559685 CVSLDLVPDBWFLZ-UHFFFAOYSA-N 495.579 0.966 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)C1CCN(S(=O)(=O)c2c(C)noc2C)CC1 825644103 TYQZNDHIBHRTNV-UHFFFAOYSA-N 465.532 0.960 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)c1ccc(-n2cnnn2)cc1 913156168 YNADHAGHLZOXNB-UHFFFAOYSA-N 451.415 0.070 50 20 JCGD CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc(C3CC3)nc21 915197601 ZNQFFGWBIFYBSR-UHFFFAOYSA-N 471.495 0.873 50 20 JCGD O=C(NCc1ccc2c(c1)OCCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915894180 HGYWBZKXVAOKRL-UHFFFAOYSA-N 476.511 0.623 50 20 JCGD CN(C)[C@@H](CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccco1 915896429 DNEHBKICRVODQZ-IBGZPJMESA-N 493.586 0.866 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NC2CCN(CC(=O)NC)CC2)c2ccccc2c1=O 916518934 ORPSKYNLTYCRNO-UHFFFAOYSA-N 457.535 0.351 50 20 JCGD COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 917720113 BXADROHRDLWADS-UHFFFAOYSA-N 498.583 0.270 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2cc3c(c(C(=O)O)c2)OCCO3)c2ccccc2c1=O 919955221 DFRSKFWGDSKRKJ-UHFFFAOYSA-N 488.478 0.899 50 20 JCGD C[C@@H](OC[C@@H]1CCCCO1)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 921146172 MAEIKRCGZLNSLU-MJGOQNOKSA-N 483.587 0.762 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCC3)C1 1779120950 JGGVGMRRKPCDEO-AUSIDOKSSA-N 467.530 0.269 50 20 JCGD Cc1nc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cs1 1779371520 XDHBQNSOGNVOQN-XMSQKQJNSA-N 472.571 0.820 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CNC(C)(C)C)CCO2)C1)NC(=O)NCc1ccccc1 1780969947 PFISQEYWQXXYLS-XMMPIXPASA-N 474.606 0.551 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)C1 1782256538 SPZBHDOLLZDPMK-AJAKECSLSA-N 489.997 0.472 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c(O)cccc34)C2)C1 1782505600 YKYRKBQGTSPFMR-XMMPIXPASA-N 461.283 0.378 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@]34C[C@@H]3CCN4C(=O)OC(C)(C)C)C2)C1 1783558695 RXPWEAATLDSRNI-PKKBDPGCSA-N 493.605 0.589 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1783937398 JCIHBUYGIMWJAW-QHCPKHFHSA-N 460.531 0.219 50 20 JCGD COC(=O)[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)NC(=O)OC(C)(C)C 1784093642 CURYXKXYQZGVKG-QMHWVQJVSA-N 491.969 0.022 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@H]1CC(c2ccccc2)=NO1 1784404806 UGGXEHWZAHFPSJ-MHADKKCISA-N 477.326 0.153 50 20 JCGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)cnn1C 1786187728 NQGRZAFFBABOEW-BVSLBCMMSA-N 497.600 0.668 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)nc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979537 WBETUVNGCHWQLK-SZMVWBNQSA-N 477.248 0.687 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1788739802 NAAWSLWNWJLNJX-UHJLUNJOSA-N 474.562 0.405 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(Cl)c(O)cc1O 1789993405 HPGISUYMLXGPRW-RISOHXOYSA-N 474.706 0.338 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)nn3)[C@H]2C1 1790588295 AUGSQDXPOFNYNL-RFGFWPKPSA-N 457.325 0.572 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4ccccc4O3)[C@H]2C1 1791230757 MOZPKUYTRMJWJW-VHHKXPHXSA-N 479.537 0.672 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C)c3C(F)(F)F)C[C@@H]21 1791288838 XBMZBZUBMUDPLY-QEJZJMRPSA-N 474.484 0.405 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1 1791290621 CKXIBEHXVSEMRO-FNHZYXHNSA-N 480.537 0.809 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]21 1791292461 RVHBIGWINQRMQM-PTDRCKJRSA-N 473.530 0.961 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(C)c1C(F)(F)F 1794275361 FZCXYDQRMHREBT-MJXOOREPSA-N 495.462 0.776 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1796190358 QNFKCPPVIDOAES-HNKHHVNMSA-N 476.264 0.775 50 20 JCGD Cn1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c(C(F)(F)F)n1 1796191827 CQAPPGYCXADYJC-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD CCc1c(Br)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)nn1C 1796408852 VWDUMEHXKCLGNX-MUJYYYPQSA-N 489.179 0.990 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2cc(O)ccc2n1 1796859818 QPUXBBAVQPJBDE-FAQVEIGNSA-N 461.283 0.137 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798439502 DDNWTHHSPOOMPE-BASYENTBSA-N 472.546 0.946 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@](C)(Cl)CCl)n(C)c1=O 1800077734 HYOLJLONILWLOZ-TXTZDMIGSA-N 485.372 0.308 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2 1800332992 KMFCNZDJZNJLAW-SDGGPSBXSA-N 495.446 0.506 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCOCC2)c1)c1cccc(B(O)O)c1 1800499880 NWYCASIECAASFJ-UADZTWIMSA-N 463.343 0.769 50 20 JCGD COc1ccc(F)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1801101705 SJDIFTWQOBLMGW-MFKICJERSA-N 450.511 0.339 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1C 1803287222 QGHYWKYZPGLGCT-CVDCTZTESA-N 461.331 0.366 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc1 1808895292 QCBWGWNBXGAGGB-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD Cn1nc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c2c1CCC2 1809978628 FBAQDCHXDCKUSX-UHFFFAOYSA-N 450.348 0.747 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810249502 YJKHSVPPRXBLIJ-GIVPXCGWSA-N 451.332 0.654 50 20 JCGD C/C(=C/C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(=O)O 1810310040 UFUVURGUJFBSSZ-JOCXJALTSA-N 452.471 0.431 50 20 JCGD NC(=O)c1nccnc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1 1811191856 RABLNPYGIVUBLZ-GLQYFDAESA-N 465.283 0.981 50 20 JCGD COCCOCCOCCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1812928674 JYOMTFPFUAHYJU-BJLQDIEVSA-N 457.955 0.757 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1ON=C(c3ccccc3)O1)CC2)c1ccc(B(O)O)cc1 1815344429 ZIZLNOYKUNSMJR-ZHRRBRCNSA-N 492.322 0.783 50 20 JCGD O=C(C#CC1(O)CCCCC1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356793 RRRQLTVEYJQNGS-KRWDZBQOSA-N 467.356 0.747 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1-n1nccn1)CC2)c1cccc(B(O)O)c1 1815360142 OQRYRIFGFDSNIX-INIZCTEOSA-N 488.338 0.943 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(Cl)nn1)CC2)c1cccc(B(O)O)c1 1815360265 DHHFEGCEOXYABJ-LBPRGKRZSA-N 457.708 0.806 50 20 JCGD CC(=O)O[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(C)C 1819248178 XVSBVBHYXLKSGD-QUCCMNQESA-N 456.308 0.983 50 20 JCGD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1)N1CCN(C)CC1 1820787866 PFKGXTFRKWPRPX-HNAYVOBHSA-N 483.577 0.350 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)no1 1822414918 NXFPWMRONSZFMT-INIZCTEOSA-N 474.522 0.501 50 20 JCGD Cc1cc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)nn1C 1824298192 VICZBEMXRCHYFD-QFIPXVFZSA-N 452.364 0.884 50 20 JCGD COCCn1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n1 1827052777 FRPIFBLBHDNEOA-JOCHJYFZSA-N 468.363 0.756 50 20 JCGD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)N1CCN(C)CC1 1827056048 AFSNPPWKJYNFEY-WMZHIEFXSA-N 470.423 0.236 50 20 JCGD COCCn1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n1 1827059382 OGIUOAMYLKBWIA-QFIPXVFZSA-N 468.363 0.756 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725162 GUENOUDTKJQYEU-GSHUGGBRSA-N 489.997 0.832 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726001 NELWJJOGEQDZAJ-DXIQSLLYSA-N 452.935 0.747 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cncc(OC)c3)CCO2)C1 1832918696 BJPHRPPZCVDYJW-NQIIRXRSSA-N 455.939 0.733 50 20 JCGD Cc1cncc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1832963326 VFADXVMRLAIWQG-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD COc1cccnc1CCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833796215 KRWLYZJXMVTVMW-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1 1835844299 QVZJMGOUXJKNEL-YLJYHZDGSA-N 465.422 0.945 50 20 JCGD Cc1cc(F)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1F 1835933980 KIWZPLXATXJDRT-HSZRJFAPSA-N 474.269 0.337 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)ccc2c1OCCO2 1836460969 PJMHGOIGRBKONU-HRAATJIYSA-N 454.907 0.436 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1836727792 ULBGXXJGQBONGF-GQWLDOHISA-N 493.960 0.392 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3sccc3F)C2)C1 1837456161 JUAVWEGMYIUOJN-HXUWFJFHSA-N 463.491 0.270 50 20 JCGD Cn1ccc(CC(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1837948300 HYRIGBREADYLJR-UHFFFAOYSA-N 469.546 0.274 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3=COCC3)C2)C1 1838528377 UFDIPLOUBVSCGI-QFIPXVFZSA-N 475.454 0.894 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](COC)NC(=O)OC(C)(C)C)C2)C1 1839145028 RCXDOCLDXIBXPO-CKJXQJPGSA-N 477.986 1.000 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1839151456 RVBKEHRYLVSUBV-MOPGFXCFSA-N 459.330 0.487 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@](C)(O)CC(=O)O)C2)C1 1839155239 PELBCLINUKLIHL-KZNAEPCWSA-N 455.335 0.295 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839790933 KRPSAFWYVPQHFW-HSZRJFAPSA-N 496.992 0.721 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1839964137 IJDSQDZRODOKGB-AUUYWEPGSA-N 472.336 0.639 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1 1840153207 HMZGUNVGHXPCGR-IIBYNOLFSA-N 463.922 0.796 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cc(C)cnc34)C2)C1 1840153275 JOBWODNNXIVEGM-OXQOHEQNSA-N 451.911 0.362 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1 1840154448 XCSBPEWWKCAPAF-KKSFZXQISA-N 463.922 0.796 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4cc(C)ccn34)C2)C1 1840155040 NSXVWBDACKAWDN-IERDGZPVSA-N 450.923 0.967 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COCc3ccc(OC)cc3)C2)C1 1840156215 OVMRUZKGDCURMN-KNQAVFIVSA-N 470.950 0.922 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1 1840184989 GTBMJIIFELVOST-JOCHJYFZSA-N 492.964 0.659 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012423 NTDKROUEZNMWTI-MZNJEOGPSA-N 469.347 0.583 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@H]2Cc3[nH]nc(C(F)(F)F)c3C2)C1 1845856886 ICKABRPPEIKRMJ-CYBMUJFWSA-N 462.237 0.340 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)[C@H]2C1 1846141306 LHWNDIYCUAKOJV-FXUDXRNXSA-N 457.955 0.671 50 20 JCGD CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1 9754510 STWHXIBAWJNUEY-UHFFFAOYSA-N 472.527 0.895 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 728509754 MFOGSMLIVXGWDL-ZCFIWIBFSA-N 457.374 0.971 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCNC(=O)OC(C)(C)C)nc2)CC1 729054467 WXBOYWKLBPLUSJ-UHFFFAOYSA-N 471.584 0.559 50 20 JCGD Cc1cc(N2C[C@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC2=O)ccc1Br 729276641 JQTUEXTXVPMTSJ-GHMZBOCLSA-N 461.338 0.196 50 20 JCGD CC(C)c1noc(CCCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)n1 749356258 CNNYYIQKHAUOTM-UHFFFAOYSA-N 466.568 0.783 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1 749487023 KOLLXUBQDHSTGQ-MRXNPFEDSA-N 459.480 0.885 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CCc1cscn1 751047643 QCYIUWNZCPLSJW-UHFFFAOYSA-N 452.558 0.877 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CNC(=O)c3ccco3)c2)C[C@@H](C)O1 751211149 CWFVQCIJLJPTEY-OKILXGFUSA-N 464.500 0.269 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)ccc1Cl 915789129 OSOCOUHJXSTXDM-UHFFFAOYSA-N 496.901 0.395 50 20 JCGD CC(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CCOCC1 916254316 UQEHNGIKXVHLHL-IBGZPJMESA-N 483.591 0.008 50 20 JCGD CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 916733726 HOMVHPNPPZIZIT-UHFFFAOYSA-N 498.583 0.927 50 20 JCGD COC(=O)N(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1 919687057 NYZAXFRBSCOIQT-UHFFFAOYSA-N 450.473 0.955 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)C1 919886524 UNYNQZBFITUCPR-LZWOXQAQSA-N 472.589 0.484 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2cccn2cn1 1778721303 CLDYDZZMZMWHRS-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4nccc4c3)C2)C1 1778731177 ZKPRZBAEDZMDPC-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1c(F)ccnc1Cl)CCO2 1779028323 IVHLNVQRUMKBMJ-FQEVSTJZSA-N 462.869 0.630 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1scnc1C1CC1)CCO2 1779029299 VPXFYZCMSVRIQX-NRFANRHFSA-N 456.528 0.776 50 20 JCGD CN(C)c1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779032160 DBCCDHJCXNFZLD-HSZRJFAPSA-N 452.515 0.508 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(F)cc3F)CCO2)C1 1779034906 WVQUQAUCXAGDSM-QFIPXVFZSA-N 459.453 0.650 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1779182110 UHYGMRCDJTWBIK-FHSNZYRGSA-N 454.325 0.208 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nn[nH]c2C(F)(F)F)C1 1780196887 YFZNXPOEBNOOPH-BFUOFWGJSA-N 496.450 0.263 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)N1CCOCC1)C2 1780712716 VQGMPWQSHZMGNU-WTLGNFPFSA-N 452.379 0.387 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968246 CJZACHDUIOZNBN-MHECFPHRSA-N 488.589 0.077 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CS(=O)(=O)N1CCCC1)C2 1782173105 XMXUXUAVESNZLW-GPMSIDNRSA-N 466.000 0.180 50 20 JCGD C[C@@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)n1ccnn1 1782751272 DQTOFAQQGXNSKJ-AVYPCKFXSA-N 470.958 0.801 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC34CN(C(=O)OC(C)(C)C)C4)C2)C1 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465.363 0.008 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835933816 GIEDBTSAZKSNLX-BVZFJXPGSA-N 477.326 0.377 50 20 JCGD Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)sc1C 1836074049 DBZCDJYCVDQGDE-UHFFFAOYSA-N 470.404 0.939 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1 1836413740 NWCUFPFYTLYPNV-IUODEOHRSA-N 485.420 0.576 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2 1836625086 OJFFCNMRWOVACN-RTWAWAEBSA-N 484.280 0.354 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc(Cl)c(Cl)c1)CCO2 1837915107 AIHDLGJYASRWKF-OAQYLSRUSA-N 494.140 0.452 50 20 JCGD O=C(CC(F)(F)C(=O)O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919431 RBSCZKLLZHIDPV-UHFFFAOYSA-N 468.262 0.089 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cnn4ccncc34)CC2)CC1 1837920393 SQMAFBIPNJWMGJ-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839153838 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CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CCC3)C2)C1 1840184920 HIIATDYJQVRSAV-XMMPIXPASA-N 472.586 0.938 50 20 JCGD O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1 1840189589 ADXFVWGVWPGCQH-NPPFBWRTSA-N 486.396 0.882 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)c2cnoc2)C1 1843473553 SAQNQUNWKUMNRC-IBGZPJMESA-N 498.345 0.307 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1843971468 DCTGKSOOUNAPPJ-LPHOPBHVSA-N 471.363 0.686 50 20 JCGD COC(=O)C12CC(C(=O)N3CCCC34CN(C(=O)CN(C)NC(=O)NCc3ccccc3)C4)(C1)C2 1846114891 QBGHWCMBMVFSCI-UHFFFAOYSA-N 483.569 0.879 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)C2 1846364939 ROJGFCKGWIQLKL-ZIAGYGMSSA-N 461.943 0.900 50 20 JCGD Cc1nnc(NNC(=O)c2cccc(NS(=O)(=O)c3ccc4c(c3)OCCO4)c2)[nH]c1=O 11266088 ARKDBASPNUWQSU-UHFFFAOYSA-N 458.456 0.802 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNc3nnc(C)c(=O)[nH]3)CC2=O)cc1 11335345 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729511878 YQPHSXSEPYABTH-JOCHJYFZSA-N 473.599 0.752 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=S)NCCc2cccs2)cc1 838822861 CILRMIVAIWZVTR-UHFFFAOYSA-N 470.598 0.941 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCNC(=O)C(C)(C)C)c(=O)n2Cc1ccccc1 901391016 CCOOMICDRTYHFI-UHFFFAOYSA-N 497.556 0.128 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C/c1cccnc1)c(=O)n2Cc1ccccc1 901393839 OVGFXNVNXNPSBL-ZHACJKMWSA-N 473.493 0.684 50 20 JCGD Cc1ccc(-n2c(N(C)C)nc(C=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)c2Cl)cc1 915957843 XUZCJJLNKVLEOA-UHFFFAOYSA-N 490.977 0.935 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C(=O)Nc1ccccc1 916156876 DHEKTWNSZGBIPW-UHFFFAOYSA-N 460.512 0.426 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2S1(=O)=O 916744347 QCURGTRACWMVTI-MRXNPFEDSA-N 461.452 0.079 50 20 JCGD CCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2c[nH]c3ncccc23)c2ccccc2c1=O 918757896 NMVOBYMCJJPVAC-UHFFFAOYSA-N 469.483 0.032 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1cc(Cl)ccc1F)C(=O)OCC(=O)NNC(=O)c1ccccc1 920263162 JMXAUEZEYMTAKO-DIFFPNOSSA-N 451.838 0.963 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cc(S(C)(=O)=O)ccc1F 921295580 UOKGXBRMEKAOJH-UHFFFAOYSA-N 478.549 0.454 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1Cc2ccccc2CN1 1778032502 TWBALDGYLYNYJK-JQYIIUTOSA-N 477.370 0.208 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)CCO2)C1 1779037316 VPTWFUZXPWKSQM-NRFANRHFSA-N 472.433 0.490 50 20 JCGD O=C(COc1cc(Cl)ccn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779504215 YMUWRVVYYWUACR-AUSIDOKSSA-N 487.749 0.621 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)[nH]n1 1779573669 NSTVJWZEBWZZRK-JOCHJYFZSA-N 455.519 0.463 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C(F)(F)F)nn2C)C1 1779790189 WLILEEQBNBLZSM-OXQOHEQNSA-N 488.511 0.939 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc(C(F)(F)F)n1 1780088377 HUDNGNOFHBIBHQ-FQEVSTJZSA-N 487.479 0.926 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1780702665 ZOUWGXADWLLYLA-ZBQZNYHESA-N 458.968 0.983 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc[nH]n1)CCO2)NC(=O)NCc1ccccc1 1780969432 LYJBHCRYONMXHM-JOCHJYFZSA-N 455.519 0.199 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCOCC1)CCO2)NC(=O)NCc1ccccc1 1780970066 QVAFHSFRRBLXEE-XMMPIXPASA-N 473.574 0.589 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1783823236 VSLGGSPWQYYVNO-USJZOSNVSA-N 490.561 0.192 50 20 JCGD Cn1c(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc2ccccc21 1783898333 IISSPSQQJXIGKO-APTRMMRNSA-N 475.354 0.694 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])cc3c1OCC3)CCO2 1783935434 SYJJGAAMPVGRNU-QFIPXVFZSA-N 475.502 0.346 50 20 JCGD Cc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)n1 1786980128 MHPPJKMDSHEZLU-NYVOZVTQSA-N 451.332 0.296 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)c4nncn4c3)[C@H]2C1 1788559395 JKOYLFXLUAFWIK-IWEFOYFVSA-N 498.931 0.288 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)nn3)C[C@@H]21)NC(=O)NCc1ccccc1 1789725006 WYAZBLMWUFJTNB-BJLQDIEVSA-N 497.556 0.122 50 20 JCGD O=C(Cn1cnc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791176023 QELUYZQMEPZFIS-JLMWRMLUSA-N 462.315 0.010 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1cccnc1 1792975763 XISAVDCVRLRTKC-CWQOZTLDSA-N 482.965 0.837 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=CCN(C(=O)OC(C)(C)C)C1 1793226067 ASIZQAUKCCLDMN-XEMDLRDOSA-N 479.578 0.126 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(O)C(F)(F)F 1793688538 NJEQIINHZHQTHO-XFNFXYANSA-N 459.425 0.023 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)n1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1794069687 NRNYJOWNALQDSE-YVWYUNDQSA-N 477.248 0.226 50 20 JCGD CC(C)(C)OC(=O)N[C@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1794154238 VVFBVTBTDBLDDO-CSFFLVESSA-N 496.992 0.707 50 20 JCGD COCCOCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795115241 RSTJNBXMMGWZGI-XEMDLRDOSA-N 495.411 0.447 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cc(F)cc(F)c3)[nH]n1)C2)c1ccc(B(O)O)cc1 1795732592 ZHGQVGPBRWUYJF-MFKICJERSA-N 496.279 0.552 50 20 JCGD CN(C)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)c1ccccc1Cl 1795736810 LGORBUCCYHOHEO-YVCBRDFCSA-N 485.777 0.526 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(Cl)cc1Cl)C2)c1cccc(B(O)O)c1 1795737003 RVPPKXCNHVGWGT-FVCICTRLSA-N 464.114 0.585 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1 1796188079 ZTFROVBEODHPQA-DVWBAYGPSA-N 499.398 0.294 50 20 JCGD COc1ccc(-c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)n[nH]2)cc1 1796496385 WCFKWOAARZPDMQ-FEJSZKPUSA-N 490.325 0.282 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1ccccn1 1797973579 PARWDBJYSYDVLC-HGOBAHADSA-N 467.530 0.606 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](NC(C)=O)c1ccc(F)cc1 1799057207 AFTXEEGJVPBKOE-HAYURNKSSA-N 455.914 0.846 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1)C2 1802337893 DXZDCJQMZYUMDK-IPPNXFFKSA-N 481.594 0.681 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CC(N)=O)[C@@H]1c1cccnc1 1803664402 ICXVQSSDUXGCRJ-PDBHHICLSA-N 467.530 0.733 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCNC3=O)[C@H]1c1cccnc1 1806084909 SSYDKRYGXCXEBL-RVKKMQEKSA-N 460.922 0.595 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807366107 SDXCUNZQUSWOOE-PZJWPPBQSA-N 466.347 0.243 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1809227628 ZKVMQWZECRWKEA-CVDCTZTESA-N 461.331 0.664 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1CCc2nc[nH]c2C1 1813323450 FXQQYMKKUFVCKV-WCAVRKLYSA-N 473.342 0.609 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(=O)c1ccccc1 1815350181 ITJQPBCATSQYDN-GOSISDBHSA-N 492.366 0.821 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CNC2=O)n[nH]1 1815597693 WAISIDSMHGFFRY-HURLIOHXSA-N 483.489 0.088 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CC(N)=O)CC2 1817275774 CRIWSJWVYBWUTO-SGZPTALBSA-N 459.532 0.701 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1 1822413365 SWDKULLWOIABCD-GOSISDBHSA-N 462.599 0.412 50 20 JCGD Cc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)nc2nccn12 1824114986 CFBHFOXVKCTQAG-OAHLLOKOSA-N 476.327 0.714 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ccccn3n1)CC2 1826085310 LMQHFIYBUIUZKJ-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD CC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551879 XAKLYNVPWXKOFZ-AVRDEDQJSA-N 480.949 0.174 50 20 JCGD O=C(c1cn2cc(Cl)ccc2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728098 OYEFEJUILDVKAS-HNAYVOBHSA-N 457.314 0.657 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1 1830737125 ATHMXKWMTPAGFC-IFXJQAMLSA-N 461.943 0.100 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830850785 GGAWROAFJVJCGL-SFYKDHMMSA-N 481.977 0.641 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCS(=O)(=O)CC2)CC1 1831828944 VYSDFMPROYVMPV-ZWKOTPCHSA-N 464.028 0.590 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cn4ccccc4n3)CC2)CC1)c1cccc(B(O)O)c1 1834800020 MPYLXCIDOXOUQH-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)n1cccc1 1834801400 GFDBETGWLHKTEC-GOSISDBHSA-N 452.364 0.614 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CCOC[C@]4(CN(C(=O)CCBr)CCO4)C3)ccc21 1834821852 ZWXCCSCEIFAJRI-NRFANRHFSA-N 495.374 0.732 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737834 FYQSDIXZTUBAFZ-MRXNPFEDSA-N 487.605 0.175 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835936755 BPPDSGBDIWULFO-RUZDIDTESA-N 490.325 0.002 50 20 JCGD CCOc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835939047 CGTOAFJTTSZLRJ-XMMPIXPASA-N 468.315 0.149 50 20 JCGD O=C(c1cccc(-c2cnco2)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939283 KGGCBZVGDQBMBI-VWLOTQADSA-N 491.309 0.405 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1csc3c1CCCC3)CCO2 1836898152 BTQMPLFAHXGTDM-XMMPIXPASA-N 484.383 0.691 50 20 JCGD CCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837456872 PHPDVWRLESAIRY-HSZRJFAPSA-N 468.514 0.026 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(C)n1 1837459681 WNSWYIATIDBKJX-HSZRJFAPSA-N 468.514 0.081 50 20 JCGD Cc1nccnc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919077 BKTKTWNJXWLIGR-UHFFFAOYSA-N 452.320 0.391 50 20 JCGD Cc1nccn1CC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920087 KGTKAIXHTXSZON-UHFFFAOYSA-N 454.336 0.184 50 20 JCGD O=C(Cc1ccccn1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920244 LHZGTWZTPJNQJY-UHFFFAOYSA-N 451.332 0.616 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CC(N)=O)C2)C1 1838527473 VWKINFPFCKOOCY-FPTDNZKUSA-N 492.485 0.102 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)[C@@H](C)O4)CCO2)C1 1838589207 MZYAAOKUXVQURH-RQVMVGKASA-N 481.933 0.730 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])CCO2)C1 1838601777 UCVTUARHZHUBCE-VLIAUNLRSA-N 487.893 0.633 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839147186 ILPMDKIYHXWHHK-WMZHIEFXSA-N 496.008 0.806 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839153840 SYYLXKZRPDAXDF-NIKGAXFTSA-N 452.379 0.984 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202550 JIECONGLEXWKEQ-NVXWUHKLSA-N 461.288 0.262 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)c(F)cc1F)CCO2 1839287617 ORMYJUDIKLGWPJ-QFIPXVFZSA-N 478.232 0.168 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)nc2nccn12 1839548300 QLQCJAPUDDKFMF-IBGZPJMESA-N 466.336 0.893 50 20 JCGD CN[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2)C(=O)O 1839743473 SUGNIFHBXPVODO-JAEDTZDXSA-N 492.479 0.391 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1839962414 DGLAKALUKUYODF-KZULUSFZSA-N 471.308 0.418 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1839964100 GTQKBGAKULZXHL-UGSOOPFHSA-N 458.309 0.736 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1)C(C)(C)C 1840030587 PPQGTRONFVYMMS-ZBQZNYHESA-N 462.385 0.777 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCS(=O)(=O)c3ccccc3)C2)C1 1840151652 JPQRKWGOYPNFDY-WIYYLYMNSA-N 488.990 0.561 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4cc(C)ccn4c3=O)C2)C1 1840152930 YWZOSOZGSORSCX-JTSKRJEESA-N 478.933 0.327 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccsc4[nH]3)C2)C1 1840185722 VXBZQCCIQXHZEM-OAQYLSRUSA-N 463.560 0.672 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(C3CCCC3)C2)C1 1841858678 RNXLROPTNBFGEI-OAHLLOKOSA-N 454.531 0.293 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012524 WTABMHKBMCUVOB-MZNJEOGPSA-N 469.347 0.440 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)C(C)(F)F)C2 1843428952 ZOPZKERKMNBQBK-KRWDZBQOSA-N 495.332 0.661 50 20 JCGD C[C@H](CC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)NC(=O)OC(C)(C)C 1844264144 KTISZURCGGDZMO-CQSZACIVSA-N 460.535 0.805 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1845145346 DUECEBIKRCDBTA-KBPBESRZSA-N 461.943 0.636 50 20 JCGD COC(=O)C1(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)CC1 1846018202 YWMHEQLQHCCEOR-UHFFFAOYSA-N 457.531 0.489 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C1)C(=O)NC[C@H]2C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847568788 LXOWJNDTKQVCQM-DRSJSQNDSA-N 484.981 0.161 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)c1csc(N2CCOCC2)n1 21967779 OMGYGGJGRMMJGJ-UHFFFAOYSA-N 475.499 0.388 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)CNc2ccc(C)cc2)c1OC 104748065 ADCUHTYTTCXLRW-UHFFFAOYSA-N 492.554 0.906 50 20 JCGD O=C(COC(=O)CCS(=O)(=O)c1ccc2c(c1)CCC2)NNC(=O)[C@H]1COc2ccccc2O1 728327646 NGENICBDSHGXJC-HXUWFJFHSA-N 488.518 0.870 50 20 JCGD CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1=O 728848145 XBRVQZOLBYJYPH-UHFFFAOYSA-N 451.487 0.037 50 20 JCGD CCS(=O)(=O)NCCCNC(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1 728943004 BVIXYHULPFZFBZ-LLVKDONJSA-N 451.343 0.876 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC2CCN(C3CCN(C)CC3)CC2)cc1 747987821 QSSNUAOADBQJSG-UHFFFAOYSA-N 480.635 0.505 50 20 JCGD COc1cccc(/C=C(/C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n2nnnc2C)c1 818027475 UEUACYMECJWBMV-PDGQHHTCSA-N 460.454 0.696 50 20 JCGD COc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(Cl)c1OCC(N)=O 839214672 ZAQRXUVDWNBSFX-MRXNPFEDSA-N 493.856 0.357 50 20 JCGD O=C(NNC(=O)C1CCN(c2cnccn2)CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1 914046300 AYCKLOBRZXIWLX-UHFFFAOYSA-N 474.543 0.175 50 20 JCGD COc1ccccc1NC(=S)NNC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 916559480 HCWNREBARQJROQ-UHFFFAOYSA-N 465.557 0.693 50 20 JCGD CCn1c(NNC(=O)c2ccc3c(c2)S(=O)(=O)N(CCOC)C3=O)nc2ccccc2c1=O 916827016 UAAPTVZLUPUACV-UHFFFAOYSA-N 471.495 0.964 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cnc(C)s1)c(=O)n2Cc1ccccc1 917537279 DMMHCHFFZYZJSM-UHFFFAOYSA-N 481.538 0.970 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886373 RPCAWWJSBLWPOD-GXTWGEPZSA-N 458.924 0.471 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)COc3ccccc3OC)cc2S1(=O)=O 920424510 BKFDCTIAPKYVTR-UHFFFAOYSA-N 463.468 0.326 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1 1780184651 BHANGYUYAVFRCP-VWLOTQADSA-N 472.310 0.581 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)Cn1ccccc1=O)CCO2)NC(=O)NCc1ccccc1 1780970604 YDEMSHKRKWEYMO-RUZDIDTESA-N 496.568 0.024 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782544067 RBJWKCXRYKZMSV-XTQVGHSUSA-N 454.336 0.027 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)[C@H]1SC(=N)NC1=O)CCO2 1783347741 OISGIARSHMYSPY-PXDYOCJYSA-N 461.382 0.792 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1783687352 SBLJJJQXVMHMKL-UXHICEINSA-N 485.405 0.749 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1)CCO2 1783871238 OEOJWZNCGZPASM-IERDGZPVSA-N 489.997 0.832 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1 1783880241 GVENTLBPFQSWFE-WIYYLYMNSA-N 480.986 0.156 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCS(=O)(=O)c3ccccc3)CCO2)C1 1783933641 BIIKTVVNQCMEMK-QFIPXVFZSA-N 480.587 0.053 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc3c(Cl)cccn13)CCO2 1783933949 OZSADYAWLZISMV-NRFANRHFSA-N 462.938 0.804 50 20 JCGD CC[C@@H](CC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)NC(=O)OC(C)(C)C 1783934963 OHYYYDKGTDXTGS-SBUREZEXSA-N 483.610 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=CCN(C(=O)OC(C)(C)C)C3)[C@H]2C1 1784344426 BCBADZFIYUEQFY-FHWLQOOXSA-N 493.605 0.516 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CCCn3ccnc3)C2)C1 1784399571 QKYKLWPACZCYFC-ALAMRGAJSA-N 455.519 0.627 50 20 JCGD CN1Cc2ccccc2C[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785022602 GYIGEZXDMBQEGT-BIHRQFPBSA-N 477.370 0.016 50 20 JCGD Cc1nnc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)s1 1785323268 NJHJBTVJRPONOY-JQFCIGGWSA-N 473.559 0.071 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(F)cc3)[C@H]2C1 1786492318 VAGSSBRPXZLDNL-SNRMKQJTSA-N 450.511 0.557 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)c1ccc(O)cc1 1786981785 LJYXCBLULYFYTB-UYIIBVGGSA-N 452.316 0.469 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(NC(=O)C4CC4)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984875 UCUJIZTYTHFACV-VJBMBRPKSA-N 491.353 0.622 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)[C@@H]1SC(=N)NC1=O 1787495972 WERXPRHLXOARNG-YGJAXBLXSA-N 456.641 0.620 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1n[nH]c2ccc(F)cc12 1788386545 UYANTRYALPBLBH-DCPHZVHLSA-N 466.278 0.289 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc2sccc2[nH]1 1788430061 BXWNELMZMLXMAY-QOKNQOGYSA-N 453.329 0.816 50 20 JCGD CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607818 LILHNBLJBCDSEB-JVPBZIDWSA-N 468.514 0.386 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)ccn1 1788904645 VHGVYBJHDMNJGX-CCYFIYGFSA-N 468.514 0.818 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cn1 1789025258 SZFLQHBUOCULCX-SNRMKQJTSA-N 467.530 0.053 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)c1ccc(F)cc1 1789697882 LPYWFPUYVXDWOQ-UDSSINMLSA-N 491.564 0.356 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccncc3)[C@H]2C1)NC(=O)NCc1ccccc1 1789736564 LTDJLSPUBOKYNE-VABKMULXSA-N 494.596 0.950 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1789940948 IFWVFWBSOXBFSI-WOYTXXSLSA-N 486.997 0.719 50 20 JCGD Cc1nccn1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1790648096 KIICPKWDDWQLKN-FKBYEOEOSA-N 497.600 0.517 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4sc(C)cn4c3=O)C[C@@H]21 1791254718 SGDVKYXWJXNFES-HNKHHVNMSA-N 468.963 0.912 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)nc2ccccn12 1791290903 DGOSMGGAESYUGP-BZSNNMDCSA-N 456.547 0.609 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr 1792867902 KORBQYMFEGSOAS-XIFNJIBBSA-N 468.352 0.741 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792975851 ZVIAZQZJBSPPJP-OIBBZDHESA-N 459.971 0.869 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1793064099 VFCOGLHOXSVQBV-PJVZLEMVSA-N 451.951 0.774 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)cc(O)n1 1796377168 KUXFHDLTIHWZPK-JHDGKUDLSA-N 496.568 0.645 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccc(F)cc1F)C2 1797748685 SZKWUKPWBIZLFZ-NXCRSVRDSA-N 491.520 0.959 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)C1 1798443671 UNQYDVIIPIMIIS-OVYGPGRDSA-N 457.531 0.916 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nn[nH]c1C(F)(F)F 1799439697 TZQLYSGABXSXSH-ILWJIGKKSA-N 452.397 0.388 50 20 JCGD CCOC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1799788365 JTABMUSILZRWBB-CEQLMSFQSA-N 466.299 0.060 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@H](C)Br)C3)C2 1800327023 YZYBIHIWLHGMNY-SVZOTFJBSA-N 497.390 0.995 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)C2 1801012546 OTCRHHHYTPDVEQ-CWPLJXCYSA-N 468.595 0.707 50 20 JCGD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)[S@](=O)c1ccccc1 1801275790 NVXFSHMNJPPSTN-SNTIRWHOSA-N 454.357 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CN2CCCC2)[C@H]1c1cccnc1 1802554971 CAIUETFDMQWBJR-DYESRHJHSA-N 451.531 0.496 50 20 JCGD CC1CCN(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1803389171 VQCVHAHXGMFATR-ZJSXRUAMSA-N 464.375 0.813 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n(C)n1 1804923353 AVCGNUPTUKQWBS-UWJYYQICSA-N 463.303 0.137 50 20 JCGD COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1804982380 XPKWYNUQKXWBSA-JXFKEZNVSA-N 455.519 0.573 50 20 JCGD Nc1nc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cs1 1807233504 VZRPGVJZQNGYCT-CRAIPNDOSA-N 451.317 0.434 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361038 OGGCPOFOTOHCAT-VGOFRKELSA-N 470.298 0.666 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807362385 VKGKGRPVQDZYOH-JBACZVJFSA-N 451.332 0.654 50 20 JCGD CN(C)c1cncc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1 1807363464 PFWJFHCVGIWWQY-AUSIDOKSSA-N 473.342 0.856 50 20 JCGD Cc1nnsc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807376016 RAUCXUMVOFYLQB-FUHWJXTLSA-N 451.317 0.555 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(Cl)nn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376193 UDOQDCHSZJKTHA-OXQOHEQNSA-N 465.706 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cnc(OCF)cn3)C2)CC1 1807651417 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O=C(Cc1ccccc1O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360070 LHCDXROFXXGQEZ-INIZCTEOSA-N 451.313 0.997 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361098 XCQOGSOIPSYOSS-CZUORRHYSA-N 465.344 0.944 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ncn(C)n1)CC2 1817277367 RIISFHQXEMJDTR-IVWJEFBKSA-N 455.504 0.631 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@H]3c3cc(NC(=O)c4cccc(B(O)O)c4)n[nH]3)CC2)CC1 1817476738 BHJDCQMKDKKUNO-FQEVSTJZSA-N 480.378 0.175 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819404485 NQXONQPTBIKCJD-HNNXBMFYSA-N 463.520 0.149 50 20 JCGD Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1821309252 BWRCQBHDANKNIM-CQSZACIVSA-N 452.301 0.061 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3nn[nH]c3C(F)(F)F)sc2C1)c1ccc(B(O)O)cc1 1821642819 BNSPHHGFTCFLBZ-SNVBAGLBSA-N 480.237 0.499 50 20 JCGD O=C(CCN1CCOC1=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051710 AETCTNKZSRNIJM-FQEVSTJZSA-N 457.336 0.442 50 20 JCGD CCN1CCC(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1 1828348506 OZOFRRNGBREBEY-QGZVFWFLSA-N 456.377 0.781 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1829114537 ALVIHUVRVRIKOM-UXHICEINSA-N 474.562 0.070 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ccc(Cl)cc3[nH]1)CCO2 1829614008 KLOPQBYQYNMCKX-XMMPIXPASA-N 497.744 0.885 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1 1830539242 FNFCRLHGUNKWMV-CQTDXNOFSA-N 459.385 0.946 50 20 JCGD CN(C)c1cccc(OCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830726352 QEKPCDMHXMJPJV-RXVVDRJESA-N 455.939 0.188 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1831865166 IWWUMCXDEPSZAN-WZONZLPQSA-N 475.546 0.534 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccon3)C2)C1 1832549582 VBVCHHIEAREIAU-MGPUTAFESA-N 472.926 0.877 50 20 JCGD Cc1ccncc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1833014619 HXOHBSBERSYGME-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833400804 BMCPJMRHHQBBIK-ACJLOTCBSA-N 490.376 0.339 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CSCC(=O)OC)CC2)CC1 1833480135 FXBPKZYNAJNXAD-MRXNPFEDSA-N 450.001 0.718 50 20 JCGD CC[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)N(CC)CC 1833539272 YCTRQTKQPDCECM-QFIPXVFZSA-N 487.649 0.991 50 20 JCGD CCc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1Cl 1833595850 HDRMZZWCFFJKLK-OAQYLSRUSA-N 484.985 0.079 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccncc3)CC2)CC1)c1ccc(B(O)O)cc1 1834798391 OWCHXXWEZNOLJL-UHFFFAOYSA-N 450.348 0.189 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1 1834822553 VBDXMBIZBJIGMI-GOSISDBHSA-N 452.309 0.813 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835116737 ZBSITUTUCMRQHL-PCLIKHOPSA-N 494.618 0.127 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)[C@](C)(Cl)CCl)CC3)CC2)CC1 1835511321 VKPIIWMQZCMOCO-JOCHJYFZSA-N 490.476 0.958 50 20 JCGD O=C1CCCc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3ccc(B(O)O)cc3)CCO4)ccc21 1835930538 LUSGUAYIOSWCEE-AREMUKBSSA-N 492.337 0.269 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3c[nH]c(=O)cn3)CC2)CC1 1836138836 YFDSRIWKGZGHDQ-CYBMUJFWSA-N 454.369 0.986 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ncccn3n1)CCO2 1836868665 OIDJATPNALILHA-SFHVURJKSA-N 452.309 0.584 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1 1837020596 UCQRGBLRUDOLFE-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD Cc1cccnc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837456045 AZTMIDLZDYQSTM-XMMPIXPASA-N 482.541 0.091 50 20 JCGD CC#CC[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1837612760 LODZIECLNMDHLO-SQHAQQRYSA-N 490.365 0.634 50 20 JCGD Nc1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1837899147 HRGZOMFRSTYDEM-UHFFFAOYSA-N 458.349 0.331 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccc(F)cc1 1839038831 DQBZUYHJWYVVKE-WAOWUJCRSA-N 471.913 0.059 50 20 JCGD O=C(c1ccc2nc(CO)[nH]c2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200975 PQAMDCODFZAOFN-QFBILLFUSA-N 485.310 0.816 50 20 JCGD O=C([C@@H](O)Cc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202629 LWHKVDQKYDPURT-BXWFABGCSA-N 459.312 0.737 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183346 ZFUDPMIFEXHTMA-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184523 RZIHEIHCMPEWHB-JPYJTQIMSA-N 461.563 0.316 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1 1840905879 UCNUDTWUGGTBOB-IIBYNOLFSA-N 482.375 0.965 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(CC(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)=NO2)C1 1846102189 OWESKZSFRCKKPI-VFNWGFHPSA-N 470.954 0.945 50 20 JCGD CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC[C@H]2C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1846118822 FSZCADLTJUVFOW-JKSUJKDBSA-N 499.008 0.553 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1846127073 IJVKOUSWOOYLKB-OYLFLEFRSA-N 484.557 0.759 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846189077 BZQDKLQJYZMRFT-OSPHWJPCSA-N 469.347 0.583 50 20 JCGD C[S@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847442436 GLOVLTGWVXEQSZ-CUXZEWCPSA-N 466.000 0.450 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1S(=O)(=O)N1CCOCC1 15889051 HMESAXRJQBJNFU-UHFFFAOYSA-N 458.496 0.728 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)CCNC(N)=O)ccc1Cl 725907789 PPKTXDKFUNDBLO-UHFFFAOYSA-N 469.907 0.969 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)ccc1Cl 728014436 FRSTUCSUPZJUPG-UHFFFAOYSA-N 479.323 0.759 50 20 JCGD CCOc1ccc(S(=O)(=O)N2CCC(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)CC2)cc1 728178068 AYARECYAQSDRFU-QGZVFWFLSA-N 473.617 0.978 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1 729275833 RZGMOLBSMJYEML-QAPCUYQASA-N 462.528 0.609 50 20 JCGD Cc1cc(N2C[C@@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC2=O)ccc1Br 729276642 JQTUEXTXVPMTSJ-MNOVXSKESA-N 461.338 0.196 50 20 JCGD CCN(CC)C(=O)COc1ccc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1 730570379 JHCCSSDHGYDMFB-UHFFFAOYSA-N 476.559 0.359 50 20 JCGD CC(C)(C)OC(=O)NCCNC(=O)[C@@H]1CCCN(CC(=O)NNC(=O)c2ccc(F)cc2)C1 747089583 FLNBUTLTZWVYNL-MRXNPFEDSA-N 465.526 0.940 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)CNC(=O)c2ccco2)c1 751206263 BCJULVMATBGRQN-UHFFFAOYSA-N 463.516 0.321 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)COc2ccc3c(c2)CCC(=O)N3)cc1OC 825354943 BRHSMDLUZFOZEZ-UHFFFAOYSA-N 457.439 0.972 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1 863999291 QLRVIRSKWAQNME-UHFFFAOYSA-N 492.554 0.622 50 20 JCGD Cc1nnc(NNC(=O)CS(=O)(=O)CC(=O)Nc2cccc(Br)c2)nc1O 916160071 DXYWGNLBAXEXHY-UHFFFAOYSA-N 459.282 0.145 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 916724510 YZZVKPFPWRMRPC-UHFFFAOYSA-N 490.582 0.926 50 20 JCGD CNC(=O)COc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1OC 919691958 GNSPJJZZOLMGJK-UHFFFAOYSA-N 490.538 0.679 50 20 JCGD O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778054232 DGYCFJIPBVMNGR-HXUWFJFHSA-N 489.330 0.799 50 20 JCGD CC(=O)N1CCN(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](C)CBr)C3)CC1 1778908681 LGKCYXCILZLQLX-YRISNDGFSA-N 487.439 0.695 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779037352 WSKOPIMHZNNURJ-QMHKHESXSA-N 452.515 0.402 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/O[C@@H]1CCCCO1)C2 1779372604 NIIPSASJLOSJMY-UVSGFCIESA-N 488.545 0.342 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1F 1780111608 SMQIHKYIODMTBA-XMMPIXPASA-N 499.499 0.758 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1780728846 XZQURAMIVRDIIC-HSZRJFAPSA-N 452.515 0.508 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1)NCc1ccco1 1781331199 GJQSGDWIEYVSOS-NDIJEHHESA-N 458.284 0.972 50 20 JCGD O=C(COc1ccc(O)nn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1781493751 GYBILSPESLUQRN-RGYTYGDFSA-N 461.288 0.765 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2 1781865282 UZIUBWRUHFPRPK-TYCAKDKSSA-N 496.524 0.721 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1782303907 ARUAFDPXWPJABQ-QFIPXVFZSA-N 460.510 0.598 50 20 JCGD N=C1NCCN1CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783022105 FKLVHLMNLOOJCW-DYESRHJHSA-N 478.391 0.662 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCc3noc(-c4ccccc4)n3)CCO2)C1 1783935852 XHKAZQWMDKUUNK-DEOSSOPVSA-N 484.557 0.872 50 20 JCGD O=C(CNC(=O)c1cccnc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1785169886 BDZGSRXRFWURHB-RZLSGREXSA-N 457.300 0.482 50 20 JCGD CCc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 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460.242 0.485 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccncc1=O)C2)[C@@H](Br)Cc1ccccc1 1800436958 QRKAQUFYFDVVRW-NYUBLWNDSA-N 489.370 0.839 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2 1800977145 KBHGLCNSGLPRTK-SVZOTFJBSA-N 463.959 0.106 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@@H](Cl)COC)C2 1800979468 JKZOUSDWDLJPSI-KCYAQADSSA-N 482.965 0.466 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCCN1C(=O)OC(C)(C)C)C2 1801013231 YDQNWYLHIGMZRR-BMQTXXJKSA-N 495.621 0.739 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1 1803972636 AMKSMQWBKDTUCF-BCDXTJNWSA-N 464.526 0.953 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C(=O)c2ccco2)[C@@H]1c1cccnc1 1804326818 GZTYWRSLJSQWDQ-BEFAXECRSA-N 462.466 0.876 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@@H]1CCc2nc(O)nc(O)c2C1 1804563999 SNLVWGCGWXMJAV-OLUCIUBSSA-N 475.933 0.693 50 20 JCGD CC(C)c1nc(CC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)no1 1806925000 DEGVIKPNHXUADN-UHFFFAOYSA-N 454.336 0.960 50 20 JCGD CN(C)CC(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1807454725 WVWOPUXHRZTVGL-URXFXBBRSA-N 481.601 0.995 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1 1809863539 YNQFREGSVVXWLO-IIBYNOLFSA-N 490.524 0.693 50 20 JCGD N#Cc1c[nH]c(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1 1811541213 UEMVJLCZZGCVGO-JXFKEZNVSA-N 458.482 0.913 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1 1813029935 BKFIBAAEWYGPQD-JKIFEVAISA-N 459.894 0.386 50 20 JCGD Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c(=O)[nH]c1C 1815354904 HTJSDGASVNUZKJ-CQSZACIVSA-N 467.316 0.063 50 20 JCGD CN1CCN(C2(C(=O)N[C@@H]3CCc4nc(NC(=O)c5cnccc5C(=O)NN)sc4C3)CC2)CC1 1819799543 DIBLCNTWBPWWAG-CQSZACIVSA-N 498.613 0.147 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1 1824533250 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1834725759 HWXMYNDMBIQCOV-JOCHJYFZSA-N 459.595 0.026 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cn4ccsc4n3)CC2)CC1)c1ccc(B(O)O)cc1 1834798523 GLRITOZGDPXRQQ-UHFFFAOYSA-N 481.387 0.575 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc2[nH]ccc2n1 1835552604 UHYJUKDBIANTKY-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836717146 KFTDSHNQPDFHRN-MSOLQXFVSA-N 462.927 0.080 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836761730 UJTKIOGVVTZSFO-FSTVOOFJSA-N 489.997 0.546 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1 1837020309 VQNWTBAVHNTEIA-BEFAXECRSA-N 466.336 0.973 50 20 JCGD Cc1cccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837456973 UPZFJLIMMPPWTE-VWLOTQADSA-N 481.553 0.696 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cn4cccnc4n3)CC2)CC1 1837919300 WUAKKCRDWOLZHG-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)[C@H]1SC(=N)NC1=O 1838100611 WELNIQSTGQVTSO-AUUYWEPGSA-N 496.634 0.160 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)n1C 1838385231 FQGOJLXRRGRQBW-HSZRJFAPSA-N 470.530 0.024 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1838403769 BSTOELJNVFULBE-YLJYHZDGSA-N 476.412 0.809 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)N3CCN(C)CC3)CC2)CC1 1838627104 JMTIWMUEPFMWMU-FXAWDEMLSA-N 459.031 0.875 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(N4CCOCC4)c3)CCO2)C1 1839344851 BUIKPFNTCQXGPH-OFNKIYASSA-N 481.977 0.847 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1 1840153049 BJIYMKWIBBBKGY-BEFAXECRSA-N 472.329 0.707 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1840153057 BMNFOXFIPZYOKB-AOMKIAJQSA-N 480.949 0.050 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccnc3Cl)C2)C1 1840182406 IQIUHEYMCQYCPC-NRFANRHFSA-N 467.954 0.107 50 20 JCGD CCOc1ccccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185320 KKTUMTQYIVGBEN-QHCPKHFHSA-N 462.547 0.528 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=COCC3)CCO2)C1 1840558772 MTAYBCCWOJGSOZ-HRAATJIYSA-N 473.954 0.879 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841352382 MFWFDCFPZIZGJG-CVEARBPZSA-N 461.868 0.954 50 20 JCGD CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011181 ZUYCYLQFRUZTIC-SFHVURJKSA-N 491.419 0.830 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)C1 1843235716 SFEKJOAJHPOHIK-AWNIVKPZSA-N 466.408 0.515 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)[C@H](O)C1 1843981168 BMQLQRLUSKCTCY-SXGZJXTBSA-N 459.971 0.798 50 20 JCGD CN1CCC[C@@H](C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)C1 1845055361 BYJBYDWLTUTNRB-HXUWFJFHSA-N 456.591 0.878 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CN2C(=O)C=CC2=O)C1 1846460748 ZLFHYVPXOIISGE-UHFFFAOYSA-N 456.411 0.262 50 20 JCGD CSCC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)C(=O)NC1CC1 9889189 YRJDQEADDYOTFP-ZDUSSCGKSA-N 457.350 0.727 50 20 JCGD COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)C(=O)NC(C)C)ccc2F)cc1 726612354 COQIBTKNJBYBQC-UHFFFAOYSA-N 452.464 0.921 50 20 JCGD NC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)CCC3CCCCC3)CC2)o1 727482402 URRMBMKJAPIXSN-UHFFFAOYSA-N 455.537 0.786 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CCCN(C(=O)N4CCCC4)C3)cc2)CC1 728214131 LVLWOCKHLLWCCL-GOSISDBHSA-N 478.619 0.994 50 20 JCGD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728367510 HGQDJGGMBXQRLX-SJCJKPOMSA-N 467.438 0.212 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 728379191 IJUXHMQLFWLOHQ-SJLPKXTDSA-N 499.636 0.822 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc(OC(F)F)c3)c2)CCN1 728484555 AGIOARFEDABTQY-UHFFFAOYSA-N 468.438 0.483 50 20 JCGD Cc1ncsc1C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 729452495 OMZUSISLADRIHC-CYBMUJFWSA-N 495.004 0.648 50 20 JCGD COc1cc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)cc(OC)c1OC 748468323 ZYCDIFBVLVLHGR-UHFFFAOYSA-N 486.529 0.790 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2cc(-c3ccccc3)on2)c1 749400339 CTSLLRXBRXRRQQ-UHFFFAOYSA-N 471.495 0.783 50 20 JCGD Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2c(C)n[nH]c2n1 750664022 VVSWOKKHCPCFRD-UHFFFAOYSA-N 458.500 0.670 50 20 JCGD O=C(NCc1ccccc1S(=O)(=O)N1CCCCC1)NNC(=O)c1ccc(-n2cnnn2)cc1 838617345 PPFSAXQGLAUVEF-UHFFFAOYSA-N 484.542 0.981 50 20 JCGD O=C(CN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 912642972 VHSLZMMVLYQMLT-CALCHBBNSA-N 462.528 0.407 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)c1 912643066 OALMPDLAXHHYRK-YXUGBTPSSA-N 474.539 0.285 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1ccc(-n2cnnn2)cc1 914839223 PAVFPBAAIQODGE-UHFFFAOYSA-N 499.553 0.006 50 20 JCGD O=C(NNC(=O)c1cnc2nc(O)nc(O)c2c1)c1ccc(S(=O)(=O)N2CCCC2)cc1 915671453 SPBCWFICJSPTAC-UHFFFAOYSA-N 458.456 0.295 50 20 JCGD CSCC[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 915789015 AMRDKSLJKDVPKS-LBPRGKRZSA-N 474.948 0.893 50 20 JCGD COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1[N+](=O)[O-] 918127935 QAGVUULCEKJBBL-UHFFFAOYSA-N 451.461 0.998 50 20 JCGD O=C(NNC(=O)c1nnc(O)c2ccccc12)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O 918548417 DCNSTJHWWRARST-CYBMUJFWSA-N 497.489 0.734 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CC(=O)N(c2ccc(C#N)cc2)C1 1251338006 NLDXDBNVSQLENW-OAHLLOKOSA-N 454.512 0.974 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1nccc2occc12 1777737049 HXQUMGGPEOQTCL-HYBUGGRVSA-N 463.299 0.949 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ccccc23)C1 1778491632 FWFZXWASPYAVAP-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1778952450 DFBIEJHDRLRYEK-RCDICMHDSA-N 491.501 0.671 50 20 JCGD Cc1ncc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)s1 1779374617 AEOJFMCZXNLVJF-XMSQKQJNSA-N 472.571 0.820 50 20 JCGD N#Cc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1 1779374731 ZIZDWYIXXGWXHY-HYBUGGRVSA-N 462.510 0.998 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnnc3O)C2)C1 1779917782 YVSQXVWCHVFMJL-NRFANRHFSA-N 471.426 0.773 50 20 JCGD CCCOc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1780836632 NJVYDQRXTFOHTQ-DEOSSOPVSA-N 452.316 0.913 50 20 JCGD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)c(O)c1OC 1781035690 OMGQBQABHDMOLW-HOYKHHGWSA-N 492.573 0.910 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781480392 DTXIYLQXAKSVDC-QRJOEMBSSA-N 465.359 0.768 50 20 JCGD COCCOCCOCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1782064755 VDVZDXMCIKOGSE-SQGPQFPESA-N 450.960 0.170 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782569828 MQZKXCJRVQSOQH-NYQDVAGCSA-N 467.331 0.356 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784094777 RMORPLJPIUFDAR-TXPCXHQGSA-N 471.982 0.965 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)n3ccnc3C)C2)C1 1784633085 YGRVSTMAAFMXLY-BACQRBPLSA-N 455.519 0.716 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)NC2(c3ccc(NC(=O)[C@@H](O)CCl)cc3)CCC2)n(C)c1=O 1786129091 GSEJJFTUISXQST-HNNXBMFYSA-N 488.932 0.168 50 20 JCGD COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1786420236 VKFLFGIKTMWLGL-HSQYWUDLSA-N 481.553 0.920 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)n[nH]3)[C@H]2C1 1786938618 DDJOUSRCYAJFSW-QITLCBANSA-N 473.442 0.856 50 20 JCGD COc1cccc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786985294 ZVZXNINWOAEAHP-HCLDPKQZSA-N 464.327 0.682 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nccn34)C[C@@H]21 1788609846 MXHZZBWESHFVGP-FNHZYXHNSA-N 463.498 0.240 50 20 JCGD CCc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)s1 1788611271 RWQYKBFDCKOEQV-ZLIFDBKOSA-N 458.544 0.611 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cn[nH]c3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724614 BNYHNACODZGSNC-FKBYEOEOSA-N 497.600 0.668 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)[S@@](=O)c1ccccc1 1791293936 PNBUSZYJFKBBTK-SZQTWAIISA-N 478.615 0.535 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(CO)c(F)c3)[C@H]2C1 1792092918 XBBKJVDHLVTGOY-LNLFQRSKSA-N 450.511 0.284 50 20 JCGD CC(C)(C)OC(=O)N[C@H](Cc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792975127 KEAAFZUVAMYCQO-MTHXSQLBSA-N 496.992 0.707 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)c(OCc3ccccc3)c[nH]1)C2)[C@@H](O)CCl 1792975270 MRGRBVVBRNXNSJ-MNDZRTMASA-N 475.929 0.757 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N[C@@H]1C[C@@H]3CC[C@H](C1)N3C(=O)[C@@H](O)CCl)C2 1793112421 IIAGHMARUUXCBN-GAGVYUBLSA-N 452.939 0.860 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734290 BTAPTQFCAGQLQX-XEMDLRDOSA-N 451.332 0.576 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(C)n[nH]c1C)C2 1796443773 IXURWVQYWVYIRL-IHBLFXCCSA-N 455.519 0.293 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc(-c2ccccc2)n1 1796535769 QGSXRPFOLIHKPZ-IRJINJETSA-N 471.322 0.945 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccnn1-c1ccccc1 1796738327 BAQMOBLPOAAPNE-OPMZPASUSA-N 460.299 0.069 50 20 JCGD Cn1ccc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)c21 1797053284 IPODWUWVVVRDBS-CWPLJXCYSA-N 462.510 0.694 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncsc3[nH]1)C2 1797751533 DBGGBMUKSYFSQW-CULMDFNYSA-N 455.500 0.140 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)C2 1800982981 MZNDPTNEAFSHHI-LXTVHRRPSA-N 463.934 0.789 50 20 JCGD O=C(Cn1nnc2ccccc21)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804016923 PRFONIZWGHYVSN-YADARESESA-N 484.325 0.526 50 20 JCGD O=C1CCc2ccc(C(=O)N3CC[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)nc2N1 1807364349 UFUVHPIVGXKFBY-CVDCTZTESA-N 499.336 0.675 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2n[nH]c3c2CS(=O)(=O)C3)[C@@H]1c1cccnc1 1807742558 KRGBQUMSNVLCOG-XUWXXGDYSA-N 481.962 0.807 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1 1808414884 OEBHUQBNGBJDTH-FIMQGSNUSA-N 491.508 0.934 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc2n(n1)CCCC2 1809865870 SQZWPXPZFKLZAE-WMZHIEFXSA-N 473.342 0.928 50 20 JCGD CN1CCC[C@H]1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810293704 GHJWLEZFQSSPNS-VDGAXYAQSA-N 451.531 0.494 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1 1810300144 XDSPPBBGJPUSHV-YWZLYKJASA-N 477.481 0.113 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1812950088 KRQJLZWKIYRGET-OZOXKJRCSA-N 496.373 0.994 50 20 JCGD CC(C)N(C)CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1813599188 NURVPJYSGPPYBV-DYESRHJHSA-N 453.547 0.740 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1814171213 IJMQKGAGLKWYKN-LPHOPBHVSA-N 482.541 0.989 50 20 JCGD O=C(CCBr)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815355101 MWKVAVXBNHPKMF-LBPRGKRZSA-N 452.139 0.834 50 20 JCGD CC(=O)Nc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815355728 ZUZOPJDNUAQXKG-OAHLLOKOSA-N 479.327 0.716 50 20 JCGD Cc1noc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n1 1817567513 ZUGRMPOVIACGIY-OAHLLOKOSA-N 453.463 0.648 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3nc4ncccn4n3)sc2C1 1818306744 QHVFFOMQRREWCA-SNVBAGLBSA-N 478.498 0.119 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCOC2=O)n[nH]1 1818848303 YKLPEUWMHZXGBH-MRXNPFEDSA-N 470.490 0.556 50 20 JCGD Cc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c(=O)[nH]c1C 1819401502 FELZHZPJUGODIS-MRXNPFEDSA-N 479.501 0.728 50 20 JCGD O=C(O)c1cnncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819759614 LNYCYNZDBOYYJQ-QGZVFWFLSA-N 464.247 0.197 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](O)N3CCOCC3)sc2C1)[C@@H](F)Br 1819891132 OJHHWXFGTNFPTN-XPLICSAQSA-N 451.318 0.396 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2)n1ccccc1=O 1820132209 ULPKUFKQJFZIGV-UONOGXRCSA-N 460.560 0.851 50 20 JCGD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1823497811 HSMYTANOHKZCJZ-HNNXBMFYSA-N 487.372 0.256 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1 1824188579 SSYVIYSUOGBUJZ-NVXWUHKLSA-N 454.911 0.976 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)n(-c2ccccc2)n1 1830727948 LGVMJIHEEJBXFX-SIKLNZKXSA-N 462.934 0.850 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1831639974 HQCWOUVETIUBLL-UTKZUKDTSA-N 452.939 0.675 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)no3)CCO2)C1 1832567132 FVVQQEDJZPATLD-OLCUMFGGSA-N 472.502 0.116 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832729538 HRYLBKIHSQJKES-IFXJQAMLSA-N 469.336 0.051 50 20 JCGD O=C(CCc1cccs1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833154228 HJJPJWLZVIPAAB-QFIPXVFZSA-N 458.345 0.131 50 20 JCGD Cc1ncc(Br)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833394337 SFTIOSMWGWVIMG-MAUKXSAKSA-N 476.755 0.822 50 20 JCGD Cn1cc(F)cc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835248613 UQUWBOVWNBPJEU-UHFFFAOYSA-N 471.537 0.662 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2 1835467114 LHJZCCQITXOVPC-LJQANCHMSA-N 470.253 0.169 50 20 JCGD O=C(c1ccc2scnc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937195 RVZMNCVFVBBWFZ-QHCPKHFHSA-N 481.339 0.360 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccc4sccc4c3O)C2)C1 1835939077 DRGKHQVIDGQAKX-XMMPIXPASA-N 496.350 0.671 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836718481 ZAIWMVHIZXAOHO-ROUUACIJSA-N 492.013 0.860 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1837078503 BVRGJUQKXNORFC-OAHLLOKOSA-N 494.452 0.499 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837171317 JIYNBPHYAFSPPK-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD Cc1nc2ccccn2c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837458843 FGHCKQWKWYIDEA-XMMPIXPASA-N 493.524 0.025 50 20 JCGD CN1CCc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)ccc21 1837460050 ZTIKUQKJWXLRMP-VWLOTQADSA-N 494.552 0.061 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460114 VQIQVYNCRHEJDL-XMMPIXPASA-N 499.572 0.409 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1 1837461983 KIWATKSUMSLBFQ-RUZDIDTESA-N 479.537 0.170 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cccc1Cl)CCO2 1838871287 OERTUPGHRYKERB-NRFANRHFSA-N 470.929 0.922 50 20 JCGD O=C(c1cnc2snnc2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200490 LYERJWWCQCJYDZ-WBMJQRKESA-N 474.312 0.847 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4cc(C)ccn34)CCO2)C1 1839602313 ACYDRACEOXTJHD-HRAATJIYSA-N 450.923 0.967 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4ccc(OC)nc34)C2)C1 1840153794 AVQUEFQLZVGCNU-VFNWGFHPSA-N 466.922 0.895 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1840371561 QDKWLONRKWYHEM-UXPWSPDFSA-N 490.388 0.150 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1841289412 YZLBLRIMHVKXCE-HZSPNIEDSA-N 487.420 0.401 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012826 SJNGPNXIHYORHI-KRWDZBQOSA-N 477.392 0.440 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)c1ncc[nH]1)C2 1843428878 WCIVACRYTXCDFC-SFHVURJKSA-N 497.361 0.043 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ncccc2Br)C1 1844506750 XRPBVDMUHXXEQE-UHFFFAOYSA-N 459.304 0.973 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc1 1846385937 NJZAQNXBLNWDNF-UHFFFAOYSA-N 473.574 0.668 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC(=O)N(Cc2cccs2)C1 1848149426 HYYVFRXHXIVMRM-SZMVWBNQSA-N 461.588 0.671 50 20 JCGD CN(CC(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)S(=O)(=O)c1ccc(Cl)cc1 8631141 UTXSYHQAEPIJKV-UHFFFAOYSA-N 484.874 0.873 50 20 JCGD COc1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc(OC)c1OCC(N)=O 12702764 BLTIOPRGFSBCSR-UHFFFAOYSA-N 479.515 0.244 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)NCc2ccc(F)cc2)c1 26745623 SPDRDBDHNHSBIV-UHFFFAOYSA-N 451.480 0.336 50 20 JCGD CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1 28197045 WHDKKSYEBJGYPV-UHFFFAOYSA-N 480.568 0.844 50 20 JCGD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1[N+](=O)[O-] 726522996 FXURKOCRCXGEGW-GOSISDBHSA-N 464.442 0.945 50 20 JCGD CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1 728633916 QOXASICUHUPJEK-XLIONFOSSA-N 496.476 0.715 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc3C2)c1)C(=O)N1CCCC1 748247138 UUNJKWYXAXBKIE-UHFFFAOYSA-N 456.524 0.817 50 20 JCGD O=C(NNC(=O)c1nnn(-c2cccc(F)c2)c1C(F)(F)F)N[C@H]1CCS(=O)(=O)C1 748718105 RFZGJCHMUDRUGH-VIFPVBQESA-N 450.374 0.556 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(N3CCCS3(=O)=O)c2)n1 830429247 ISHARHBHLRCONI-UHFFFAOYSA-N 452.514 0.538 50 20 JCGD Cc1oc(C)c(S(N)(=O)=O)c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916096594 YBMQOGIRYUTKGO-UHFFFAOYSA-N 470.529 0.403 50 20 JCGD O=C(NNC(=O)c1cccc[n+]1[O-])c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 916144708 JYSNQEHRWJLXJA-UHFFFAOYSA-N 495.561 0.901 50 20 JCGD O=C(COC(=O)c1cccc(S(=O)(=O)NC2CC2)c1)NNC(=O)[C@@H]1COc2ccccc2O1 916655267 YEZYDCHWSTWCGD-SFHVURJKSA-N 475.479 0.272 50 20 JCGD COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 917724444 VYVTZZQIKQDLII-UHFFFAOYSA-N 470.529 0.463 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)CC1 918138731 ZLOMOQZETVQIBM-UHFFFAOYSA-N 463.491 0.481 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@H](O)CN1C(=O)Cc1ccccc1F)NNC(=O)c1cccc(Cl)c1 919184629 VIAWHVBJRVOBOI-WMZOPIPTSA-N 477.876 0.988 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)OCC(=O)NNC(=O)c2cccs2)cc1 920679005 DEOVAZDDVPKVKT-OJXHRBAXSA-N 470.507 0.856 50 20 JCGD CS(=O)(=O)c1nc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccn12 921166488 LXNUSWFBODKHSE-UHFFFAOYSA-N 471.904 0.113 50 20 JCGD COc1ccc([C@@H](CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)NC(C)=O)cc1 921173786 RMPFTTFZCBXZEX-XLIONFOSSA-N 471.466 0.793 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1779035001 ZLBMJUBDZMDIPT-JOCHJYFZSA-N 455.519 0.032 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)n1 1779234717 KBWUDUHLZJLBJU-IBGZPJMESA-N 455.353 0.902 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1781516937 XDDUGXJGBWDVQA-WHSLLNHNSA-N 456.540 0.435 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1781985402 NYQVFRNLDBPPIZ-QFIPXVFZSA-N 486.460 0.798 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CS(C)(=O)=O)C2 1781997070 BIQPRHBWJSWIOO-SZOQZIPDSA-N 453.399 0.964 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1 1782970073 DLIYQECJUJNAAX-JOCHJYFZSA-N 486.460 0.419 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1783351787 LOGHLCBZTKHZAJ-KUHUBIRLSA-N 485.404 0.895 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(N4CCOCC4)c3)C[C@@H]21)[C@@H](O)CCl 1784092708 UBHOTIJTCAZFOJ-LEAZDLGRSA-N 451.951 0.716 50 20 JCGD O=C(Cc1cccc2ncccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784457545 ITANGKITVKRURL-APTRMMRNSA-N 473.338 0.751 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C(=O)Nc4ccccc4)CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980116 KORFWJAOXWKPNH-NYVOZVTQSA-N 491.353 0.379 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c(C)c1 1788611445 YAXNIAFTIVBNCM-NDXORKPFSA-N 495.536 0.687 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Cn3cncn3)[C@H]2C1 1788723864 XMZMAXTXFKOEDL-MEOCNFHCSA-N 470.534 0.028 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)[C@H]2C1 1790174361 ZGIUQGOPTXKNDK-XSEXMBABSA-N 478.384 0.840 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3O)[C@H]2C1 1790264390 VACRDYFSDJJRGD-DAZSYXDRSA-N 469.498 0.825 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)nn3-c3cccc(=O)n3C)C[C@@H]21 1791253964 GGOHSPDXPNASNN-BMFAXAFESA-N 491.976 0.727 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn4nc(N5CCOCC5)ccc34)C[C@@H]21)C(Cl)Cl 1791295420 FWWLCVASSGCCEY-DZKIICNBSA-N 497.383 0.963 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)C(=O)c1ccc(Cl)cc1 1792945420 IOTZHZYKEQHCEI-HGKCTWBKSA-N 456.691 0.106 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792982688 MCMQNDNCVWKUJF-PNVHDIKGSA-N 457.955 0.575 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(C(F)(F)F)(C1)C2 1793474572 PYJXRVKPNRBAND-KYNXIJSSSA-N 452.238 0.302 50 20 JCGD COc1nn(C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1794579478 FOYAOVIWFJMISR-XRGAULLZSA-N 485.969 0.764 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)no1 1794846126 VZCHCTUSIAXJNL-RMFSNUHRSA-N 470.530 0.532 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCN(Cc3ccccc3)C1)C2)c1cccc(B(O)O)c1 1795737410 YQZKOWMBSUYLSK-UCKMRUJXSA-N 491.397 0.482 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1noc2ccccc12 1795765262 YMNUCOGDOLBHRT-GFENJXEQSA-N 464.482 0.272 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H](O)CCN1C(=O)OCc1ccccc1)C2)[C@@H](F)Cl 1796368527 LXCHEMDFRZGAAU-CABLIKTCSA-N 483.924 0.882 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)n2[nH]nnc2n1 1796572517 CPGCDAQXIJXSHC-OPDFLTKYSA-N 494.940 0.197 50 20 JCGD CCOc1ccsc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748149 KFEVMEMKXKUOCY-FVCICTRLSA-N 459.528 0.662 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccnc1Cl)C2 1797748487 FHJWXWGKDOCESU-ZSBFGKGUSA-N 458.906 0.179 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCNC(=O)OC(C)(C)C 1799260333 HQIRNJFGRQTVFZ-HGTKMLMNSA-N 478.384 0.901 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1799276296 ISPQKGIGZZPKGD-BASYENTBSA-N 470.419 0.484 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801224631 OFCLJNZMBVQVNE-MFCZKXCZSA-N 452.515 0.162 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)C2 1802339959 VAFFTIKTFKZSNH-WHGMGBLPSA-N 453.543 0.908 50 20 JCGD O=C(CNC(=O)c1cccs1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804571551 GHIMMHYDQCBNFS-PGRDOPGGSA-N 492.366 0.573 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1806342237 LINRCELFQJQHGP-GUYCJALGSA-N 452.309 0.424 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](N)c2ccccn2)[C@@H]1c1cccnc1 1807166791 GCGWWISJJOVBEV-YHYVQYDKSA-N 453.547 0.555 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1 1807373625 CSDGNKOQEAMOQJ-PGRDOPGGSA-N 476.298 0.946 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1[nH]nc2ncccc12 1808107019 OJCHMYIJGGZZMO-UTKZUKDTSA-N 470.298 0.666 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810302570 LEFGGCIUKJZONW-IIBYNOLFSA-N 475.509 0.412 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1 1810305645 OPMATGFUDDCINX-JXFKEZNVSA-N 490.524 0.693 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCc2cnccn2)[C@H]1c1cccnc1 1810309450 QYZWWLRZRHKEJB-JTSKRJEESA-N 474.525 0.823 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)C(=O)C(=O)O 1812390581 ZNRAQPNRXQKQPW-XJKSGUPXSA-N 455.309 0.415 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813069537 ZMBMDEMDZSYFKY-KSSFIOAISA-N 460.564 0.667 50 20 JCGD O=C(Cn1nnc2ccccc21)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336780 FBGAFGJQAWFUBZ-HNNXBMFYSA-N 476.327 0.494 50 20 JCGD O=C(/C=N/N1CCCCC1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344232 OXXAAMIFWQXAHN-DXRSZSRVSA-N 455.349 0.520 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cnnn2)n[nH]1)NC(=O)NCc1ccccc1 1817615644 BYCKFYRZVQDLMG-SFHVURJKSA-N 495.548 0.435 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1[nH]nc3ncccc13)CC2 1819797732 YWQBRZFOWHJPIJ-JTQLQIEISA-N 477.510 0.953 50 20 JCGD CN(C)c1ncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)o1 1825753777 CTMXPBPEELQFBC-LJQANCHMSA-N 454.336 0.968 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060491 LTBUUSPDSBYIIB-WMZHIEFXSA-N 460.336 0.216 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1830669015 YFDSWWPDVHNOLD-UXHICEINSA-N 489.378 0.443 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830719998 QQJPVVFPMJSBKK-GEYWLOKFSA-N 489.997 0.736 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2n1 1830727824 GXMOREVOQRXDDP-OXQOHEQNSA-N 451.911 0.016 50 20 JCGD O=C(C1CCN(c2ccc(F)cn2)CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830735624 JGSNZAMEFDYFHJ-GCJKJVERSA-N 484.956 0.493 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830738418 OTZCUPQCXKMBFU-GSHUGGBRSA-N 492.013 0.839 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(F)(C1)C3)CCO2 1831586941 HPTQAFJJNYXGEO-UUMCHTHNSA-N 461.494 0.469 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn(C)c3=O)CCO2)C1 1831881611 ZVAPUFDMTUZWOP-AUUYWEPGSA-N 456.337 0.486 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1834823498 XLPAMGBJNMEPIA-SFHVURJKSA-N 452.309 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)Cc3cccnc3)CC2)CC1 1834880256 UUTHLBGHBLPQDC-UHFFFAOYSA-N 465.558 0.508 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccn4c(O)nnc34)CC2)CC1 1835044154 XFUZOMKVPFPMPF-KRWDZBQOSA-N 464.954 0.874 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)ccc21 1835364038 XXFNAWHNEAGSGJ-HXUWFJFHSA-N 477.993 0.662 50 20 JCGD COc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccn1 1835930523 ZNRWXVRWJXZEDC-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD Cc1ccc(SCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835930642 RKTWUWZIQYOYMA-DEOSSOPVSA-N 484.383 0.537 50 20 JCGD O=C(Cc1ccc2ccccc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935912 WWCOOZMMJZPQMI-HHHXNRCGSA-N 488.349 0.832 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1)[C@@H](F)Br 1836412847 YNPJHEGNVUNATM-CQSZACIVSA-N 460.304 0.764 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837338417 KMMLPMNUTNOWHP-OSPHWJPCSA-N 482.541 0.256 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1F 1837456469 NEGRJQDNXPXDDY-HSZRJFAPSA-N 487.488 0.217 50 20 JCGD O=C(CCc1cncnc1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920768 CUHGHPCGCSDDHD-UHFFFAOYSA-N 466.347 0.401 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C(C)(C)C)n[nH]1)CCO2 1837993967 PHPAMOKGYFGWLZ-JOCHJYFZSA-N 464.567 0.150 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3nn[nH]c3C(F)(F)F)CC2)CC1 1838552174 XBSOXYMPUIYVBV-UHFFFAOYSA-N 489.499 0.809 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839219042 RVZSMFVFCLNLEP-MZNJEOGPSA-N 483.525 0.223 50 20 JCGD O=C(c1ccc(Br)c(O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839329003 SFXCBVZJDXQNNS-MAUKXSAKSA-N 477.739 0.824 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1839478015 XMJCMJLFAQQAMR-GHTZIAJQSA-N 463.922 0.245 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1839928534 HOAVDNRFWARPIC-DFBJGRDBSA-N 466.343 0.630 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCCC3=O)C2)C1 1839966704 NPMVRDODDPZBSY-KXBFYZLASA-N 460.369 0.629 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1839967071 ZJQDEGZEXHCBKS-SCLBCKFNSA-N 473.324 0.191 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1840033332 ARMUCXPHSKUCNC-QVKFZJNVSA-N 495.374 0.580 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(NC(C)=O)n3)C2)C1 1840150689 PAHTVTVUDXWKGW-MGPUTAFESA-N 454.911 0.364 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2 1840152251 CNUGLLQEUGERNZ-HRAATJIYSA-N 454.907 0.995 50 20 JCGD CN1CCCn2nc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2C1 1840189911 SUHKWJJPFXXAPB-IBGZPJMESA-N 460.362 0.592 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CS(=O)(=O)N1CCCC1)C2 1844692477 AKORYPRDWLPOAQ-UHFFFAOYSA-N 494.526 0.763 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846143509 HUHYHOUCRGLWFS-VDGAXYAQSA-N 483.374 0.971 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1847100751 WQOQCMDLRHOLIB-KGLIPLIRSA-N 475.974 0.131 50 20 JCGD Cc1nnc(NNC(=O)c2cccc(S(=O)(=O)NCc3ccc4c(c3)OCO4)c2)[nH]c1=O 11335806 VPDOQJZVWIMNCL-UHFFFAOYSA-N 458.456 0.437 50 20 JCGD CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 28196550 MMYIEUWPAVSFSJ-UHFFFAOYSA-N 494.595 0.638 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc(N4CCCS4(=O)=O)c3)cc2)CC1 728213511 CYADPEKGPQYLPL-UHFFFAOYSA-N 493.611 0.920 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(Br)cc1Cl 728261169 OLLHUKJWRAXMCK-ZETCQYMHSA-N 489.753 0.633 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1nnc(O)c2ccccc12 748464311 BGTAVJBEHSZSME-UHFFFAOYSA-N 464.486 0.413 50 20 JCGD COC[C@H](C)n1c(SCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nnc1-c1ccccc1 751361545 KMIDRRVFVSQIAO-DZGCQCFKSA-N 482.588 0.762 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)n1 761228654 PUERBTJWNWCESP-UHFFFAOYSA-N 451.505 0.185 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 913606416 LCPAUOKLFSRXHT-UHFFFAOYSA-N 494.595 0.827 50 20 JCGD CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)o1 914837105 GSYLFQYNVBAGRF-UHFFFAOYSA-N 470.529 0.389 50 20 JCGD O=C(NCCc1ccc2c(c1)OCCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915891709 SKXPHKLMUHLTIQ-UHFFFAOYSA-N 490.538 0.665 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 916643033 DRHFLUYBABNKTC-UHFFFAOYSA-N 497.622 0.867 50 20 JCGD CCN(CC)C(=O)N1CCC(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CC1 917918753 DEKLWMRDGVYRLT-UHFFFAOYSA-N 459.956 0.922 50 20 JCGD CCCC(=O)N1CCCC[C@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 918142721 HLXOMBIDZUVORE-FQEVSTJZSA-N 494.614 0.969 50 20 JCGD CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc(C(C)C)nc21 918209213 MKVXSYJTOHLSGP-LLVKDONJSA-N 451.505 0.226 50 20 JCGD C[C@H](Cc1cccc(O)c1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 919785072 ZDZXDFSOKMFVLB-OAHLLOKOSA-N 462.528 0.988 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 919822762 IAFDKYPCCLPEMI-KRWDZBQOSA-N 483.568 0.167 50 20 JCGD O=C(NNC(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)N[C@@H]1CCS(=O)(=O)C1 919889883 VYGUAIWJLRJZMS-CYBMUJFWSA-N 457.468 0.222 50 20 JCGD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2)cc1 920254834 QJDRCLQESDHITQ-XPTLAUCJSA-N 466.494 0.887 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2cccnc2n1 1778952030 WDTKAXRDTKMHHW-PXDATVDWSA-N 474.326 0.751 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ncccc4c3)CCO2)C1 1779030501 RDUZBPNWYITNFA-XMMPIXPASA-N 460.494 0.991 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1780095615 QXPQFRAGRCZXHG-QFIPXVFZSA-N 499.436 0.766 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1780543365 YQGXUCYBLQCWRY-BXTJHSDWSA-N 470.979 0.005 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1780920502 OPVMFVCWKIDTBG-VWLOTQADSA-N 492.341 0.346 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)C1 1781099277 POSIKTXYHVJLJR-AUSIDOKSSA-N 498.496 0.740 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1781362749 SHAFVRMPECMCRF-VFCRVFHLSA-N 472.970 0.569 50 20 JCGD COc1cccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)n1 1782209019 GSPUCSRQTXGOCQ-WZONZLPQSA-N 461.563 0.520 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(-n3cncn3)c1)C2 1782213386 NZDMSNHIEYUKEB-HYBUGGRVSA-N 483.573 0.768 50 20 JCGD C[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)Oc1ccccc1 1782878787 ITBHEQLDXJMXHG-UUOWRZLLSA-N 452.316 0.668 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1783533256 YKDGTCSTNYFRAG-ZKTNFTSUSA-N 469.336 0.606 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)C1 1783936957 BNNKTVBRLWYXIN-DRSNIGMVSA-N 452.552 0.169 50 20 JCGD C[C@@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)n1cncn1 1784472861 ZGZGDVWREUTWFA-AVYPCKFXSA-N 470.958 0.801 50 20 JCGD C=CCO[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1784504098 KVWFCIBMGWMLMB-QESAQDPVSA-N 487.601 0.903 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786983069 HNBNCIZRLNPBIF-VJBMBRPKSA-N 450.344 0.819 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984749 FLAKRJYHYHULAO-IHPCNDPISA-N 488.390 0.718 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C[C@@H]21 1788611596 LXLZGTUPSDKALH-NDXORKPFSA-N 496.524 0.819 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C[C@@H]21 1791255012 ZIMKIZUGUPQDKJ-FPXQBCRKSA-N 464.950 0.574 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2 1792867146 YNLNUGJCRRZNER-UKSCXKOUSA-N 496.402 0.786 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793066610 ZSMYNUHOHYZJPG-MQFRRQCYSA-N 493.369 0.168 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793594631 CRCIYBCUOYLHJD-PIKOESSRSA-N 487.362 0.039 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](N)c1cccnc1 1795677850 NOKQHOCSWMMAJW-ZCHQYYIMSA-N 467.530 0.195 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@H]1SC(=N)NC1=O 1796426871 KLYFFYOHMYDNFL-IMHINIOTSA-N 451.318 0.069 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ccc1O)C2 1796443721 DUQCKKHGGGXILZ-NPBXBZOPSA-N 455.471 0.435 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)nc2ccccc12 1796988365 KWCMGOZWRMOXPX-FEJSZKPUSA-N 459.311 0.740 50 20 JCGD Cc1oc2cc(O)ccc2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1796994948 NIRBCICEDPOTLV-GFENJXEQSA-N 479.493 0.962 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798521291 ABFFNDHCGHPKGG-ZCQATVAHSA-N 476.486 0.638 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097153 FSOYFHGLDGKYKU-AJYBTWMASA-N 481.981 0.176 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)C1 1799198046 RGPNBEOVYNLUAP-XVIXHAIJSA-N 466.362 0.608 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2 1800754541 RBMNHDGUAHNLSS-HPCHECBXSA-N 464.357 0.245 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(Cl)c(F)c1)C2 1801010853 ZZDYLPOMZXMILB-GFENJXEQSA-N 470.929 0.821 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)C2 1801013010 PUJZNZYOHMKTRX-XJIHWEBXSA-N 493.605 0.062 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801017309 LCZIBJNHAFQLRM-YVECIDJPSA-N 454.351 0.655 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)C1 1801052516 RGHMFXZMHXEAHW-IMDDZUEWSA-N 494.358 0.638 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCCS1(=O)=O)NC(=O)NCc1ccccc1 1801518447 AHBKXLBPYMAKEY-IYWMVGAKSA-N 491.614 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1O)C2 1802336566 MXZZQLZFSRXNJY-PJVZLEMVSA-N 495.621 0.616 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)c2ccco2)[C@@H]1c1cccnc1 1802522468 GYJWLPAOWNSPMA-XPGWFJOJSA-N 464.482 0.726 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807360211 PFRKCNIFGVEFFO-LDQXTDLNSA-N 496.373 0.994 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361035 OGGCPOFOTOHCAT-JTSKRJEESA-N 470.298 0.666 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363890 RBLJZMOECQIDBL-LAUBAEHRSA-N 479.277 0.491 50 20 JCGD Cc1noc(C)c1CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807369213 CIHKCODTTNKGLH-AUSIDOKSSA-N 462.315 0.929 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373767 GASPULVUKSYBAE-HOJAQTOUSA-N 457.361 0.195 50 20 JCGD CN(C)c1cncc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)c1 1809969644 YPYTTXYLIVVPHZ-UHFFFAOYSA-N 450.348 0.986 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810294167 IOEYCSRLUWXOOR-SIXWZSSISA-N 488.570 0.080 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1 1810948618 PVVVKNJRUQZMSG-RKPMPJFSSA-N 464.486 0.964 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ncon2)[C@@H]1c1cccnc1 1811176310 OKDWYPQBLIBOCG-HZWOONMDSA-N 450.459 0.918 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1 1812353224 MDFJZGJPBQGATL-KSFYIVLOSA-N 471.518 0.035 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@@H]1c1cccnc1 1812889739 SDKDKGBTVYJZSC-KHYFJFHWSA-N 464.526 0.967 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1813071351 SMXLSLQLUAEHDE-CVDCTZTESA-N 455.563 0.974 50 20 JCGD 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RTYYEUXFVUZTMM-HNNXBMFYSA-N 450.544 0.148 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1 1826086502 XAUOCQPOVARYEB-CYBMUJFWSA-N 474.543 0.924 50 20 JCGD COc1ccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)nn1 1827058190 QBDUGRJGNXDIEJ-FQEVSTJZSA-N 452.320 0.712 50 20 JCGD NC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1 1827500767 JHYZLRRPMSGVCK-MRXNPFEDSA-N 464.312 0.461 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829074076 WTNALHRJPRVDTR-UWJYYQICSA-N 457.380 0.905 50 20 JCGD Cn1c(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc2ccccc21 1830433346 QDPSXALUQSZIAQ-AREMUKBSSA-N 491.353 0.171 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(F)(F)C(=O)O)C2)C1 1830538411 FFIWRIAOZWZBFY-ABAIWWIYSA-N 457.268 0.584 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1 1830539086 AKNLFOGVMLQYCB-QINHECLXSA-N 470.364 0.897 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](S)C(C)C)CCO2 1831487575 QCTQIVVUGNYTOY-CVMHLPAOSA-N 465.576 0.531 50 20 JCGD COCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549125 GFESBUYCJRUJKH-MGPUTAFESA-N 463.959 0.611 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc4snnc4c3)CC2)CC1)[C@@H](O)CCl 1833312706 XYGWYWIWVMMKNU-INIZCTEOSA-N 452.968 0.871 50 20 JCGD CC(C)(C)n1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1Cl 1833602639 IKQFMJDMNPKIPK-IFXJQAMLSA-N 463.362 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(C(F)(F)F)c1)CCO2 1833794952 ANGJIIGHPLQENI-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD Cn1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)c1 1834441486 ZSKAIZDWYXJKEU-YCRPNKLZSA-N 485.969 0.622 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C[C@H](NC)C(=O)O)CC2)CC1 1834740199 SGABUCDJKBQAAG-HOTGVXAUSA-N 461.401 0.794 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1834819137 HXJOOIZGQGPJBT-ZDUSSCGKSA-N 479.221 0.583 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834821649 SDBRUFQJNOWRNO-YOEHRIQHSA-N 461.382 0.254 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1 1834825026 RKRCJIKXIMAKDA-FXAWDEMLSA-N 455.349 0.831 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3c(F)cncc3F)CC2)CC1 1835737969 OXFJYRLQARWMLI-UHFFFAOYSA-N 487.511 0.857 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835830170 DWUWQZUUXVHSOB-ZYVYOHQTSA-N 485.589 0.383 50 20 JCGD CCCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939136 GJEDZQPKGZDNKD-RUZDIDTESA-N 466.343 0.703 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n(-c2cccc(=O)n2C)n1 1836260204 VYJUAJFTDLDWNG-OAQYLSRUSA-N 498.367 0.753 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@H]1CNc3ccccc3O1)CCO2 1837355984 IQISZRQSOPZAPA-MHECFPHRSA-N 489.573 0.079 50 20 JCGD O=C(c1nnc(-c2ccccc2)o1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837534390 LWFCVBZTYDWOCU-FOIQADDNSA-N 450.879 0.406 50 20 JCGD O=C(c1ccnc(Br)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837810385 IPOLOEWSKKYWFQ-SUMWQHHRSA-N 462.728 0.514 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838418311 XMNGPKRTQIEOTE-BFUOFWGJSA-N 470.935 0.080 50 20 JCGD O=C(c1cccc(-c2cnccn2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838589630 XLAOTMONTMPSJV-KNQAVFIVSA-N 460.918 0.813 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)N1CCN(C)CC1)CCO2 1839106065 GQCYLLHHXNRRIK-MBOZVWFJSA-N 475.428 0.252 50 20 JCGD O=C(c1cc(Cl)ncn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200857 QYJFAPDTVUVWPC-WFASDCNBSA-N 451.680 0.891 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3O1)CCO2 1840139024 IFQXHVVAJNWGKS-GBXCKJPGSA-N 474.558 0.210 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1 1840156801 UATQQHPVBPPTOS-QRWLVFNGSA-N 492.953 0.553 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840187751 UOGMZJLRRAAIMN-FNLSEGDXSA-N 460.318 0.381 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cc(Cl)c1)CCO2 1840709896 NLVCCMIVIVUBJS-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cc(Cl)c1)CCO2 1840711565 WXRGFABGFVLXMD-NRFANRHFSA-N 470.929 0.922 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1841414933 SNHZEOQWHUVUQS-NRFANRHFSA-N 463.343 0.782 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264552 HBHITJDCHYEASY-UHFFFAOYSA-N 451.409 0.568 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1845823080 SHJBWDGGIGOSHW-UHFFFAOYSA-N 494.552 0.607 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CSCN2C(=O)[C@@H]2CCC(=O)N2)C1 1845873500 ZFAFAQLAFYSGDZ-QLFBSQMISA-N 456.996 0.777 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)C1CCN(c2ncccn2)CC1 728890156 YFPLKUJOEMZGNZ-UHFFFAOYSA-N 450.496 0.348 50 20 JCGD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)C1 731218492 BSBYRMURZQPFLP-IAGOWNOFSA-N 493.634 0.647 50 20 JCGD Cn1c(CCC(=O)NNC(=O)C(=O)N2CCCC2)nc2cc(S(=O)(=O)N3CCCCC3)ccc21 748247072 JPBACAXUXVMUPO-UHFFFAOYSA-N 490.586 0.450 50 20 JCGD CC(C)[C@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)N1CCCC1=O 748552030 BAFPDPSICOAUHP-OAQYLSRUSA-N 480.587 0.435 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)cc2)C[C@H](C)O1 912921110 LTYBKWYJJZRFPQ-BDXSIMOUSA-N 482.603 0.745 50 20 JCGD CCc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 913459259 DPJCAYDDYUFWOW-UHFFFAOYSA-N 463.512 0.915 50 20 JCGD CO[C@@H](C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 917703874 ROYBDTBCCXWMLL-HNNXBMFYSA-N 456.503 0.246 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2F)cc1 918061897 DIURFBKQJFBFBF-UHFFFAOYSA-N 459.477 0.463 50 20 JCGD Cc1ccc(CNC(=O)N[C@H](CC(C)C)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 919888439 CRKBHFBEAIHQDX-DLBZAZTESA-N 453.565 0.726 50 20 JCGD Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nc2ccccc12 1777876424 IAPIVRBWQSTADA-RUZDIDTESA-N 459.311 0.980 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccc4)no3)C2)C1 1779578338 YOYISHUOETWUTH-DEOSSOPVSA-N 461.283 0.779 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779656745 RXMULFYJSISARS-IBGZPJMESA-N 481.435 0.195 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1 1779688344 JVTZHEVMQBYYFM-QQNPRBCQSA-N 490.524 0.845 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2n1 1780042273 VTIZAHZKXMJWFW-QHCPKHFHSA-N 464.287 0.009 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ncccn4n3)CCO2)C1 1780097935 SJLKYWNRRWCNSG-QFIPXVFZSA-N 495.452 0.715 50 20 JCGD COc1ccnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)c1OC 1780252474 WVMWFCNCLIKVLZ-HOYKHHGWSA-N 498.540 0.539 50 20 JCGD CC(C)N(C)CC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968630 FUALYNSPNZMYDL-DEOSSOPVSA-N 474.606 0.503 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ccc(F)cn34)C2)C1 1782462786 KWYCOFWTXIIXFR-JOCHJYFZSA-N 467.461 0.229 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1 1783872566 BPDVXWGFUVBMFD-DYESRHJHSA-N 452.939 0.616 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1 1783880807 GWRBKHIVRSHNIU-KXBFYZLASA-N 462.927 0.927 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@H]21)[C@@H](O)CCl 1784091937 FHJGHDXAZWSMPH-LVLWZLKYSA-N 451.867 0.664 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C#N)CC3)[C@H]2C1)NC(=O)NCc1ccccc1 1786696800 LOTGBCIBYGRGCU-UFYCRDLUSA-N 468.558 0.616 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786983139 KMKRUSKCPPDNJQ-HJWJTTGWSA-N 453.142 0.133 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CS[C@H]3CCCCO3)C[C@@H]21)c1cccc(B(O)O)c1 1786983967 ICVGXAXZDBIPPZ-WBKMXMRLSA-N 462.377 0.220 50 20 JCGD O=C(Cc1ccc2ncnn2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1789717321 YCKRHMBVPMKMEI-WSMBLCCSSA-N 454.300 0.942 50 20 JCGD O=C(Cn1cnc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791176138 VLVMZXXCVJRLSU-JLMWRMLUSA-N 462.315 0.010 50 20 JCGD CCSc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1792395997 JVIUINSAYGKBOA-HGKCTWBKSA-N 455.345 0.390 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(OC(F)(F)F)c1)C2)c1cccc(B(O)O)c1 1795740531 FDHHVWJBOABVHK-UPHUGPLXSA-N 492.259 0.711 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCO3)C2)c1cccc(B(O)O)c1 1795740605 COMYQPWIRUOMPM-HATOLVCRSA-N 450.300 0.208 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)ccc2c1OCCO2 1796251951 XMQOXGPTOMOOHU-VPTLXERWSA-N 460.531 0.342 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3n[nH]cc3c1)C2 1796440596 UGGYEJHBGBBBMD-UCNOBMHRSA-N 463.498 0.900 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]cnc1-c1cccnc1 1798496053 MXBODWPNLSPMNP-HGKCTWBKSA-N 455.519 0.048 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2)[C@@H](F)Br 1799348514 JISXTOGEYYHTJA-OTMMVIPVSA-N 459.297 0.650 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)C1CCN(c2ccc(F)cn2)CC1 1800290508 VSKFNWOWSYHKPQ-BBIADKPPSA-N 496.348 0.020 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1804094572 IZWYINRDIBAJFQ-JKIFEVAISA-N 466.336 0.813 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n[nH]1 1805259398 UKKHLEWKGFVAJX-FOIQADDNSA-N 476.497 0.639 50 20 JCGD CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1806293214 MJBPBMTZDBBLOS-PSQWMWCVSA-N 451.288 0.200 50 20 JCGD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc2nccn12 1807363207 BESZXZZRELKBAV-DENIHFKCSA-N 484.325 0.746 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370909 NBAZZMLQEHBZFH-VGOFRKELSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1[nH]nc2ncccc12 1808106964 MJCSNLYGCTYKJQ-UWJYYQICSA-N 470.298 0.666 50 20 JCGD C[C@@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)O1 1809557020 GESHKBKXGOIZHJ-NVRFMJDISA-N 452.515 0.967 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2)CC1 1809748737 FBSDYEGEKZOBNO-GOSISDBHSA-N 496.653 0.833 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(C)C 1810106970 RIEABMOVOSSZIY-UIFIKXQLSA-N 482.541 0.987 50 20 JCGD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc2nccn12 1812169768 VAUSVBZQIUPXDA-KNQAVFIVSA-N 484.325 0.746 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](N)c3ccccn3)sc2C1 1815016520 PSCXLQLTFDVCCN-APPDUMDISA-N 466.527 0.462 50 20 JCGD O=C(Cn1cc(Cl)cn1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354641 OLQBOIMYPUQKJX-AWEZNQCLSA-N 459.724 0.599 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1 1816077613 WGZJSBYMLZLNMY-OAHLLOKOSA-N 456.507 0.583 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)c2cccs2)[nH]n1)c1ccc(B(O)O)cc1 1817470900 LJYBQLYCFOXVRV-KRWDZBQOSA-N 481.343 0.887 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1)c1ccc(B(O)O)cc1 1817471709 XQKLDUWTAGCRPZ-LJQANCHMSA-N 455.324 0.118 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1 1829063267 LHLLCNREHREJOH-QFIPXVFZSA-N 494.401 0.900 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C(C)(C)C)nc1)CCO2 1829572058 DSLDJOPFIMQMMD-DEOSSOPVSA-N 475.590 0.822 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1830246414 DNMBDPZIYUDDND-QHCPKHFHSA-N 482.434 0.380 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn(C)c3=O)C2)C1 1830536120 YMIGOOKEHWUIIE-AUUYWEPGSA-N 456.337 0.486 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1 1830546704 VPFKUJXSBVQJIX-AUUYWEPGSA-N 456.337 0.817 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733665 QQLSBZRUDSXLBJ-VFNWGFHPSA-N 462.971 0.801 50 20 JCGD C#CCO[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1833465864 SUFXBXSUAHPVEQ-CICSQNLLSA-N 470.574 0.730 50 20 JCGD COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)n1 1833765033 OUERONBILXWRTB-VUEBRRCKSA-N 484.513 0.294 50 20 JCGD O=C(Cc1ccccc1F)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834488909 HVHDTTFZWYZTAM-UHFFFAOYSA-N 467.350 0.933 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c(C)n1C 1834801085 KEHCUAPXLIYEPJ-UHFFFAOYSA-N 466.391 0.821 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c(OC)c1 1834801182 PHRBWRHASYJNCN-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834824758 LRWLDXUISKGXTL-KSSFIOAISA-N 480.356 0.071 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1nc2ncccn2n1 1835353010 MXNRMLIZUJTQNJ-CQSZACIVSA-N 468.331 1.000 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835448762 WUZHOOACVHNLTI-MOPGFXCFSA-N 452.379 0.401 50 20 JCGD O=C(c1ccnc(C(F)(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935236 JURVWIDWZYESRV-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939993 RRLSOSZMSZTHBW-HXOBKFHXSA-N 485.371 0.012 50 20 JCGD O=C(c1cc(=O)nc2cccnn12)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836718629 XGOPYRVHZOUYGH-KRWDZBQOSA-N 463.922 0.301 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1 1836967133 ONTSQXIIVMBMLH-IFXJQAMLSA-N 471.352 0.767 50 20 JCGD CCOc1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cn1 1837710087 HMWBWYVRQNMWLU-FQEVSTJZSA-N 452.584 0.797 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1837710482 ZYJHQXGAIGFXNK-HXUWFJFHSA-N 469.636 0.786 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)nn1 1838346192 LZDHJZWIAXNSLB-UGSOOPFHSA-N 457.325 0.586 50 20 JCGD COc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(F)c1 1839198352 YNFWMNYOIXDKML-RHSMWYFYSA-N 464.263 0.990 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)C(C)(C)C 1839198473 FKTUPKTXKUNNMK-HBUWYVDXSA-N 466.348 0.684 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1[N+](=O)[O-])CCO2 1839357950 RYEWFVNXLCWQKJ-NRFANRHFSA-N 481.481 0.177 50 20 JCGD COc1c(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1C 1839394423 YXYUAIBCBGWOFC-XMMPIXPASA-N 476.574 0.755 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc3c(O)cccc13)CCO2 1839606181 JFJJLMBTRJSNPM-RUZDIDTESA-N 491.309 0.004 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1ccccn1)CCO2 1839666048 MIQQPHNBECKJQZ-VWKPWSFCSA-N 497.390 0.687 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSCC(=O)OC)C2)C1 1839962569 KUATXJRAAZYIEL-CXAGYDPISA-N 467.382 0.523 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1839962941 VXBCETOZZYNXTA-FOIQADDNSA-N 485.379 0.765 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1840035460 SAUIAMWENGPAIA-QVKFZJNVSA-N 481.391 0.623 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCOCCOCCOC)CCO2)C1 1840077874 QKZZSFNSSRYCLI-FXAWDEMLSA-N 495.411 0.686 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1 1840149745 ZFTALQNIIFJMBZ-UTKZUKDTSA-N 450.923 0.587 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4ccccn34)C2)C1 1840152535 LMFCSWSMPSWBCU-HRAATJIYSA-N 450.923 0.967 50 20 JCGD COc1ccc(F)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840186595 BBZNFAPFAAZXDV-QFIPXVFZSA-N 466.510 0.277 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840335321 KSMZZWODUFOARZ-WZONZLPQSA-N 461.563 0.090 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1841477390 DLSOKOLOCPCLDA-PKOBYXMFSA-N 471.363 0.877 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)C1 1841826431 XQKNFAHAHRQJQW-YSURURNPSA-N 461.372 0.679 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CN1C(=O)C=CC1=O)C2 1841925447 WVMRFKAZJZZOQL-ZDUSSCGKSA-N 454.911 0.247 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc3cc(Br)ccn3n2)C1 1844148471 SOYNLNZEOHBTFG-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc2n(n1)CCNC2=O 1848095885 WPDVXMJHBDUATE-KKUMJFAQSA-N 480.953 0.574 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=S)NCCNS(C)(=O)=O)c2)c(C)c1 727065547 LISSLXDUPSHNAI-UHFFFAOYSA-N 499.640 0.762 50 20 JCGD Cn1c(=O)nc(O)c2cc(S(=O)(=O)NNC(=O)c3ccc(F)cc3Br)cnc21 728504938 ZEKDKKZZRCSDEZ-UHFFFAOYSA-N 472.252 0.559 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1 728512672 FGRRWSQVPKKYFF-NHYWBVRUSA-N 455.309 0.491 50 20 JCGD CS(=O)(=O)NC1(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CCCCC1 729047042 LXKKCRGAZLLPKE-UHFFFAOYSA-N 453.569 0.276 50 20 JCGD O=C(NNS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)c1ccc(-n2cnnn2)cc1 731181426 QXBPMDAYCAGWQY-UHFFFAOYSA-N 468.249 0.956 50 20 JCGD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)C1 731220494 INRQXRUBLHJXQT-AZUAARDMSA-N 486.621 0.746 50 20 JCGD O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)C(=O)N1CCCC1 748247184 VVPKQECLINJZHR-UHFFFAOYSA-N 468.532 0.066 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1=CC=CN2CCS(=O)(=O)N=C12 762384044 LYBZNPNFLVQXPY-UHFFFAOYSA-N 468.875 0.150 50 20 JCGD COc1ccc(-n2cnnc2SCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 894390868 LXZFRMUPPBVDRG-UHFFFAOYSA-N 451.472 0.805 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)C[C@@H](C)O1 912918894 GFXJVOWLEUSTAO-HZPDHXFCSA-N 477.587 0.494 50 20 JCGD O=C(CCS(=O)(=O)C1CCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915802064 IJTNGKFUPYMMQG-UHFFFAOYSA-N 473.573 0.216 50 20 JCGD C[C@H]1CCCCN1[C@H](C)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916448088 MILDGVOCNGBVFP-DLBZAZTESA-N 467.592 0.914 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cccc(N(C)C)c3)CC2)cc1 916724561 BYZQOTFUJQTIAA-UHFFFAOYSA-N 459.572 0.829 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cc1 919243633 PMTRZQROVXVMRW-JOCHJYFZSA-N 456.430 0.906 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1C(=O)[C@H]2CCCC[C@H]2C1=O 933651700 JLTCWBPJQLWMQY-OWCLPIDISA-N 471.539 0.601 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4[nH]ccc4s3)C2)C1 1778067935 PALCKCBXJCWFFE-NRFANRHFSA-N 454.512 0.985 50 20 JCGD C[C@H](Nc1nccs1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1778072057 MKRBVZTXHVCUEU-WTBBCNCBSA-N 487.586 0.770 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(F)F)no3)CCO2)C1 1779030065 GHGMKMQDBSINDT-LJQANCHMSA-N 450.402 0.368 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3c(F)cccc13)CCO2 1779032768 XZYKAVWAHRXMFH-QFIPXVFZSA-N 467.461 0.458 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)CNC3=O)C1 1779157225 PMJPXLRKTYYELF-CJFMBICVSA-N 492.536 0.370 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)CNC3=O)C1 1779162779 XTYPGACWIALNJL-NTKDMRAZSA-N 471.558 0.431 50 20 JCGD Cc1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cs1 1779371003 FQTPQWXQWPTWKZ-DYESRHJHSA-N 458.544 0.891 50 20 JCGD CCc1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)co1 1779822851 OWYCULHEDLCFHL-VGOFRKELSA-N 456.503 0.677 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1780543371 YQGXUCYBLQCWRY-STXHMFSFSA-N 470.979 0.005 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)c1ccccc1F 1781413949 JPFDWRXJWFKDSF-IOMROCGXSA-N 455.914 0.607 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781900013 JPUAZUDOPHOVRD-MBOZVWFJSA-N 467.169 0.667 50 20 JCGD CN(C)[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccc(Cl)cc1 1782821773 MZKWMNQPJOAECI-XUZZJYLKSA-N 485.777 0.766 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Cl)cc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1783723033 MNAPATOHIBQHLU-QFBILLFUSA-N 494.397 0.438 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CCO2)C1 1783876923 SOQQRKINPOFRIH-XLIONFOSSA-N 458.964 0.716 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cncc(C(F)(F)F)c1)CCO2 1783934813 HMRGUHOAYLGJJC-IBGZPJMESA-N 457.453 0.917 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(O)nc3O)C[C@@H]21 1785076529 PULHPAGOYIRPBL-MXAVVETBSA-N 499.952 0.613 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1786381425 OBMFFJVFIKOCAD-HNNXBMFYSA-N 458.345 0.795 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786979630 FTSVXYGWESPWRJ-SZMVWBNQSA-N 468.344 0.291 50 20 JCGD COc1ncc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607851 OWHQKPQAAIRWPI-IGNZVWTISA-N 488.932 0.649 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[S@@](=O)c1ccccc1 1790598095 ZFWVBHVQIMVVPH-JOIMRNKESA-N 484.383 0.156 50 20 JCGD COc1ccccc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790951436 LHLTVQFJODQMDL-LRQRDZAKSA-N 467.526 0.530 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C[C@@H]21 1791253936 JCERTTIUGYOXJI-OWLYRPNTSA-N 462.934 0.850 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C(=O)NCc3ccco3)C[C@@H]21 1791255603 WVWPQPASGQPIBS-ZCTXCFBYSA-N 453.923 0.686 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)n1 1791288621 MLICMIDLNPSRTR-BQFCYCMXSA-N 460.535 0.006 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1792536775 YWAFPAXRULKNLD-BAAGSCJXSA-N 476.486 0.638 50 20 JCGD C[C@@H]1[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CCN1C(=O)OC(C)(C)C 1792983555 OSVKKXYROBGGLO-IFTGGNMHSA-N 459.971 0.821 50 20 JCGD CCOC(=O)/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793881063 MRWXIQRVDKAWCS-DZDOSFCXSA-N 473.954 0.827 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCC3CC3)cc1)C2)c1ccc(B(O)O)cc1 1795736786 GNDKNAASIBRYGI-JHDGKUDLSA-N 464.327 0.672 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccoc1C(F)(F)F)C2)c1cccc(B(O)O)c1 1795738878 KZQFKWURSAWKSM-YWVIFJGQSA-N 452.194 0.495 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)C2)c1cccc(B(O)O)c1 1795739227 SWHWJWDWMDJIII-USGNIVHTSA-N 469.253 0.643 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(n1)OCCO2 1796282420 RBHKXOHYQZERPD-RVQRMFQJSA-N 482.497 0.190 50 20 JCGD Cc1nc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)ccc2s1 1797030370 BQCAFUFUJCIWRN-UPHUGPLXSA-N 465.340 0.802 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@H](F)CN1C(=O)OC(C)(C)C 1797117795 ALZKJUWAKWPUAS-QOSLBHJFSA-N 499.584 0.297 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Nc1cnccn1 1797775947 CZDLJIVMBJTQDY-ONHZYDQLSA-N 468.518 0.001 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1798265404 FKCWBAXEDUBTTQ-ZYKCCNLVSA-N 478.458 0.836 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(-c2ccccc2)n1 1798699425 VEUMCTVMMGOSRY-VPTLXERWSA-N 475.509 0.388 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2 1800978345 AZZAYENWDVESML-OCVGTWLNSA-N 465.894 0.136 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)CC1 1804121160 DLPPSXHEWNIZRV-BJWYYQGGSA-N 472.546 0.805 50 20 JCGD C[C@](O)(C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(F)(F)F 1807360736 CWOBKQIWROARBU-KNBMTAEXSA-N 465.237 0.394 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1 1807375247 NOJNHLBIAAKEOC-UGKGYDQZSA-N 460.299 0.798 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H](CNC(=O)Cn2cnnn2)[C@@H]1c1cccnc1 1807608489 LNJVSOLKRCAFME-RYRKJORJSA-N 492.968 0.906 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1[nH]nc2ccncc12 1808099831 OLYLCGYHSTTZQG-JTSKRJEESA-N 470.298 0.666 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1811068631 SONAKPUQKVRVKX-CVDCTZTESA-N 473.342 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cn2cccc([N+](=O)[O-])c2=O)[C@H]1c1cccnc1 1813073572 JSBQOFMHFQMDOL-VGSWGCGISA-N 499.528 0.231 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1 1813351026 LZFXYVJVXLTWBL-DNVCBOLYSA-N 460.564 0.371 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)C1 1814861101 HDJFRNAVWIXSEE-GPMSIDNRSA-N 468.319 0.985 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3c1OCCC3)CC2)c1cccc(B(O)O)c1 1815360644 WELTWDCTQJOOTM-AWEZNQCLSA-N 467.316 0.342 50 20 JCGD O=C(/C=C\C(=O)NC1CC1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819270411 JBIMKSHCRPICGF-LENZSSGSSA-N 451.292 0.230 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793643 QWPUFKXCGJOJGS-MNOVXSKESA-N 480.572 0.048 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)N1CCOCC1)CC2)[C@@H](F)Br 1823007259 LLBTTWHCUUGSPF-XPLICSAQSA-N 451.318 0.396 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](COC(C)=O)OC(C)=O)CC2 1826000585 WZMADWPLEARVLG-MBNYWOFBSA-N 461.924 0.804 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCNC2=N)CC1 1826870487 CLFGHKRTGXKRID-FQNOVECQSA-N 470.578 0.580 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1827561182 BVRJZBALPPIBAR-ROUUACIJSA-N 459.551 0.365 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)no1 1828924239 LYSAZMNBIKYIQY-HXUWFJFHSA-N 497.556 0.645 50 20 JCGD CNc1nsnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1829755878 OOXWURPUUBIQIY-YGRLFVJLSA-N 452.306 0.340 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2 1829840150 NEMYFMQXFFIXQH-XMMPIXPASA-N 479.537 0.487 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1 1830538521 IECFDJGMBVQNHZ-ORAYPTAESA-N 487.351 0.799 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725545 JLWOWOWPQHCYNI-KSSFIOAISA-N 465.856 0.699 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737601 FZVMPHDFVBBNLA-YWFTZVROSA-N 453.879 0.664 50 20 JCGD COC[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831620774 LKWVEDFVAOZGMC-CKJXQJPGSA-N 477.986 0.857 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1831656695 HRSLYDRPICEMKW-MGPUTAFESA-N 470.910 0.620 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1831999102 PRZXMBMLMQJWHP-MRUHUIDDSA-N 475.970 0.512 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551302 IEXMRWCKKTWIOZ-HOIFWPIMSA-N 491.029 0.915 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1832760262 GKDACLOIHVLYOS-YLJYHZDGSA-N 455.870 0.975 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc(C)c(C)[nH]c3=O)CCO2)C1 1833390033 IRZDLBPLNUEFQM-KUHUBIRLSA-N 471.352 0.630 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1sc(C)nc1C)CCO2 1834074248 QICZRMYATFSNQC-BHSKHCGUSA-N 488.570 0.964 50 20 JCGD Cc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1835039887 YIORUGJPUHLXSU-DEOSSOPVSA-N 467.526 0.306 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ccncn3)CC2)CC1 1835117850 RNOMZKCKWJEZHX-LQKURTRISA-N 466.546 0.796 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2)C1 1835212523 ABDYYKHIBLILQJ-QRWLVFNGSA-N 463.959 0.564 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCOCC3)CCO2)C1 1835420030 UMMDGOUEIQFKRE-QADUPLGGSA-N 475.546 0.394 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1n[nH]c2c(F)cccc12 1835596993 JIGMIEVHPGWSHM-UHFFFAOYSA-N 493.348 0.881 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835712931 LSVXRODZWVVSFF-OAQYLSRUSA-N 457.380 0.125 50 20 JCGD CC1(C)Cc2cccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2O1 1835928445 QRMORKBDEZDOGD-AREMUKBSSA-N 494.353 0.464 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@]3(F)CCCC=C3F)C2)C1 1835940862 CCEUOQMAUUFNGB-VXKWHMMOSA-N 464.274 0.182 50 20 JCGD Cc1cnc2c(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)cnn2c1 1836949227 DRJUDAMLKHHNKB-KBXCAEBGSA-N 470.299 0.798 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3ncnn3C)CC2)CC1 1837370021 TYHIRMCVELUMLY-CVKSISIWSA-N 470.534 0.561 50 20 JCGD NC(=O)[C@@H](N)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1837882333 XHFYTLCTLLSMFT-ZFWWWQNUSA-N 451.337 0.268 50 20 JCGD Cc1nnc(CC(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)o1 1837939843 DAMWEDTUMCSFTC-UHFFFAOYSA-N 471.518 0.231 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838394727 QPVBMLCFSNRRJE-HNNXBMFYSA-N 491.545 0.859 50 20 JCGD O=C(c1cc(Br)ccc1O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838889979 VADDNGCDYNPHID-MAUKXSAKSA-N 477.739 0.824 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3cccc(Cl)c31)CCO2 1839740745 SKPLQHONNKUWAL-NBGIEHNGSA-N 498.772 0.820 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(C)c3C(F)(F)F)C2)C1 1840150823 QZJBRJBEZIZEHP-CXAGYDPISA-N 468.860 0.763 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc(OC)c3OC)C2)C1 1840154188 OQYWELNIEKHOLM-XOBRGWDASA-N 457.911 0.423 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3(c4ccc(F)cc4)CC3)C2)C1 1840182776 UDVBGNMPRGLHOS-HSZRJFAPSA-N 476.549 0.687 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3Cl)C2)C1 1840184893 CAGJPNLESIZLCP-NRFANRHFSA-N 452.939 0.783 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(O)c3)C2)C1 1840185056 KPTRMNYQRSQFSH-QHCPKHFHSA-N 462.547 0.154 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C(=O)OC)cc3)CCO2)C1 1840279682 WOLHTEOMPUVDJA-GCJKJVERSA-N 468.934 0.726 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840298607 ZCIISTSIKQZLTA-CLOONOSVSA-N 466.343 0.315 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CN1CCN(C)CC1)C2 1844692652 UYSBTRPCFQKABD-UHFFFAOYSA-N 459.503 0.585 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c2ccccc2c1=O 3550622 WUWXAJCTRJKUJG-UHFFFAOYSA-N 455.496 0.793 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1 17059989 SXCDROVHPKVMPF-UHFFFAOYSA-N 492.554 0.925 50 20 JCGD O=C(NNC(=O)c1n[nH]c(=O)c2ccccc12)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12 17849440 ZESHASBUUPAKDG-UHFFFAOYSA-N 470.492 0.609 50 20 JCGD NC(=O)NCCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 726230445 OBBSKHRIEANKPR-UHFFFAOYSA-N 488.570 0.013 50 20 JCGD CN(C)C(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 728176667 KKPRBUUKOIAJRI-UHFFFAOYSA-N 460.512 0.484 50 20 JCGD COc1cc(OC)cc(C(=O)Nc2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c(O)c2)c1 728203201 HZOYTINOYDCUHQ-GFCCVEGCSA-N 477.495 0.857 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)cc1OC 728204224 ZBQMCEDQEPIQKD-OAHLLOKOSA-N 465.532 0.906 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)/C(=C\c1cccs1)n1nnnc1-c1ccccc1 728381253 VMWWCFUYPRWQHO-LUYJPIOASA-N 458.525 0.982 50 20 JCGD CN1CCC(CCNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 728752501 NYWJZMVJQNGOPD-UHFFFAOYSA-N 481.619 0.702 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 729049697 AFJIIDJKBRCCSO-UHFFFAOYSA-N 476.582 0.576 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCS(=O)(=O)N2CCSCC2)cc1 730672552 GLLRXULAPXYMDO-CQSZACIVSA-N 460.578 0.562 50 20 JCGD COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)NNC(=O)C(=O)N1CCCC1 748246677 NXVITASJLZXDAB-UHFFFAOYSA-N 472.523 0.830 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 789841646 ILVMMAUAXJVPKJ-UHFFFAOYSA-N 464.818 0.991 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1 789852753 CWBPMMRLBZLVJY-UHFFFAOYSA-N 457.468 0.520 50 20 JCGD CCOc1ccc(S(=O)(=O)NCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1OCC 798114543 RGBCPWJXQSYRCV-CQSZACIVSA-N 463.578 0.255 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1 822647530 QNGFZMOFMBWUHO-SNVBAGLBSA-N 481.394 0.583 50 20 JCGD Cn1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cc1C(=O)O 912979480 YBEZIGVUMVWQSC-UHFFFAOYSA-N 492.535 0.825 50 20 JCGD CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc(C(C)C)nc21 914280407 NGAWSLOIHKQTAI-UHFFFAOYSA-N 477.481 0.962 50 20 JCGD Cn1c(=O)n(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c(=O)c2ccc(C(F)(F)F)nc21 915795165 ZKLIJAMWKYFDEB-UHFFFAOYSA-N 466.332 0.483 50 20 JCGD Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)C(F)(F)F 916378245 KPIADDWFKKHPNZ-INIZCTEOSA-N 453.385 0.180 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1OC 916655516 DNGPBAHJQRPCRF-UHFFFAOYSA-N 478.527 0.775 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1778237935 PEMDIPDIQPDPAL-MHECFPHRSA-N 487.362 0.067 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1 1778238110 QBHOAEOMSWHQNR-MHECFPHRSA-N 487.362 0.067 50 20 JCGD COc1ccc2c(CC(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c[nH]c2c1 1779029768 YOTSPGMGYBUISF-VWLOTQADSA-N 492.536 0.861 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1779179438 FPWPSPGPAKGKIB-BNLOLNQZSA-N 458.288 0.115 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1 1779509224 XMGJCLGVIDTCPG-FQEVSTJZSA-N 463.221 0.538 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ncccc3Br)C2)C1 1779650068 RPBHFRXWLIHHCF-FQEVSTJZSA-N 474.120 0.281 50 20 JCGD COCCOCCOCCOCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1780797878 UNYAZODYHDNTNR-NNMXDRDESA-N 495.013 0.186 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968621 OQBLVWVTXFXDMG-CJFMBICVSA-N 487.601 0.736 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)Cc3cnn(C)c3)CCO2)C1)NC(=O)NCc1ccccc1 1780969694 PFKXBOOPPWTVQL-XMMPIXPASA-N 483.573 0.139 50 20 JCGD O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1781326974 VPEPTUOVYXCAPA-SBOFIZKASA-N 473.299 0.513 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781332475 ZHGMZWHZIOAOLN-PLQHRBFRSA-N 458.288 0.115 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1781342325 KYFKZCDLGLVEKJ-KPZWWZAWSA-N 454.351 0.896 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)OCCO3)C2 1782212080 SFPUNGCKFBADRW-HYBUGGRVSA-N 474.558 0.958 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1782864819 UVCFEUWZLNEBMH-KAAOTHNJSA-N 481.264 0.695 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(CNC(=O)OC(C)(C)C)CC3)[C@H]2C1 1783594770 PTKHBLQXZQITQZ-BZSNNMDCSA-N 495.621 0.644 50 20 JCGD CN1CCC(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CC1 1783654548 OGJGKBLPSPSPCQ-VDGAXYAQSA-N 458.563 0.010 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C)COC3)[C@H]2C1)NC(=O)NCc1ccccc1 1783671240 WDNUZJWFWAXHMY-UFYCRDLUSA-N 473.574 0.349 50 20 JCGD CN(C)c1cccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1785059098 UPODINDZPJTRPC-TZYHBYERSA-N 481.358 0.105 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1Cl 1786981862 CUGJPMARMKJKIR-MDKPJZGXSA-N 472.734 0.936 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc2nccnc2c1 1788027968 LYQLGUZENCKZAY-JLMWRMLUSA-N 460.299 0.217 50 20 JCGD COC(=O)C12CCC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)(CC1)CC2 1788214518 FYOJMRCIOHRVFP-URDWGJOXSA-N 498.385 0.473 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4[nH]ncc34)C[C@@H]21 1788610078 BNQLNQZDKAPUMG-GMVOTWDCSA-N 463.498 0.469 50 20 JCGD COc1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789465394 ZRPYLNGDAMVPKO-DCPHZVHLSA-N 453.499 0.601 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnoc3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726608 DNYOSPVCZDRGEG-IHPCNDPISA-N 470.530 0.614 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(F)cc([N+](=O)[O-])c1 1790132487 XAQPBIYCPHYWJP-GKCIPKSASA-N 471.250 0.321 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1Cl 1792010595 AXFTYIMZZFVAKJ-MDKPJZGXSA-N 472.734 0.936 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)[C@H]2C1 1792984068 RUWDFQFQQJUICP-LSIGDULCSA-N 487.981 0.058 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN(Cc2ccccc2)C1 1793754336 VDRKFARHMQDEJS-ILSIFQBBSA-N 485.629 0.861 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)C1 1795115000 WJNYMYFHZDQWDD-SVZOTFJBSA-N 490.395 0.589 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)ccc3c1OCO3)C2)c1cccc(B(O)O)c1 1795739230 UPEHWPBIWRZWGC-HBCWATKFSA-N 472.690 0.266 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cncc(C(F)(F)F)c1)C2)c1cccc(B(O)O)c1 1795740960 SMTTUNDNLMACGN-UPHUGPLXSA-N 491.275 0.616 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)ccc1O 1796441437 JAAQZUJRXKJCNZ-GSBKIRKESA-N 469.498 0.738 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2[nH]1 1797458643 ASIKANFVASWRCN-UMNWKFCPSA-N 463.498 0.900 50 20 JCGD C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1799232909 IMJMEEAUMWYYLY-MDMSPXHWSA-N 471.982 0.873 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)C2 1801011704 WAJJVXCHSZBBDV-YCVZEPRFSA-N 458.584 0.837 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803140022 XXHQLXJAAIQYIR-FHOLKWQSSA-N 460.922 0.821 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1 1803745043 RYPNQVHVDCKTPP-LIRRHRJNSA-N 462.470 0.209 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808418140 ZVNJPWSGHZSRQN-HHFZMZSRSA-N 496.572 0.929 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2c(c1)CNC2=O 1810038040 WRFWAXDEHKUBNA-WMZHIEFXSA-N 484.321 0.638 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnn2c1OCCC2 1812117435 IWUBVYGMOURCBB-RXVVDRJESA-N 475.314 0.374 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1812812360 TUTPZQDWKPCVRB-JXFKEZNVSA-N 497.556 0.924 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@@H](N)Cc2cscn2)[C@@H]1c1cccnc1 1813070053 FWZXOVBXZSIRDJ-PLMTUMEDSA-N 473.603 0.487 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1 1814877875 NBGAIMFGTSURIV-BZUAXINKSA-N 451.915 0.472 50 20 JCGD N[C@@H](CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1cccnc1 1815172440 LFNJCMBLRQMAJB-SJORKVTESA-N 465.344 0.534 50 20 JCGD Cc1cc(NC(=O)CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)no1 1815340055 CUPHVRZWFAKTHV-AWEZNQCLSA-N 483.315 0.374 50 20 JCGD C[C@](O)(C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(F)(F)F 1815350344 ROHBEDUXIAEPKF-DIFFPNOSSA-N 457.239 0.362 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350435 VUPYQBWDARYHIX-AWEZNQCLSA-N 459.333 0.781 50 20 JCGD O=C(CC(F)(F)C(=O)O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1817092162 YBZOGVQVZWYZDX-NSHDSACASA-N 453.232 0.159 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])[nH]n1)c1ccc(B(O)O)cc1 1817472310 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)C=CC2=O)CC1 1827679656 NIVGFIQAVUFPJV-DZTFFZQKSA-N 482.541 0.665 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828524967 IZCCSMOCDPRJHZ-NHCUHLMSSA-N 488.368 0.986 50 20 JCGD CCNC(=S)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924386 QJFPGZACAHQNCI-SFHVURJKSA-N 475.619 0.402 50 20 JCGD O=C(CCOc1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830254891 ZFNOCYSFRBLHEE-DEOSSOPVSA-N 486.305 0.045 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2)N1CCN(C)CC1 1830543289 PESGKAXPRGYEGW-ABSDTBQOSA-N 475.428 0.110 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830543916 HQORXMNCSDBHIG-CKJXQJPGSA-N 497.390 0.687 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)C(C)(C)C 1831090133 YWBMEAKBSAIWKD-WIYYLYMNSA-N 457.644 0.845 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1 1832209193 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O=C(NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1ccco1 1836128302 JAHCXXCHFMYCHK-PBHICJAKSA-N 462.272 0.156 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccnc(F)c3)CC2)CC1 1836971993 GFMLNQNNJLDQPJ-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837461392 VMPYXAPKPFMSFG-BXKMTCNYSA-N 482.541 0.029 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920756 BODGPGGEJJCPLE-SFHVURJKSA-N 481.358 0.841 50 20 JCGD O=C(C#CC1(O)CCCCC1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921205 LRIFZAUGRAYFMX-UHFFFAOYSA-N 482.386 0.677 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)c2n1 1838485850 BEDZWZADQHSTJP-YWZLYKJASA-N 452.895 0.241 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1838549153 CJKYGPHFECXOHU-YWZLYKJASA-N 460.886 0.513 50 20 JCGD CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)on1 1838779868 IGTOQZSYCPYTHL-OAQYLSRUSA-N 451.524 0.241 50 20 JCGD CCO/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054317 TVEBVOWMTJSKHD-XJCKULRNSA-N 489.573 0.339 50 20 JCGD O=C(c1cnn2ncccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198879 DSOZKYAMJDMLAQ-YOEHRIQHSA-N 456.272 0.490 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3ccnn3c1)CCO2 1839570119 UJMOGGQVCXVABT-VNSNFZHPSA-N 493.524 0.538 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839744005 KBDCJZOOYCEXMN-ORGVGYNBSA-N 491.495 0.775 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(F)(F)C(=O)O)C2)C1 1839964563 VTJOTGIQTDXACQ-NHYWBVRUSA-N 457.268 0.726 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](C)Br)CCO3)C2)cc1 1840030252 GUMFCGNXLQTQKJ-VHFSOBRXSA-N 471.348 0.968 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cc3)C2)C1 1840152796 UBXHDUDOUURHON-REWPJTCUSA-N 481.977 0.847 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCCc3ccccc3F)C2)C1 1840183086 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)/C=C(/C)C(=O)O)CCO2)C1 1780099189 YPADMPWJZBIPRX-NMIMRFFTSA-N 461.427 0.995 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)cc2NC1=O 1780175288 JEFQDPVNIJJLAE-LFPIHBKWSA-N 494.508 0.162 50 20 JCGD CC[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)NC(=O)OC(C)(C)C 1781357113 HRIIMFRSGFUFPL-CYFREDJKSA-N 489.378 0.503 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc([N+](=O)[O-])c1OC 1782119378 ZIDFRBZEQRINOT-LIRRHRJNSA-N 457.867 0.655 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782158483 CIFYJCSVBOKVJO-UPUUWEMXSA-N 484.358 0.249 50 20 JCGD O=C(Cc1cccc(OC(F)(F)F)c1)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1783011994 ZTXBLNXBLRFDRH-JOCHJYFZSA-N 492.259 0.951 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n1 1783533682 FGVQGBWTHZNZKN-AUUYWEPGSA-N 455.353 0.900 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)COCCOCCOCCOC)C2)C1 1783679432 IONOSKCUTARVDL-GHTZIAJQSA-N 464.987 0.920 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(O)O)[C@H]2C1 1783871566 QZSDDKOZHHCMGP-PPZVJCQGSA-N 464.316 0.646 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)COc1cccc(N(C)C)c1)CCO2 1783933362 IWLIZPKXYTXQBG-QHCPKHFHSA-N 461.563 0.334 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnn1-c1ccccc1)CCO2 1783935312 RXCNQKGESUHZRZ-QHCPKHFHSA-N 454.531 0.689 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCO)NC(=O)OC(C)(C)C)[C@H]2C1 1784197205 LJPRDJFLFVPDOO-KSWRQPAISA-N 477.986 0.496 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3c3ccc(F)cc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978711 MVKYSVNXMSOOLW-GEFFGTOZSA-N 466.318 0.903 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnccn3)C[C@@H]21 1787506945 UYRWRZYOKUKKGJ-YKNBRYRPSA-N 453.503 0.133 50 20 JCGD 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O=C(NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374890 KXMCCTCHVLNAKD-JXFKEZNVSA-N 463.259 0.631 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)Cn2nccn2)[C@H]1c1cccnc1 1808947096 KHUDUQHLSZFAEJ-PFWGCWTJSA-N 463.502 0.513 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1810120220 GARMAJOPPKWWHJ-CMUXQDGESA-N 451.593 0.619 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1810339188 MEDIKRKTNXIPRI-XWTMOSNGSA-N 455.895 0.182 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc(O)ccc1O 1811894555 HIGXDQZUQHJZMU-VGOFRKELSA-N 461.283 0.806 50 20 JCGD Cc1cccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815335725 MKUIDSYLFPEBIP-KRWDZBQOSA-N 450.329 0.995 50 20 JCGD C[C@@](O)(C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(F)(F)F 1815528379 UMIHQZZWVNPFLN-RDTXWAMCSA-N 454.214 0.709 50 20 JCGD Cc1nn(C)c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1F 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O=C(c1ncn(-c2cccc(F)c2)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833352043 KWSKIUIMTQHDNC-OXQOHEQNSA-N 467.885 0.076 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(N3CCOCC3)cn1)CCO2 1833615038 UZYBVTRYMLUDIF-OAQYLSRUSA-N 497.390 0.773 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1n[nH]c(C2CC2)c1F 1834021417 AQIWLQBSOIEWEM-UHFFFAOYSA-N 483.353 0.605 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccoc1C)CCO2 1834137739 GNIIUOIVNZBFKL-VCOZGABYSA-N 457.487 0.792 50 20 JCGD Cc1ccc(OCC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1834797878 HECSFXUNHUEMMS-UHFFFAOYSA-N 479.386 0.939 50 20 JCGD Cc1nc2ccccn2c1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798656 VRDZIKYEBAADNB-UHFFFAOYSA-N 489.385 0.822 50 20 JCGD O=C(/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2)NCc1ccco1 1834823388 RETXPIWUDWRDOR-YADGQWAMSA-N 484.347 0.693 50 20 JCGD CCOCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1834986387 YEEJYFYEDYAYGC-NRFANRHFSA-N 465.459 0.627 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccc(Cl)cc1 1835926656 WWHDTGCHCWOORH-OSPHWJPCSA-N 486.761 0.894 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3)C2)C1 1835939864 LHHKPJRPQMDKAD-TZBSWOFLSA-N 464.327 0.240 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nccc3occc13)CCO2 1836295157 CPWWQINXYQHQEL-QFIPXVFZSA-N 459.503 0.271 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(C(F)(F)F)o1 1836511227 SRGYDZZGGLVEMJ-BDJLRTHQSA-N 455.817 0.672 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1 1837460937 LSRQQRQFNRBEIH-QFIPXVFZSA-N 491.907 0.861 50 20 JCGD O=C(c1cc2n(n1)CCCO2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201367 VTBNUKLGUABFMO-RHSMWYFYSA-N 461.288 0.426 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3ccoc3c1)CCO2 1839535457 WTIWNJJAHMFXHS-XMMPIXPASA-N 464.283 0.496 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1 1839630697 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O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cn3cccc(Br)c3n2)C1 1845651215 RRUFBCNUQGTAKP-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(Cc2cccs2)C1 1848145415 IMDFOWKQWFYQSB-CCKFTAQKSA-N 482.566 0.611 50 20 JCGD C[S@@](=O)Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 11771589 QQSBOHBBBVQTDK-PMERELPUSA-N 465.553 0.661 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCN2C(=O)[C@H](C)Oc3ccccc32)cc1 17407120 BYIJCOVINLDYEA-INIZCTEOSA-N 474.539 0.967 50 20 JCGD Cc1nc2nc(N)nn2c(C)c1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 17516187 FLEDXIJLUUSWML-UHFFFAOYSA-N 472.531 0.112 50 20 JCGD CN(C)N(C(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1)[C@H]1CCS(=O)(=O)C1 24768119 BZHYLNFOOUPDDO-INIZCTEOSA-N 487.600 0.351 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1 726523733 VJWNUOAVOPCAHB-AWEZNQCLSA-N 465.532 0.016 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1csc(-c2ccc(Br)cc2)n1 728510396 IJYLNVYIEQOZMG-QMMMGPOBSA-N 483.391 0.820 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccnc2S(=O)(=O)C(F)(F)F)n1 728733818 QUQKHAUVTJQMDA-UHFFFAOYSA-N 466.419 0.687 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 729274806 DNZUYSNOLSWLAA-UONOGXRCSA-N 460.578 0.257 50 20 JCGD CCS(=O)(=O)NCCNC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1 747867415 XTEGEISVIMGXLL-FQEVSTJZSA-N 459.572 0.883 50 20 JCGD NS(=O)(=O)c1ccsc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 800027101 HZHOBPDMACWXBJ-UHFFFAOYSA-N 458.543 0.255 50 20 JCGD C/C=C/C=C\C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CCOC)n(Cc2ccccc2)c1=O 901414853 ALXMDUJIVCDBQU-TZOXPPMKSA-N 466.498 0.334 50 20 JCGD C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 912642864 BFBHVFUWWCSIHC-OLMNPRSZSA-N 476.555 0.796 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@@H]1CCN2CCC[C@H]2C1 916572913 GCQJWRCKOMJMLN-MOPGFXCFSA-N 479.603 0.597 50 20 JCGD C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1 918002103 QMWNMRABNHOFRR-HNNXBMFYSA-N 481.492 0.801 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)NCC(=O)N1CCN(C(=O)OC(C)(C)C)CC1 918002273 YDGBQZNXSKZGCW-UHFFFAOYSA-N 465.507 0.484 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1n[nH]c3c1CCC3)c(=O)n2Cc1ccccc1 918016453 IOVVZTOEKSEFRI-UHFFFAOYSA-N 476.497 0.101 50 20 JCGD Cc1sc(=O)n(CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1C 919805694 IGAHRVKNXVCGNQ-UHFFFAOYSA-N 482.584 0.328 50 20 JCGD Cc1c(F)ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1N 1779030712 GTEMGIUBAIDLNV-QFIPXVFZSA-N 456.478 0.472 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1779956613 YYRNCNIYCOZGKV-GTNSWQLSSA-N 455.334 0.983 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CS(C)(=O)=O)CCO2 1780095173 IKKGCHNZRIGIEF-SPLOXXLWSA-N 497.526 0.644 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ccc1C 1781909815 CMRPUKWOLAZYLW-DEOSSOPVSA-N 465.315 0.391 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc(-c4ccc(O)nn4)cc3)C2)C1 1782116544 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ncccc4n3)C[C@@H]21 1787508679 GKMUNQMDWBHBBA-BRZMCFHBSA-N 478.513 0.457 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1 1789872246 FJHAXFNHIXJVOJ-SVKXURNBSA-N 474.389 0.673 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC(=O)N3C)[C@H]2C1 1789942242 JEDMYZXUFONEHB-RNVRALISSA-N 488.497 0.734 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)nc3)C[C@@H]21 1791290956 FJRHMTFUMZGKKX-FHWLQOOXSA-N 469.546 0.234 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(Br)ccc3n1)C2)[C@H](O)CCl 1792981272 IJJREUKYTZNZKY-YHYOWMERSA-N 471.739 0.900 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C 1793254952 MIFVORAUFLQGBC-DFGXFYAUSA-N 479.578 0.576 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(Cl)c1 1793864142 BPGLHMSWOJVHFA-FAQVEIGNSA-N 472.734 0.474 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ccccc13)C2)c1cccc(B(O)O)c1 1795738839 IDXZDBSHMNXPQR-NHKMSHSESA-N 461.327 0.684 50 20 JCGD O=C(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)Nc1ccc(F)cc1 1796188496 NLUKRXABJSYZKF-ACDBMABISA-N 453.279 0.786 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2cnccc12 1797473027 UHBYZQIXWCHDLV-VPTLXERWSA-N 460.494 0.750 50 20 JCGD N#Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797748266 NZVUKZXODZJILX-OPMZPASUSA-N 462.510 0.393 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc3c1CCCO3)C2 1797750797 TWDKDSJDJSQOJN-IVWMJMPLSA-N 471.539 0.589 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)nc1 1797753208 XOTJANWXDZWUMI-CWPLJXCYSA-N 482.541 0.449 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2c(nc1=O)SCC2 1799074428 LCHAGJLQYHQYBQ-IKVITTDRSA-N 471.377 0.265 50 20 JCGD COc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1OC 1799663177 WNVFRPFVTOUSJQ-VTEUUUEMSA-N 466.510 0.419 50 20 JCGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)cn2[nH]cnc(=O)c12 1800760147 DDCWAVMPTIHVHR-FMSGJZPZSA-N 452.309 0.318 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1800808025 OVGXWQPDKVGITO-XHJNMGKDSA-N 466.362 0.750 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1801138980 GWWZRKXAGMBHHN-UJHHCITNSA-N 459.971 0.823 50 20 JCGD C#CCO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803547982 GADAWXCINFJYNG-MDYRTPRTSA-N 450.499 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnnc(Cl)c1 1804723445 XMGLXHQQEJRMPH-JXFKEZNVSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374095 IFOJEFMNTBWDBB-PWZKMPOXSA-N 451.332 0.632 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1808306763 NXWRXXBBNJFOSX-XLSPSMHOSA-N 459.374 0.974 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1 1808417510 ZTHVIIIGCSRURY-XNQORMJESA-N 477.529 0.903 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1810297743 DBJFSPNHUFUXOE-IIBYNOLFSA-N 490.524 0.902 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1 1810303641 UFPMNVVLXQFQHE-OXQOHEQNSA-N 485.508 0.756 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813074622 UPMPUMGZOBZKDO-PLMTUMEDSA-N 456.551 0.388 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813408048 UOOLGPRBKXKKPF-WGGBDISSSA-N 474.326 0.944 50 20 JCGD Cc1cc2nnc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)c(C)n2n1 1815340795 OVYKMRMIIZSPBA-OAHLLOKOSA-N 491.342 0.417 50 20 JCGD Cn1ncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1Cl 1815361044 SKXMYHRVTKBWEC-GFCCVEGCSA-N 459.724 0.749 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3c(n1)OCCO3)CC2 1819796782 FZWOGAFOJFPRNM-LLVKDONJSA-N 495.521 0.847 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc(=O)nc4sccn34)sc2C1)c1ccc(B(O)O)cc1 1821153332 PYKCNXSZECQVDC-ZDUSSCGKSA-N 495.351 0.432 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nc2ccc(F)cn2n1 1821597307 RRYFXEJHQMRKDY-QGZVFWFLSA-N 477.265 0.891 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cccc(B(O)O)c1 1823002174 AOADXGSWCOFDNW-ZWNOBZJWSA-N 456.102 0.739 50 20 JCGD CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN(C)C(=O)C(=O)O)sc2C1 1824677441 SCVHXHLKCZMMLY-DTWKUNHWSA-N 461.338 0.772 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1830539260 FVQRJAXSDYGIKP-ZSEKCTLFSA-N 494.342 0.922 50 20 JCGD Nc1nc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2s1 1830723553 PNNRPLCWQLSXIL-IFXJQAMLSA-N 454.936 0.548 50 20 JCGD Cn1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1C(F)(F)F 1830724999 KTVDTNDFQBROLP-MLGOLLRUSA-N 454.833 0.109 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830734039 ZSLSVYDPEWDGNY-GEQKSPFYSA-N 497.976 0.605 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832880176 AONHTRCRUMALIH-FOIQADDNSA-N 485.379 0.765 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)CCO2)C1 1833024283 INJHEMDCIZQHDV-JLCFBVMHSA-N 482.965 0.714 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3n[nH]c(C4CC4)c3F)CC2)CC1 1834021744 LCGKHZNBFXIEGZ-UHFFFAOYSA-N 498.563 0.924 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1 1834821450 LAUJNHAAPSRWJG-RXVVDRJESA-N 466.376 0.942 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C(F)(F)Cl)CC2)CC1 1835738284 SCMLBUQWEUWPSE-UHFFFAOYSA-N 458.897 0.702 50 20 JCGD O=C(c1ccc(Cl)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939308 LVPCPAACSIUCKL-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3ncncc3c1)CCO2 1837028101 ZKZFOIGDRIEALE-QHCPKHFHSA-N 470.530 0.073 50 20 JCGD Cc1ccc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461264 RVMBKPXLBODFDM-DEOSSOPVSA-N 467.526 0.686 50 20 JCGD N[C@H](CC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccnc1 1837896698 QAMKZDVWFFSZMW-HSZRJFAPSA-N 480.374 0.464 50 20 JCGD Cc1ccnc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1837919261 AAUJMIRIWLONIN-UHFFFAOYSA-N 451.332 0.996 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc4nncn4c3)CC2)CC1 1837920440 ZCFSJMYFCYMWAT-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CSc3ncccn3)CC2)CC1 1837960386 UEWUHTGHTUUICC-UHFFFAOYSA-N 499.597 0.880 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)CCS(C)(=O)=O)CC2)CC1 1838102965 ILIYAVAEPRYPMK-LFVJCYFKSA-N 495.602 0.554 50 20 JCGD O=C1CC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)=Cc2ccccc2N1 1838443269 GXEZIGXLWZICTJ-XMSQKQJNSA-N 463.918 0.468 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(Cl)c3)CCO2)C1 1838918614 IIXSAHIUZBTIJR-JOCHJYFZSA-N 473.917 0.722 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1838934626 DOVMEHNZUUHBDA-QHCPKHFHSA-N 478.546 0.147 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839184120 UWKUDQJLPVVSTE-LTMIRXACSA-N 497.976 0.605 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(OC(F)F)cc1)CCO2 1839330517 BNBOVSORCAVYLY-QHCPKHFHSA-N 490.268 0.352 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc([N+](=O)[O-])c1OC 1839470451 PMWPOEIVZIFSBQ-QRWLVFNGSA-N 487.893 0.282 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)C1 1840151176 XAZBGSBKLGUTPX-XMSQKQJNSA-N 482.965 0.242 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC4CCOCC4)n3)C2)C1 1840154379 VRSTXWQZXAMPME-MBSDFSHPSA-N 497.976 0.963 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ccncc3)C2)C1 1840182526 LRNYLSIMWMKAJA-NRFANRHFSA-N 465.576 0.003 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1840381310 VNIWXZGJLGODHS-HZPDHXFCSA-N 452.364 0.590 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCN2C(=O)C=CC2=O)C1 1841756843 MZBVGWQRFLBFJT-UHFFFAOYSA-N 470.438 0.652 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCNC(=O)c2ccc[nH]2)C1)NC(=O)NCc1ccccc1 1842016002 ODNUEIYOQQLPBP-UHFFFAOYSA-N 495.584 0.684 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844264270 ADOJERDTFVSVGV-UHFFFAOYSA-N 472.546 0.759 50 20 JCGD C[C@H](C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1)N1C[C@H]2C[C@@H]2C1 1845038915 IOBCVKQXDWRBBA-HMXCVIKNSA-N 468.602 0.876 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846189023 AKILFLCNNPNENQ-BXKMTCNYSA-N 469.347 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 1847715639 CTFICCXHDXVNSR-AABGKKOBSA-N 455.559 0.610 50 20 JCGD COc1cccc2c1OC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)C2 728398834 JMAABUGLXLXELC-QGZVFWFLSA-N 490.538 0.664 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 728846037 UIXQDYGLULMUIP-UHFFFAOYSA-N 492.533 0.314 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCS(=O)(=O)CC2)cc1 729369034 OYQSBHNCIKHYBC-VBKFSLOCSA-N 457.512 0.598 50 20 JCGD Cc1ncsc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 729508885 OVZLBOUHRBBDDF-UHFFFAOYSA-N 454.490 0.721 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNS(=O)(=O)c1cncc(F)c1 749155182 VFICRQZPLQDLSZ-UHFFFAOYSA-N 472.520 0.184 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)ccc1Cl 751393232 SPVLDGRLHCQSPP-UHFFFAOYSA-N 472.932 0.602 50 20 JCGD COc1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1S(=O)(=O)N1CCCC1 752862871 ZJEAVJLVIASCCK-UHFFFAOYSA-N 496.567 0.792 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc2c(c1)NC(=O)CO2 818788809 SWKSAFRFKJZSRL-UHFFFAOYSA-N 453.502 0.242 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)c2ccccc2c1=O 862111491 ROLRQLPLSSYODV-UHFFFAOYSA-N 491.508 0.607 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)CN2CCN(CC)C(=O)C2=O)c2ccccc2c1=O 915357404 DWOGIYDGUCJLOQ-UHFFFAOYSA-N 456.503 0.038 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC[C@H]1C[C@H]1C)N(S(C)(=O)=O)CC2 916640832 TTYHCAJCGPMCIY-XPKDYRNWSA-N 454.549 0.939 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cccc(OC)c2O)cc1OC 919756703 IIFYNVKKNNSCSG-UHFFFAOYSA-N 453.473 0.548 50 20 JCGD CC(=O)N1CCc2cc(Br)c(S(=O)(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc21 919961140 UOWOWPPMBNWZBQ-NSHDSACASA-N 495.377 0.038 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778057396 XZCVLFBZLPLCHP-YUNKPMOVSA-N 489.330 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2 1779029734 XVQFDVMZEATASY-MHJFOBGBSA-N 467.448 0.861 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779299492 AJRDKSCECBYVIG-QFIPXVFZSA-N 490.670 0.754 50 20 JCGD CC(C)(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)[nH]n1 1779726997 GKFKFOZVERJFFP-HYBUGGRVSA-N 468.363 0.828 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1780158251 WQKQHTPRRQGBKY-DYESRHJHSA-N 454.907 0.533 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc[n+]([O-])c1)CCO2)NC(=O)NCc1ccccc1 1780970483 YUWGYVVYKPUGBY-XMMPIXPASA-N 482.541 0.110 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1 1781555063 PAEAGMVAKBNOHR-FQEVSTJZSA-N 451.455 0.550 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4ccc(O)nn4)cc3)C2)C1 1782117690 QWLFJQIVHZQBIX-DEOSSOPVSA-N 482.541 0.666 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)Cn3ccncc3=O)CCO2)C1 1782866952 MIPCFNSSGFAWQS-VAPFXODJSA-N 469.448 0.959 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCN(Cc3ccccn3)CC1)CCO2 1783935674 BSAMTZXEVGBYIT-RUZDIDTESA-N 486.617 0.497 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785132885 DDWDUMUAPWTOQZ-JOCHJYFZSA-N 458.707 0.786 50 20 JCGD CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cc4n(n3)CCNC4=O)cc2)CCC1 1787572621 HFHILXDJPWSYAN-UHFFFAOYSA-N 467.530 0.747 50 20 JCGD CC(=O)N1CCN(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)CC1 1789214611 GZYZFOCISSNNEV-UHFFFAOYSA-N 493.568 0.597 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1789927758 CGUJXDAAOXLFLZ-YTFOTSKYSA-N 451.923 0.776 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)C(F)(F)F)C[C@@H]21 1790963750 LFMVIVUGCNSVPD-YFKTTZPYSA-N 458.275 0.818 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(C(F)(F)F)n3)C[C@@H]21 1791288077 VFDOAVCROAJRTC-XIRDDKMYSA-N 485.507 0.996 50 20 JCGD COC(=O)N[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)c1ccccc1 1792903969 YDJYHCRHHAXXFM-PLACYPQZSA-N 465.315 0.716 50 20 JCGD 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O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(OCC2CC2)c(F)c1 1801893698 JPWHHMOOOLGLPD-BBIADKPPSA-N 482.317 0.811 50 20 JCGD C[C@](O)(C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(F)(F)F 1803991302 YDTGTVPDRHQRQN-VPWXQRGCSA-N 465.237 0.394 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362251 LBUVOKHOGOFOOZ-GHTZIAJQSA-N 470.298 0.438 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1807369664 RKJCTKDZTDXBSW-OFNKIYASSA-N 461.331 0.595 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1 1810302040 FCONBUWZDILZMS-DYVFJYSZSA-N 450.459 0.142 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1 1810302951 ONIHMOWMVAFQKW-HRAATJIYSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2[C@H]3COC[C@H]32)[C@@H]1c1cccnc1 1810309584 SEQNFKAHFYGDCN-IGGMLHCZSA-N 450.499 0.292 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1812865110 UVIZZBYNVLDFSZ-FDQGKXFDSA-N 460.137 0.864 50 20 JCGD CN(C)c1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815344203 NWXXNTRINRWJKO-MRXNPFEDSA-N 465.344 0.824 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)CN)sc2C1 1817064181 ULBGVHOKTACDNS-SCVCMEIPSA-N 460.988 0.473 50 20 JCGD COC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2 1820192889 USUQETUWYYPGBA-UBHAPETDSA-N 451.318 0.897 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2 1822478754 RCNVPBGGJCHQGK-PWSUYJOCSA-N 469.976 0.560 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826088380 XHANSMRRAWWPJY-CHWSQXEVSA-N 452.581 0.733 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1827971945 PTCWBNBAVLEWES-OAHLLOKOSA-N 488.375 0.964 50 20 JCGD CCNC(=S)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1831091840 ODOVMJBZQVDNBB-GOSISDBHSA-N 475.619 0.402 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1831110867 MXBDZHVKXNZCRA-FDDCHVKYSA-N 492.385 0.813 50 20 JCGD COc1nn(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1833860955 PLOIYXPVDQZNNP-FZKQIMNGSA-N 459.341 0.530 50 20 JCGD Cn1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)n1 1833883895 UKRUFKCJSLLOKR-AGBQBWRISA-N 472.452 0.770 50 20 JCGD CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)no1 1834500531 LZHOIOSSPCRIFN-OAQYLSRUSA-N 451.524 0.241 50 20 JCGD O=C(CCN1CCOCC1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1834638516 PKZNBKWVUVJPOL-GOSISDBHSA-N 463.392 0.971 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CS[C@H]3CCCCO3)CC2)CC1)c1ccc(B(O)O)cc1 1834798670 WKYFOEJODXLELI-QHCPKHFHSA-N 489.447 0.811 50 20 JCGD COc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1835921617 JLYASXOMMLZEDP-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1 1835930649 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1837919327 GUQMMJYSCOTHFL-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc[nH]n3)C2)C1 1838528315 QJUDRBPDBCVZQH-QFIPXVFZSA-N 487.469 0.556 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccc(OC)c3OC)CCO2)C1 1838841886 UTJQGRYCNPMSSL-XOBRGWDASA-N 457.911 0.423 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1839881100 LLGJXENETYZLPU-ZWDAVXSWSA-N 496.402 0.974 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1 1840033724 NZQMXZZDPCJZQR-OXJNMPFZSA-N 457.365 0.925 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc(C)c1O 1840674683 AQZAXUZKVRWWBV-XMMPIXPASA-N 468.315 0.073 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841354370 VTEDXRTYGSMJFW-KBPBESRZSA-N 481.999 0.118 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)CCC#N)C2 1843428564 AWBNOEBDQYIWRQ-IBGZPJMESA-N 484.362 0.309 50 20 JCGD O=C1NC(=O)[C@@H](CC(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)N1 1845940288 GZHVDVDXDSNTFY-HUUCEWRRSA-N 463.332 0.794 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)[C@@H]2C1 1846133506 NYERPPUJOTZGMY-BCDXTJNWSA-N 484.557 0.615 50 20 JCGD O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 1846905375 CRTMSTXFRMXLSO-QGZVFWFLSA-N 471.963 0.124 50 20 JCGD O=C(O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 13059075 JEBCDYUDBLDUMT-UHFFFAOYSA-N 453.498 0.793 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)c2ccccc2c1=O 17190893 XGBZBVLAPYQRNW-MRXNPFEDSA-N 499.549 0.949 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)CNC(=O)c2cccs2)ccc1OC(F)F 725902938 YLGQGUGHMYNVGC-UHFFFAOYSA-N 456.427 0.665 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC(=O)N(C)CCc1ccccn1 727474103 YHGHQGBVLRMQEG-UHFFFAOYSA-N 461.548 0.328 50 20 JCGD CCS(=O)(=O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1 727943516 MNZZVKRJYGIVKN-UHFFFAOYSA-N 484.556 0.875 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(Br)cc1F 728503545 VBFDLXDXKAPRTD-UHFFFAOYSA-N 499.278 0.974 50 20 JCGD CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)[C@@H]1c1ccc(OC)cc1 729276108 XDCFBOJFTDWEGS-FNHZYXHNSA-N 468.576 0.860 50 20 JCGD C[C@H](NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)[C@@H](C)N1CCOCC1 729624146 SQZVQQDVXIATJM-ZWKOTPCHSA-N 497.618 0.080 50 20 JCGD C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 912860934 NSSRFNOYBLWKTB-ZDUSSCGKSA-N 467.475 0.880 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)c1 915164977 UVKCGXXESANFCZ-UHFFFAOYSA-N 485.515 0.325 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CN1CCCCCCC1=O 915808412 PDATXRBVZLCQIM-UHFFFAOYSA-N 480.587 0.580 50 20 JCGD COc1ccc([C@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)N2CCOCC2)cc1 915896601 HQLFSOHCXXSAKR-FQEVSTJZSA-N 480.525 0.960 50 20 JCGD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1csc(N2CCOCC2)n1 916136074 GLHDICRWHHWBCA-UHFFFAOYSA-N 464.895 0.692 50 20 JCGD COc1cc(C=NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OCC(=O)N1CCOCC1 916349627 GNXYAUGUUQCCEF-UHFFFAOYSA-N 465.470 0.672 50 20 JCGD COCCn1c(C)cc(/C=C(/C#N)C(=O)OCCn2cnc3c2c(=O)n(C)c(=O)n3C)c1C 916418691 JVDNDQSGVMZFFM-BOPFTXTBSA-N 454.487 0.649 50 20 JCGD CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 916485930 NJPWRMNKGFLSAY-UHFFFAOYSA-N 495.583 0.523 50 20 JCGD CN(Cc1ccccc1)C(=O)N1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1 918779546 YWUBZNVQWXUCHU-UHFFFAOYSA-N 463.502 0.886 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cc2c(=O)n(C)c(=O)n(C)c2n1C 919690023 HHKKMIVCNSOBSJ-SNVBAGLBSA-N 478.303 0.567 50 20 JCGD O=C(NCC1CC1)NNC(=O)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1 920862102 MELQLPOQLXRUMT-UHFFFAOYSA-N 461.338 0.824 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NC[C@@H]1CCOC1)N(S(C)(=O)=O)CC2 1319045937 CIFKHJXXMSTWET-XJKSGUPXSA-N 470.548 0.320 50 20 JCGD CS(=O)(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 1320276265 WLDDCZFCUDJCJO-UHFFFAOYSA-N 464.522 0.146 50 20 JCGD C[C@H]1CCCN(C(=O)CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1 1351923135 BKPLOFNFAQJTTI-INIZCTEOSA-N 467.596 0.292 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](N)c1ccccn1)C2 1778090972 AIYCSKGVIGBLNS-LVVLJIKYSA-N 481.557 0.729 50 20 JCGD Cn1c(=O)n(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)c2ccccc21 1778784141 QNFSTQFSPKECJY-NJNPRVFISA-N 464.950 0.454 50 20 JCGD Cc1ncccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371044 JKSIARCATOWMCF-AUSIDOKSSA-N 452.515 0.830 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)N2CCOCC2)C1 1779410694 QSXIWQADPVPGRX-OSGQAZFXSA-N 462.385 0.182 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1780049152 GXZMVSLDDOMYMV-QHCPKHFHSA-N 492.496 0.196 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968249 CJZACHDUIOZNBN-UUOWRZLLSA-N 488.589 0.077 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C1(C)COC1)CCO2)NC(=O)NCc1ccccc1 1780968834 KCCPRKFJXFQXOJ-HSZRJFAPSA-N 459.547 0.199 50 20 JCGD Cc1ncncc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969273 VLUDYKODQQTUBD-XMMPIXPASA-N 481.557 0.575 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1782050221 XMGVMKRWAVASIR-QHCPKHFHSA-N 482.302 0.098 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CSCN3C(=O)[C@@H]3CCC(=O)N3)C2)C1 1782873296 MLLOJSFCSZPWMR-IGMJJTELSA-N 472.995 0.014 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CNC(=O)C3)C2)C1 1783158263 QGIGLRASRJEFLI-YRVVQQKDSA-N 458.943 0.085 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1=CCCN(C(=O)OC(C)(C)C)C1)CCO2 1783933243 FQFUTZMDVCLBSF-DEOSSOPVSA-N 493.605 0.757 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@]13C[C@H]1CCN3C(=O)OC(C)(C)C)CCO2 1783937620 WDFRBARZUZXDMU-GAZXMLTASA-N 493.605 0.589 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783950331 MOEXBSBRNMYPHA-GOSISDBHSA-N 457.351 0.316 50 20 JCGD Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(C)s1 1785409723 XYDHEZZZBRYYFP-FNHZYXHNSA-N 472.571 0.594 50 20 JCGD CC(C)c1csc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)n1 1785501934 HGBIJYLPLVVINA-IEZWGBDMSA-N 457.361 0.853 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(N4CCCC4)ccn3)C[C@@H]21)c1cccc(B(O)O)c1 1786983631 YSDWGQXTRPCNEV-HARLFGEKSA-N 478.358 0.269 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc(=O)nc2cccnn12 1789197631 MSPKREJUDZQFBC-YDHLFZDLSA-N 464.320 0.468 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21 1791143154 YJOUFULPOADHLU-RYLXDESZSA-N 499.432 0.899 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c4nncn4c3)C[C@@H]21 1791291039 INFUOOJYPNAUPI-QRTARXTBSA-N 477.953 0.349 50 20 JCGD Cc1nn2cc(CC(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)nc2s1 1793903239 SZLDLBXDCARZFY-YOWGUQMCSA-N 468.543 0.592 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)cnc2s1 1797602144 JEYVECNYTIELEQ-BJWYYQGGSA-N 466.328 0.310 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1Cc2ccccc2C1=O 1797763754 DEZFHYHXKYSRHW-BCDXTJNWSA-N 476.537 0.983 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccccc1C(=O)OCCO 1798565303 BBPXKQZXOILFTO-ZSBFGKGUSA-N 469.332 0.824 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(Br)nc1 1799031045 BCEXQUBQTRSXPE-YVWYUNDQSA-N 482.379 0.349 50 20 JCGD Cc1cc2nnc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)c(C)n2n1 1799346961 GKCOTUBIWRJRAH-BAESOJJISA-N 455.288 0.635 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](COC)NC(=O)OC(C)(C)C)C2 1800975323 MMQALEGHWMCVEI-QRJUGERDSA-N 463.959 0.370 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C(F)(F)F)n1)C2 1801011889 PUBSCQZWLLIBJW-IVWMJMPLSA-N 457.453 0.677 50 20 JCGD CN(C)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1805109664 WDRZZGJDUSUUPR-WMZHIEFXSA-N 473.342 0.856 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccn(C(F)F)n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360801 LXVXITJSEFQBGD-QFBILLFUSA-N 469.257 0.986 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373998 FVDURHNIBNJLTO-WVBUVRCRSA-N 466.347 0.386 50 20 JCGD O=C(Cc1ccc2ncnn2c1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807400982 OHOASUKNUWRGJD-GBXCKJPGSA-N 484.325 0.366 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1CC[C@@H]2CCC(=O)N2C1 1807735018 JCHUBXQJLAUTBN-CXFRRJOOSA-N 490.369 0.482 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc2ncccn2n1 1809763523 MPYKTHQLYWGMQS-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD COc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1 1810303781 YHDRBBQGDIWMOE-MGPUTAFESA-N 476.497 0.512 50 20 JCGD Cn1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c2c1CCC2 1817471836 QVLWRROPVUVBNL-IBGZPJMESA-N 462.319 0.931 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)nc3sccn23)[nH]n1)c1ccc(B(O)O)cc1 1817472633 XNXBDUFHFFVORT-INIZCTEOSA-N 492.326 0.779 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc(=O)nc2cccnn12 1820145183 FFSQGIPIESLOCS-QGZVFWFLSA-N 487.285 0.112 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499384 DEEZGGCYTFWTQH-CYBMUJFWSA-N 481.604 0.635 50 20 JCGD O=C(CN(CCO)CCO)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2 1825327796 QTKYEJBJLPEMMW-TVQRCGJNSA-N 453.334 0.032 50 20 JCGD COCCOCCOCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1825774965 BMZSOESSMCXPAU-HNNXBMFYSA-N 485.607 0.498 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052723 BSOPRIBWALUELK-LEWJYISDSA-N 470.404 0.626 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1830538372 DQNANPPHVMYXBT-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD O=C(C[C@@H]1COc2ccccc2O1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725560 JZAUCNDLJVVELA-VWKPWSFCSA-N 454.907 0.273 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737894 JVFHKSZFVNWWFK-AJAKECSLSA-N 487.981 0.442 50 20 JCGD COC(=O)N(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)Cc1ccccc1 1830739048 XBWJWWHFPWLKRE-XMSQKQJNSA-N 483.949 0.311 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831506029 RNUAXFKOFSGLTC-DOWNOZBLSA-N 492.013 0.982 50 20 JCGD O=C(/C=C/c1ccsc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833139554 WHOVXKNFAAIMAI-BGDOBLQISA-N 456.329 0.211 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCN3C(=O)c4ccccc4C3=O)CC2)CC1)[C@H](O)CCl 1833308065 HBAUWWIZKSZGTK-HXUWFJFHSA-N 490.988 0.844 50 20 JCGD Cc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1F 1833709718 SCBNDAUOOPVWJT-CZUORRHYSA-N 451.268 0.628 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c4ncccc34)CC2)CC1)c1ccc(B(O)O)cc1 1834798659 VUGVYUKMEPJNCE-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD O=C(NCC(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)c1ccco1 1834822317 HEQNJDVVEFUSKW-GOSISDBHSA-N 458.309 0.251 50 20 JCGD Cc1ccc(SCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835930643 RKTWUWZIQYOYMA-XMMPIXPASA-N 484.383 0.537 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc(C)c1O 1835941061 FGQKFNOOZQKUJV-XMMPIXPASA-N 468.315 0.073 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)C1 1836715011 YDUSMCSMQVPVLQ-QZTJIDSGSA-N 480.606 0.947 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(Cl)c(Cl)c1)CCO2 1837915106 AIHDLGJYASRWKF-NRFANRHFSA-N 494.140 0.452 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837921022 SXRZXGFTODBJKV-CQSZACIVSA-N 467.169 0.762 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922179 TXOXPSAFKGICDD-UHFFFAOYSA-N 467.331 0.200 50 20 JCGD O=C(c1n[nH]cc1I)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1837963405 MXQNZCLDHOGIGB-RISCZKNCSA-N 486.669 0.619 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C#N)CC3)C2)C1 1838528413 VZHKYCPZHVHSQY-QFIPXVFZSA-N 472.454 0.894 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)c(C)n2n1 1839200412 HLWWTXNEGDYGCZ-QAPCUYQASA-N 485.314 0.502 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201845 LANQESHSCTVEIS-WZDAXMPFSA-N 488.310 0.904 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1 1839437296 PPHKRBGPKPDGDB-RXVVDRJESA-N 463.922 0.591 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc3c(c1)CCNCC3)CCO2 1839693303 WEAHFNZFAHMDMF-HSZRJFAPSA-N 476.650 0.691 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1 1840033353 AZZNCSSVDSVIAJ-PNHOKKKMSA-N 482.331 0.961 50 20 JCGD CC(C)[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1840106407 FWANFFHDUAFVTH-JKSBSHDWSA-N 492.013 0.982 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(NC(C)=O)c3)C2)C1 1840152831 VVMFKSMONJYAPR-OXQOHEQNSA-N 454.911 0.364 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1840185771 XHBUEJIOFGJSEM-NRFANRHFSA-N 484.937 0.194 50 20 JCGD O=C1C[C@@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CN1Cc1ccccc1 1841504521 FNARWPVEOVOFQC-HXUWFJFHSA-N 461.327 0.232 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cnccc3C(=O)NN)cc2)CC1 1847242490 YUDATBBNFKGHSN-VXKWHMMOSA-N 477.569 0.566 50 20 JCGD O=C(COC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNC(=O)c1ccc(Cl)cc1 3467978 QHHUDNWIKAUPDA-UHFFFAOYSA-N 460.786 0.849 50 20 JCGD O=C(Cn1cnc2scc(-c3cccs3)c2c1=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 9931021 ZIJBSOIUMSVBEE-JTQLQIEISA-N 452.539 0.769 50 20 JCGD COc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1S(=O)(=O)N(C)C 17406262 FXXBGCLPFJRNQL-UHFFFAOYSA-N 498.583 0.336 50 20 JCGD O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 17517218 XVLWCGJXRHCXRN-UHFFFAOYSA-N 485.522 0.326 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 109759245 BNPLPXNJUSZNAD-UHFFFAOYSA-N 474.437 0.920 50 20 JCGD O=C(COC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1)NNC(=O)[C@@H]1COc2ccccc2O1 728323132 VIESSGKIOSMJGM-KRWDZBQOSA-N 493.469 0.411 50 20 JCGD Cc1ccc(C)n1-c1ccc(C(=O)NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)cc1 749353977 RSCIEMIWOMJULI-UHFFFAOYSA-N 462.576 0.615 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNC(=O)c2cccs2)s1 751208168 AYIHNGGXNGYWMN-GFCCVEGCSA-N 456.571 0.849 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)Cc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)c1 825781959 MPNHRJLFOBJRGT-UHFFFAOYSA-N 492.554 0.527 50 20 JCGD COc1ccc(N2C[C@@H](C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)CC2=O)cc1 912988622 MUVPDWJASAYDOU-LBPRGKRZSA-N 466.903 0.810 50 20 JCGD CCN1CCC[C@H]1Cn1c(C)cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)c1C 914695141 GUGIEAIXBFOPOM-KRWDZBQOSA-N 461.592 0.624 50 20 JCGD O=C(O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 918062199 NOFNHEAPEDMKRI-UHFFFAOYSA-N 471.488 0.932 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CS(C)(=O)=O)cc2)cc1 919685941 HKALWIFJBIDVSJ-UHFFFAOYSA-N 455.514 0.692 50 20 JCGD O=C(CCCN1C(=O)CNC1=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 920242837 GFSLHZXWXGLVCG-UHFFFAOYSA-N 462.466 0.538 50 20 JCGD O=C(COC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)NNC(=O)c1ccccc1 921105023 XPRXPGRHARUHSZ-UHFFFAOYSA-N 452.514 0.370 50 20 JCGD O=C(NNC(=O)c1n[nH]c2c1CCCC2)c1cc(I)ccc1-n1cnnn1 1321830036 RBSGOEDWXZVQJG-UHFFFAOYSA-N 478.254 0.944 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccccc3N)CCO2)C1 1779031569 UFPBLDYXKUZRQV-NFOSPISASA-N 450.499 0.424 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)CCO2 1779033748 CSFQMTZHMPYQJT-NVQXNPDNSA-N 492.580 0.793 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](COC(C)=O)OC(C)=O)C1 1779406248 BVRLMFSNJRANRI-TVKQPGBESA-N 462.927 0.249 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc(Cl)n3)C2)C1 1779502107 UGJDZUHNDYZZNE-ORBAKXMTSA-N 459.894 0.708 50 20 JCGD COc1ccnc(C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c1 1779537679 YTCSKAICWINJEJ-VWLOTQADSA-N 496.568 0.880 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ncccc3Br)C2)C1 1779651809 SVQXIRNFVPKVFH-HXUWFJFHSA-N 489.330 0.600 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn(C)nc2C(F)(F)F)C1 1779706346 LKNFAVDWMYEYBW-FOIQADDNSA-N 488.511 0.939 50 20 JCGD COCc1c[nH]c(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)c1 1780075402 KIAAHXIEEDDASX-IBUSPFOHSA-N 456.503 0.739 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780774759 LLURUCLGCSEKQR-DDFXLWFNSA-N 454.293 0.255 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1780826382 PNTKWXIKKGADKJ-NFBKMPQASA-N 454.336 0.077 50 20 JCGD Cc1cnn(CC(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)c1 1780970517 WUVMKUMZJLLJBS-DEOSSOPVSA-N 483.573 0.368 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@]3(NC(=O)OC(C)(C)C)CCOC3)C2)C1 1781312883 ZRRZNWXLRWURBZ-JHVJFLLYSA-N 475.970 0.754 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CC[C@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)[C@H]2C1 1783475704 XQFDAPBFKMFMPV-CLJZWUSWSA-N 487.981 0.298 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3c(I)cnn3C)CCO2)C1 1783874125 CJBUXVYPRYSXPB-BDJLRTHQSA-N 496.733 0.722 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)CCO2)C1 1783875716 SLNNTLAIDMQAMP-LRTDBIEQSA-N 474.905 0.268 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1783936164 HNEHTZGWHBNRKM-DEOSSOPVSA-N 474.558 0.861 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784097148 PQVSDBDNYAYWJN-ZOFXXKQRSA-N 475.970 0.202 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1784197043 CHYRVSLIOSVZMY-YTFOTSKYSA-N 496.374 0.932 50 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C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C[C@@H]21 1788762505 CZRDDGHTQGRECH-BZSNNMDCSA-N 475.684 0.489 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)nn1C(F)F 1789329576 SHADHNVSAPBWFZ-ZVZYQTTQSA-N 462.262 0.174 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C(C)(C)C)nn3)[C@H]2C1 1789354368 OYWZHGMGJSKUEO-GDJYOZILSA-N 484.561 0.760 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1789589416 LXHQRUGYANZXAR-NDXORKPFSA-N 466.542 0.658 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c1 1790311142 VHZIENURJYIYDD-GQGQLFGLSA-N 462.927 0.422 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)C=CC3=O)[C@H]2C1 1791396093 SMQUXBCNAYSNIS-TYDTZWSASA-N 484.459 0.776 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCCO1)NC(=O)NCc1ccccc1 1792564813 LIAXWSRBAJHPNJ-XAPVIXHLSA-N 473.574 0.491 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC(=O)NC1)NC(=O)NCc1ccccc1 1792662874 RMTICEKJFYMRAD-YSTOQKLRSA-N 470.574 0.497 50 20 JCGD O=C(C[C@H]1OCCc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793270248 FSJUOLSYTRVURL-OMXLDXBASA-N 464.327 0.274 50 20 JCGD COCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1795353193 ZASORJFVSOJXJI-IVSAIRAKSA-N 463.959 0.371 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cc1F)C2)c1cccc(B(O)O)c1 1795737604 AENDNOPYZHILRZ-HBCWATKFSA-N 491.122 0.785 50 20 JCGD CC1=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)CCO1 1795948828 BNFGPIRAGPOQJY-HATOLVCRSA-N 471.558 0.617 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSC(=N)N)NC(=O)NCc1ccccc1 1795950776 ZLLZIROFZPUXHB-BJWYYQGGSA-N 461.592 0.597 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796187802 FXAVIUQIHGWRCS-DQEVTTJGSA-N 459.352 0.779 50 20 JCGD CC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(F)cc1 1796188426 DWXDNBWBHJIUHH-LRSLUSHPSA-N 467.306 0.635 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cccnc1-c1ccccc1 1796565987 SNMRBZVGVDVUSW-JHDGKUDLSA-N 471.322 0.945 50 20 JCGD C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)NC(=O)OC(C)(C)C 1797750911 VIIVMLBOCFEOGH-BKEDOTJMSA-N 490.561 0.192 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C3)nn1 1798372242 SBTOAPBZWOTCNW-VTEUUUEMSA-N 485.453 0.836 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1799218171 ZVWRDGXCFFNWCR-BCDXTJNWSA-N 481.270 0.766 50 20 JCGD Cn1c(=O)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)nc2ccccc21 1799346752 ABMQZRPIZFVLHT-VAECKANCSA-N 467.295 0.827 50 20 JCGD CN1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C#N)=C/c2ccc(F)cc2F)CC1 1800333473 XHELHBUELMJCKS-TVLHWSJOSA-N 473.524 0.709 50 20 JCGD O=C1NC(=O)[C@H](CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)Cc2ccccc2)N1 1800435741 MJGXINQVLNAQGJ-IWSXDTNSSA-N 493.358 0.180 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803137052 ZWPNZFRVDXVHCO-BDXSIMOUSA-N 484.981 0.963 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCNC(=O)c2ccc[nH]2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362914 MWOORYQQNJRMJO-CVDCTZTESA-N 489.341 0.229 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1[nH]nc2ccncc12 1808100951 SMDSCYUMSHVRQA-VGOFRKELSA-N 470.298 0.666 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1 1808668313 ODQXAKBXFGBLOD-QVHKTLOISA-N 461.288 0.842 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n(C)n1 1810297877 FUWZPCUDUHVQDZ-FOIQADDNSA-N 478.513 0.456 50 20 JCGD CC(=O)O[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(C)C 1810302089 GCBGTMHGJYMBNN-WMQCIHAUSA-N 482.541 0.987 50 20 JCGD 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COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cccc(O)c1)c(=O)n2Cc1ccccc1 916333529 NOSXRROXNCRSCH-UHFFFAOYSA-N 476.493 0.910 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NC[C@H]1Cc2ccccc2O1 916516302 RQKWYTXFTDLIRD-LJQANCHMSA-N 488.566 0.974 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3ccc(Cl)nc3)n[nH]c2n1 918069351 NXUSMMQGCHESHN-UHFFFAOYSA-N 450.916 0.407 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1)N[C@@H]1CCS(=O)(=O)C1 919889538 NXTDETNTALRXTL-OAHLLOKOSA-N 498.608 0.626 50 20 JCGD CCO[C@H](C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 920092941 HVRZJUUGOWXTRJ-MRXNPFEDSA-N 470.530 0.636 50 20 JCGD COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1 921022249 NFORBESSPREILW-HJWRWDBZSA-N 498.535 0.917 50 20 JCGD CN1CCN(c2ncccc2CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1 921247730 JZBQCBRJYBUFQV-UHFFFAOYSA-N 475.575 0.228 50 20 JCGD COc1ccccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029791 YWPVLIWRWBKLPY-XMMPIXPASA-N 467.526 0.770 50 20 JCGD 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491.353 0.836 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)Cn2cnnn2)[C@@H]1c1cccnc1 1807611490 SRYMCAUDTHVFKL-IERDGZPVSA-N 494.468 0.921 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808418106 ZEPKZJHZFBDRQB-YYURKQIGSA-N 482.545 0.668 50 20 JCGD Cn1nc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c2c1CCC2 1809359873 IPFXTVCGHGEMTP-JPYJTQIMSA-N 473.342 0.617 50 20 JCGD Cc1nn2cc(CC(=O)N3CCC4(CCCN(C(=O)c5cccc(B(O)O)c5)C4)CC3)nc2s1 1809977443 GRWCEFAJOFMBAD-UHFFFAOYSA-N 481.387 0.867 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1 1812868706 KEQUUBRWBHKXRM-LNSITVRQSA-N 455.309 0.414 50 20 JCGD Cc1c(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn2[nH]cnc(=O)c12 1813074658 UXPOJWGKIWQZOT-HTAPYJJXSA-N 494.556 0.419 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)[C@H]1c1cccnc1 1813338073 ONLIXDDRAGFWEH-GSEOLPGOSA-N 476.965 0.812 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CCn2ccnn2)[C@@H]1c1cccnc1 1813430365 NOLQSAQELYWQLU-VCMTVRCOSA-N 477.529 0.903 50 20 JCGD COCc1oncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817471867 STOKSIIZZPVWPU-QGZVFWFLSA-N 453.264 0.844 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817473814 BEAVQMNZLGVPEO-QGZVFWFLSA-N 462.275 0.203 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnn3ccncc23)[nH]n1)c1cccc(B(O)O)c1 1817476322 QATVQUXZWFMCLI-GOSISDBHSA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCn2ccnn2)[nH]n1 1819404484 NOWJPERHJWPVCK-MRXNPFEDSA-N 452.479 0.396 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc(O)n3c1CCCC3)CC2 1819797737 IJFIQYGEGGQTRK-NSHDSACASA-N 496.553 0.920 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCCS2(=O)=O)n[nH]1 1821835681 JHQVJFDXKQGKTJ-LSDHHAIUSA-N 454.553 0.352 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)sc2C1 1826650707 WTISCGVVCOBKEL-UXIGCNINSA-N 468.967 0.779 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827055085 PMDYVUJNWIQPRE-CVDCTZTESA-N 460.336 0.216 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830353669 JJNMKSNWOKPRFA-QVKFZJNVSA-N 477.986 0.593 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1sccc1F)CCO2 1831918806 VYWRJYRORJOWIB-FQEVSTJZSA-N 463.491 0.270 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(F)cc3F)CCO2)C1 1832141602 YEGPYALEENPMMK-ILHLOOHCSA-N 480.512 0.807 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(Cl)s3)CCO2)C1 1832604585 WSIVHRHHFOYXNB-OAQYLSRUSA-N 493.973 0.713 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(OC)n3)CCO2)C1 1832826960 ZZXBDXBPSWAOGI-UTKZUKDTSA-N 455.939 0.733 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3)CC2)CC1 1833099517 HNDOPYZGGYICJJ-OVVQPSECSA-N 471.606 0.788 50 20 JCGD CC(C)c1nc(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)no1 1833783817 BEDXKNSTICYPHA-UHFFFAOYSA-N 498.588 0.619 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nc1 1833998086 VOWBMFABTOSPOR-GOSISDBHSA-N 472.995 0.270 50 20 JCGD CC(C)Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n(C)n1 1834797861 FJNMGHPJOJVEIK-UHFFFAOYSA-N 495.433 0.797 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCOC[C@]2(CN(C(=O)CN)CCO2)C1 1835554355 BTIFGEWFJOTEEA-ZYEUVFMNSA-N 463.332 0.771 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)c3ccco3)CC2)CC1 1835734326 ALIVNWAHYWLYJI-HXUWFJFHSA-N 470.530 0.197 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3CCCC4)C2)C1 1835933903 ILGIXHMQRDTYMQ-AREMUKBSSA-N 478.354 0.629 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835934130 LUFNWXZIINKHLU-MHECFPHRSA-N 452.316 0.240 50 20 JCGD O=C(Cc1ccc(Cl)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935312 ANTMQBZAZMXWOP-HSZRJFAPSA-N 472.734 0.333 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccnc4c3OCO4)CC2)CC1 1836093399 BOQORTFVKKONNP-UHFFFAOYSA-N 474.562 0.369 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1836215751 NDITVFYJPKALRR-YRVVQQKDSA-N 496.388 0.617 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cn1 1836380972 PYIZMIYLPZFIQU-SFHVURJKSA-N 480.370 0.500 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CC(=O)NC3=O)CC2)CC1 1837077704 OIGHUHPSOWDGFE-GFCCVEGCSA-N 459.341 0.320 50 20 JCGD COc1cccc(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1837128507 XOPGXZHDMLHDJW-UHFFFAOYSA-N 481.358 0.625 50 20 JCGD N[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccn1 1837873035 HHEOARMMLDCCPL-JOCHJYFZSA-N 466.347 0.074 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccncc3F)CC2)CC1 1837919449 SWPMGSPPDLBTPH-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1 1839200614 LCCJMNOQNVVUGP-PBHICJAKSA-N 491.270 0.759 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1 1839489169 OSUXEECUAWWNLJ-IIBYNOLFSA-N 461.906 0.758 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)c12 1839557409 YMZKGKLVEIMNNV-VWLOTQADSA-N 493.325 0.240 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(C)c(C)[nH]c3=O)C2)C1 1839962617 LRBWRHQIZBXPAV-AUUYWEPGSA-N 471.352 0.630 50 20 JCGD COC(=O)N(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)Cc1ccccc1 1840083647 QKSAWZQJZDRRMV-XMSQKQJNSA-N 483.949 0.311 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1 1840152278 DFSVUVBPPODAEJ-QRQCRPRQSA-N 478.933 0.257 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CN(C)C1)CCO2 1840571440 UMFZWYBAMSLTCS-JOCHJYFZSA-N 476.486 0.152 50 20 JCGD CO[C@H](C)[C@@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)N(C)C(=O)OC(C)(C)C 1843011928 KXOFBGKKAMVZPN-APWZRJJASA-N 489.378 0.454 50 20 JCGD C[C@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1ccccc1=O 1844366434 VNGCWFHBKAUSKJ-LJQANCHMSA-N 480.569 0.959 50 20 JCGD COc1cnc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)cn1 1845038564 TUQBGRILAMXZAT-UHFFFAOYSA-N 467.530 0.648 50 20 JCGD Cc1nn(C)c(C)c1-c1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n[nH]1 728329219 KZVAYYQUZJETQC-KRWDZBQOSA-N 454.443 0.571 50 20 JCGD CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1 730542394 WKQYCKAJMRAQCZ-HNNXBMFYSA-N 450.608 0.631 50 20 JCGD O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)C(=O)N1CCCC1 748240310 RGIFOZPGNKARBG-HXUWFJFHSA-N 463.494 0.270 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1)N[C@@H]1CCS(=O)(=O)C1 749583664 SWUGCMLBDVNCGU-KGLIPLIRSA-N 473.349 0.571 50 20 JCGD O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 788022627 DBSAJWKWSFVZDS-LLVKDONJSA-N 471.479 0.346 50 20 JCGD CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 812452885 DEGOYZUNLUHFCP-IBGZPJMESA-N 470.438 0.748 50 20 JCGD CC[C@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 834791275 FQBRZEQNJYMXDL-IFXJQAMLSA-N 491.522 0.908 50 20 JCGD O=C(COC(=O)C1CCN(c2ccc3nnnn3n2)CC1)NNC(=O)c1ccc(Cl)cc1 904489477 IKIOLYQPSIKVBA-UHFFFAOYSA-N 458.866 0.394 50 20 JCGD CSC[C@@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 913155986 NHOVEBDQSNMIHO-XHSDSOJGSA-N 457.516 0.330 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)COc1nsnc1N1CCOCC1 914685638 FAZMCNSODOTAHY-UHFFFAOYSA-N 472.321 0.742 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCc1ccc(O)cc1 916259249 ZCILAQDTMPNMDO-UHFFFAOYSA-N 462.528 0.876 50 20 JCGD COCC(=O)Nc1cccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 916383082 HPNSQIRJASJNJC-UHFFFAOYSA-N 477.543 0.731 50 20 JCGD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 919361671 PNAHQRNNQGLPNQ-OAHLLOKOSA-N 456.477 0.493 50 20 JCGD COc1cccc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)c1O 919756629 OXTLSBXJJOMRPX-ZDUSSCGKSA-N 475.479 0.799 50 20 JCGD CNC(=O)CN1CCC(NC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CC1 920855063 WBURDKYGBNEHFY-AQTBWJFISA-N 493.568 0.668 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1 1779032310 IXJHTVCKPPQUOI-QHCPKHFHSA-N 476.497 0.228 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2 1779473478 CFQVSISSMVXABK-FKEXNYPISA-N 482.379 0.892 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1780095212 JSIFJTMWRUARBH-KXBFYZLASA-N 455.851 0.563 50 20 JCGD O=C(CN1C(=O)C2(CCOCC2)c2ccccc21)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1780932973 PJCPKZQFQXAWIE-AUSIDOKSSA-N 491.972 0.511 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C2 1782175352 IJTIEFLAKFLEQB-WOCWXWTJSA-N 462.927 0.249 50 20 JCGD CC[C@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)NC(=O)OC(C)(C)C 1783934965 OHYYYDKGTDXTGS-UZUQRXQVSA-N 483.610 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(OC(F)F)cn1)CCO2 1783935749 CVUXFDZPJNKUBT-HXUWFJFHSA-N 455.462 0.500 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1784011564 QAYSBOMMIUSSNZ-RTBURBONSA-N 466.362 0.992 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CS(C)(=O)=O)[C@H]2C1 1784513501 GKMKILMGVULVEC-QTVXIADOSA-N 453.399 0.678 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC(=O)N3)[C@H]2C1 1786570115 VFDVVQPHPXBQBB-QXKUPLGCSA-N 472.970 0.377 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cc(O)ccc4n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979646 HGXDKPCHBYMTSL-NYDSKATKSA-N 475.310 0.527 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(Br)n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979960 UJBHAMORCOBYFK-NOLJZWGESA-N 494.176 0.493 50 20 JCGD CC(C)COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)ccn1 1786983547 WYBFYZRLMKEHPU-BVSLBCMMSA-N 481.358 0.703 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C[C@@H]21)c1cccc(B(O)O)c1 1786984836 OUIQANXOKSUQLC-LEDOBFOHSA-N 474.326 0.664 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C)nn3-c3cccc(=O)n3C)[C@H]2C1 1787154175 YUMSRWOXUJZRKM-BMFAXAFESA-N 491.976 0.727 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21 1788611609 MIHWMYZSSGXJGZ-GQSCTRQFSA-N 498.584 0.070 50 20 JCGD CN1CCN(c2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)cc2)CC1 1792529105 YBBMGKHTNGCOFK-VILGAWFOSA-N 476.386 0.684 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccc(C)n1 1794148329 OXOSUSWGDNATOX-VPTLXERWSA-N 471.470 0.928 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncc1-c1ccccc1)C2)c1ccc(B(O)O)cc1 1795735320 ZJDJLQQOFKOELI-IRJINJETSA-N 471.322 0.945 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(-c3cccnc3)n1)C2)c1cccc(B(O)O)c1 1795738753 CUWVUZNOGCTJCO-XEMDLRDOSA-N 478.339 0.402 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NNc1ccccc1)C2 1796439891 NDCKTEFWSXGFNU-MZEKZNODSA-N 481.557 0.715 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cc(C)cnc13)C2 1796441937 IIHZLVLYFXVBFY-JRADWPLCSA-N 478.513 0.375 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1796445585 FGCJWBBVMLCXIO-DQJWAHKXSA-N 487.557 0.689 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc(-c2cccnc2)n1 1796485059 VLXZAPJSTBUXLL-CCWDJLKJSA-N 493.549 0.721 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1796890708 GQTNYFBCFQVEEY-MZFCXCTDSA-N 495.540 0.765 50 20 JCGD Cc1cccc2[nH]c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)cc12 1797401912 QNHHRRDBKSIAKP-USGNIVHTSA-N 462.510 0.992 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cnc1Cl 1798045852 OOPBVEMGTQHIJL-CULMDFNYSA-N 462.869 0.390 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)N1CCOCC1)C2 1800333457 VYIGBLLUTLGAPX-DDCXILGUSA-N 476.480 0.112 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC12CN(C(=O)OC(C)(C)C)C2 1800708122 BIEQXAGAPBIVNN-AXVVYFOYSA-N 493.605 0.206 50 20 JCGD COc1cc(F)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801014420 PMBCKQJCXVMNSI-MFKICJERSA-N 450.511 0.339 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1801316550 UBVAGZSBIWRGGT-DFYYWFRZSA-N 455.345 0.145 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(C)(C)C 1803386827 YWVPAQNQOJFGIU-KSEOMHKRSA-N 480.374 0.632 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnnc(Cl)c1 1804720448 DBKJLJKEMPDQKZ-OXQOHEQNSA-N 465.706 0.838 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)C1 1805506293 LZKOTMHXZPOKRU-OALUTQOASA-N 456.348 0.801 50 20 JCGD COCc1c[nH]c(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1807362351 VIIZGRCJYGUXTM-KNQAVFIVSA-N 462.315 0.869 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365151 WLVJKDPRTWTESR-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc(O)n1 1807375881 QTPPNOVSXHKKNP-PGRDOPGGSA-N 460.299 0.804 50 20 JCGD Cc1nnsc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303635 UFKIYDPAFCFQCT-YOEHRIQHSA-N 466.527 0.873 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)[C@H](O)N1CCOCC1 1810351843 QFUMAROTEHCAJY-KRXQYRFLSA-N 459.316 0.429 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1 1813070883 NLQBOCXBHRNUQF-DYESRHJHSA-N 464.530 0.817 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ccc(F)cn3n1)CC2)c1cccc(B(O)O)c1 1815360533 SORJIDSEWJLLBO-CQSZACIVSA-N 480.290 0.544 50 20 JCGD O=C(/C=C\C(=O)NC1CC1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819270426 JJBOISPRYBLYBD-HJCTWCACSA-N 451.292 0.230 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2ccc(O)nn2)[nH]n1 1819403863 KGDYFPGBBGRERH-QGZVFWFLSA-N 479.501 0.843 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)C(F)(F)F)n[nH]1 1822444581 ZZVFVGGCMUUBGW-LBPRGKRZSA-N 461.445 0.453 50 20 JCGD CC(=O)C(=O)N[C@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822518987 ZKBJJCGRWYHXFH-HNNXBMFYSA-N 458.544 0.990 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3C)sc2C1 1823046052 BOAZZMQSJZLUBL-JBGLZKNHSA-N 471.543 0.810 50 20 JCGD O=C(CCN1CCOCC1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050753 FPOIEVRWSYFOPH-JOCHJYFZSA-N 457.380 0.322 50 20 JCGD O=C(COC(=O)C(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052137 POAMPTZRIMTXQL-QGZVFWFLSA-N 470.253 0.705 50 20 JCGD O=C(Cn1cncn1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551362 OGNSWIUWJCFVTK-AVRDEDQJSA-N 490.948 0.330 50 20 JCGD O=C(c1ncn(-c2cccc(F)c2)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725419 OJGIVHGFKUXFQV-OXJNMPFZSA-N 467.885 0.076 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2 1831248988 JELVDIKKRSBRIY-LQWHRVPQSA-N 451.907 0.236 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1831655311 VVPJAMTVUOCRFB-VFNWGFHPSA-N 463.922 0.567 50 20 JCGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(=O)[nH]c1C 1833390367 WGJGOWBSTMWUGZ-CXAGYDPISA-N 461.288 0.147 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(F)(F)F)CCO2 1834111331 MFHCOPZWJKUBRV-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccno3)CCO2)C1 1834144499 IETDCDWFVMSBHP-VBKZILBWSA-N 472.926 0.877 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OC)cn3)CCO2)C1 1834531933 JHDGDUXSQFZRBG-ACJLOTCBSA-N 457.325 0.729 50 20 JCGD Cc1ccc(C(=O)C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1834799348 YQMXJPUTARDMPQ-UHFFFAOYSA-N 477.370 0.743 50 20 JCGD CN(C)c1cncc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835737070 JYMDPPOFADXFDF-UHFFFAOYSA-N 494.600 0.645 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nc2ccccc12 1835930686 UKIPQROECKNDKH-AREMUKBSSA-N 489.337 0.607 50 20 JCGD COc1ccc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1835931866 FGEOAOBJPHAMAF-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD O=C(c1ccc(OCC2CC2)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933518 AZCPAYYUVYEQDF-SANMLTNESA-N 494.353 0.539 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)C3CCC(C(F)(F)F)CC3)C2)C1 1835934058 LOEJMPDRELRSMJ-QRFVXNFXSA-N 498.307 0.805 50 20 JCGD CSc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835934483 VLYPVPKXSJOGSM-XMMPIXPASA-N 484.383 0.401 50 20 JCGD COCCC(=O)N1CCC(N2CCC(NC(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1836343482 DUOQDPCZWXNOTE-UHFFFAOYSA-N 488.633 0.941 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cnnc(Cl)c3)CC2)CC1 1837223976 FNVGRJDLXDRTOB-UHFFFAOYSA-N 472.738 0.736 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837348817 VSIMIVDHHKGOAB-KUDFPVQQSA-N 453.923 0.306 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C2)C1 1837456460 NADFVNRFEZFRAR-XVAXZDLZSA-N 497.474 0.488 50 20 JCGD Cc1c(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cnn1C 1837543282 NLBUNGGECNSZQC-UHFFFAOYSA-N 469.546 0.653 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1839156123 BWNXEQRYHZTURL-DLBZAZTESA-N 484.427 0.539 50 20 JCGD O=C(c1nc(O)n2c1CCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200635 NAPGBBOEVMGGNJ-KDOFPFPSSA-N 475.315 0.686 50 20 JCGD COC(=O)C12CC(C(=O)N3CCOC[C@@]4(CN(C(=O)[C@H](F)Br)CCO4)C3)(C1)C2 1839202415 FCKGWTUMWWYYJU-IMBJVDQRSA-N 463.300 0.477 50 20 JCGD CC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802324 SNZRYBGEEFQELN-RXVVDRJESA-N 482.375 0.585 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CNC(=O)C1)CCO2 1839872000 RRZSMESNFSLCFA-FNBZOWKBSA-N 474.464 0.464 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2 1839962578 KVZYFJVMESIBIK-DNVCBOLYSA-N 462.385 0.923 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840184716 CAKDHASYXHJOHS-YADARESESA-N 460.575 0.928 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841837327 UQRYRJOYYODKEB-UHFFFAOYSA-N 458.563 0.404 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCOCC3)n2)C1 1843527830 HSAVPMQIJGVDOE-WPWMEQJKSA-N 479.541 0.869 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1844692710 BPTUIEUXONAHJQ-INIZCTEOSA-N 464.431 0.402 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)COCCNC(=O)OC(C)(C)C)C1 1845154283 PFRLKVFJSCZFCS-WGOQTCKBSA-N 490.561 0.865 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O)C2 1846385173 YMGPKDWXWSHUNI-DLBZAZTESA-N 481.594 0.181 50 20 JCGD Cn1cc(C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c2ccccc21 10737075 FVVKJPBYBQYEBQ-SFHVURJKSA-N 492.579 0.721 50 20 JCGD C=C(C)CNC(=S)NNC(=O)Cn1c(=O)c2c(ncn2CCOC)n(Cc2ccccc2)c1=O 16310843 HJGYNJHNNOVWRO-UHFFFAOYSA-N 485.570 0.126 50 20 JCGD CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)CC1 21189664 AFMLRYYVBNROIL-UHFFFAOYSA-N 466.589 0.930 50 20 JCGD COc1ccc(-n2nnc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2C)cc1 728324015 OLJLLUKHSQOQKP-GOSISDBHSA-N 467.438 0.729 50 20 JCGD Cc1sc2nc(CS[C@@H](C)C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)nc(O)c2c1C 729276364 DEDGEIPHTOXREI-WPRPVWTQSA-N 461.591 0.721 50 20 JCGD C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)CCOc3ccccc3)CC2)C[C@H](C)O1 747104691 HCIOMERVFHKDSS-IRXDYDNUSA-N 469.564 0.168 50 20 JCGD CN(C)C(=O)CN1C(=O)C(=NNC(=O)c2ccc(-n3cnnn3)cc2)c2cc(Br)ccc21 750929417 BASVYLDISOTLML-UHFFFAOYSA-N 497.313 0.994 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1 912920239 ZQRPYRQRFHHCEF-UXLLHSPISA-N 490.623 0.872 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)cc1 916112282 LUZZHZHZRVZEEV-UHFFFAOYSA-N 478.552 0.250 50 20 JCGD CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)CC1 916390853 RXAFSPNESIYTSJ-HXUWFJFHSA-N 453.499 0.745 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1scnc1C)c(=O)n2Cc1ccccc1 916739397 COLARIYDEDERIE-UHFFFAOYSA-N 497.537 0.281 50 20 JCGD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 917723798 MLUUKUIHEJRDKO-UHFFFAOYSA-N 457.490 0.828 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)NCc2ccco2)c1 917901087 PNISDQBBVVKYIF-UHFFFAOYSA-N 451.505 0.571 50 20 JCGD C[C@@H](Cc1cccc(O)c1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 919785071 ZDZXDFSOKMFVLB-HNNXBMFYSA-N 462.528 0.988 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034969 YOQXJMPBTZQGGQ-NYHFZMIOSA-N 470.555 0.704 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)cc(O)n1 1780969042 TUTALXHRRSWFRG-RUZDIDTESA-N 496.568 0.885 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](N)c1ccccn1)CCO2)NC(=O)NCc1ccccc1 1780969429 GPVQQZMLUPZIFZ-RDGATRHJSA-N 495.584 0.258 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(O)n1)CCO2)NC(=O)NCc1ccccc1 1780970290 UFAIMPHYQXNRIC-DEOSSOPVSA-N 482.541 0.577 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1781355214 MBZFJZRYZVQOAB-IAISJRAMSA-N 482.347 0.783 50 20 JCGD Cc1cccc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)n[nH]c12 1781389284 OCQAPTHTCNHPLJ-CJFMBICVSA-N 476.342 0.992 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1783450480 OKEDCIQWYVPCMT-KBMIEXCESA-N 499.373 0.067 50 20 JCGD CC(C)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)CC1 1784993043 HILRZWMJUSYCNX-BVSLBCMMSA-N 457.380 0.080 50 20 JCGD COc1cc(Cl)cc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1785138072 YHGITQZKTSCZDF-JOCHJYFZSA-N 458.707 0.786 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788145676 NUBUHHDKMHIURT-NRFANRHFSA-N 482.298 0.609 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21 1788637894 IEFMVCUGSWRGDE-KFFAWSGCSA-N 477.352 0.492 50 20 JCGD COC(=O)N(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)Cc1ccccc1 1791145210 LVIVSRDTCJKXPJ-OKYOBFRVSA-N 467.950 0.834 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C(F)(F)F)cn3)C[C@@H]21 1791289388 WVAGWGBYYJMYAC-YDHLFZDLSA-N 472.468 0.462 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(F)CN(C(=O)OC(C)(C)C)C3)C[C@@H]21 1791292363 OJRGGVTYEKGRIZ-ULQDDVLXSA-N 499.584 0.298 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878294 PEZOZZHUATZVAG-LFYQSXPISA-N 474.986 0.623 50 20 JCGD Cc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n[nH]1 1793880156 RSKRWOFOYAORBQ-KPEUIFRASA-N 469.970 0.982 50 20 JCGD 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COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1F 1801504175 MZPLDVCMEKZODQ-USGNIVHTSA-N 471.489 0.279 50 20 JCGD O=C(CN1CCSCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1802446868 RGSNCXHWJFOYLC-DENIHFKCSA-N 468.388 0.130 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n(C)n1 1804923351 AVCGNUPTUKQWBS-UTKZUKDTSA-N 463.303 0.137 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc(O)n3c2CCCC3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359738 DFHUNVYYMWQBEN-PGRDOPGGSA-N 489.341 0.633 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807365818 PKGJOADZWSHOSM-GOEBONIOSA-N 497.210 0.436 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374505 LAHXQXWKAIQPBQ-FHJLPGHOSA-N 473.342 0.609 50 20 JCGD O=C(CC(F)(F)C(=O)O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808288437 ZEBWRLGDVUTBMK-CRAIPNDOSA-N 461.230 0.191 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1808714855 HYNWVUCWQLBUOY-ICSRJNTNSA-N 462.319 0.567 50 20 JCGD Cc1nc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c(=O)[nH]c1C 1810300315 XIWUQEGAYSTFJK-OXQOHEQNSA-N 490.524 0.414 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302166 HKIUKPZGRSACPE-ZTQAJYAQSA-N 467.530 0.267 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810305354 KHSFENKVLAVBFL-SNRMKQJTSA-N 472.571 0.514 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnc(N(C)C)o2)[C@@H]1c1cccnc1 1813069771 BPCIIFAYXKHLFV-OXQOHEQNSA-N 457.535 0.828 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cn2cccc([N+](=O)[O-])c2=O)[C@@H]1c1cccnc1 1813073569 JSBQOFMHFQMDOL-HTAPYJJXSA-N 499.528 0.231 50 20 JCGD NC[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccc1 1815159729 JMUSXUASVLOANM-MSOLQXFVSA-N 464.356 0.791 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1nc(O)n3c1CCCC3)CC2)c1ccc(B(O)O)cc1 1815344403 XRHDXVMQTCHTTR-CQSZACIVSA-N 481.343 0.601 50 20 JCGD CN1CCCn2nc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)cc2C1 1815348191 INKMCTRHVLMSJM-MRXNPFEDSA-N 494.386 0.395 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1)c1cccc(B(O)O)c1 1817476465 IGIFWLCAGUYZNY-LJQANCHMSA-N 473.302 0.681 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnncc2C(=O)O)n[nH]1 1819764256 ZLPUVKPOAZIMMY-OAHLLOKOSA-N 458.479 0.577 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1820107154 LJNKTNIQFUBOQY-IUODEOHRSA-N 458.349 0.354 50 20 JCGD O=C(CN1C(=O)CSC1=S)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1823497948 JDQZXTRDXMQKIJ-OAHLLOKOSA-N 487.372 0.256 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2 1825447500 YXWYMHBANKUFRG-SFYZADRCSA-N 481.336 0.668 50 20 JCGD COCCOCCOCCC(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826089676 LEGBQCIITLLQQY-HNNXBMFYSA-N 485.607 0.498 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827054626 HWLZGQKCTCQQEU-LJQANCHMSA-N 450.366 0.034 50 20 JCGD CC(C)(CCl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](N)CN)C2)C1 1828517444 BFXJXIONOBXWMA-FDDCHVKYSA-N 480.009 0.990 50 20 JCGD O=C([C@H](O)CCl)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828548268 HIESADYMRHBRJH-LZJOCLMNSA-N 488.368 0.638 50 20 JCGD CN1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCN3C(=O)OCc2ccccc2)C1 1828551889 XDPMIQPUKTXXPE-WMZHIEFXSA-N 478.977 0.600 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1830454816 HGJZXKOZQLYKST-KOSHJBKYSA-N 476.574 0.628 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1830534880 DLRXYMHOQFYGOB-SGTLLEGYSA-N 471.308 0.276 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c12 1830734970 BNXZSMYMXQDIFL-IIBYNOLFSA-N 451.907 0.846 50 20 JCGD 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496.008 0.806 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1839667929 QFECHGLEJGCHHH-ONGXBYRLSA-N 487.384 0.893 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)Cc1ccccc1)CCO2 1839959660 RBNXICBZOCJMFA-SIKLNZKXSA-N 450.608 0.898 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)[C@@H]2C1 1840009533 KLVIZHJXKLXVRX-CKOFKNITSA-N 487.981 0.155 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1 1840034106 AGPBQZBJJPBLNS-PIGZYNQJSA-N 470.349 0.940 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(C)c3C(F)(F)F)C2)C1 1840150825 QZJBRJBEZIZEHP-GUYCJALGSA-N 468.860 0.763 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)cc(C(N)=O)cc3C)C2)C1 1840153540 SCZBMUYJCBNYQQ-VGSWGCGISA-N 467.950 0.726 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(=C/c3ccco3)NC(C)=O)C2)C1 1840155214 SUKXSFIURYDBPE-UTQAEQOYSA-N 469.922 0.467 50 20 JCGD 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NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(C(=O)Nc2ccccc2)CC1 1847839021 GMEFXKIDIJLZLE-OALUTQOASA-N 462.510 0.919 50 20 JCGD O=C(CCNC(=O)c1ccco1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 25166528 PIVBLJYKGKUKEL-UHFFFAOYSA-N 478.527 0.201 50 20 JCGD CC(C)Cn1c(=O)[nH]c(=O)c2c(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc(C(C)C)nc21 105874334 KFONNCKQVHIKTR-UHFFFAOYSA-N 491.512 0.915 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(CC(=O)Nc2ccccc2Cl)CC1 725871954 JCGLAVZXRCHIHY-UHFFFAOYSA-N 462.894 0.660 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)Cc1ccccc1F 731344641 XUSKWYORQKNDTQ-RNUYOQPASA-N 497.570 0.909 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)NC(C)C 744446960 QIOUWBLSSBEMJH-KRWDZBQOSA-N 466.585 0.912 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1 748466834 NAAOCBAAKNMSCN-UHFFFAOYSA-N 456.503 0.538 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)C1(C(=O)NC3CC3)CC1)N(S(C)(=O)=O)CC2 749721469 XLKBWOBZMDUATP-INIZCTEOSA-N 494.570 0.159 50 20 JCGD COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1S(=O)(=O)NC1CCCC1 751207375 WSMKMAVOHDCLKW-UHFFFAOYSA-N 464.500 0.700 50 20 JCGD COc1ccc(C(=O)NNC(=O)C[C@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)cn1 761416150 OFBCIVHECNGUDM-INIZCTEOSA-N 478.527 0.818 50 20 JCGD CCOc1ccc(-n2ncc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)c2C)nn1 818184258 KOMYUBIDPIOPTJ-UHFFFAOYSA-N 459.488 0.681 50 20 JCGD CCn1nc(C(=O)NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)c2ccccc2c1=O 916722566 PGGYTNMMJWLVBZ-UHFFFAOYSA-N 476.497 0.569 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(=O)N(C)Cc2ccccc2)cc1 918090588 NASHCRXQVNJXGZ-UHFFFAOYSA-N 461.544 0.605 50 20 JCGD O=C(NC1(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1)OCc1ccccc1 1778278029 MVVJDLTWIAEMAW-UWJYYQICSA-N 465.934 0.875 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc4cc(F)c(F)cc4[nH]3)C2)C1 1778402097 SXTUIHQGKDJZOE-QHCPKHFHSA-N 469.253 0.883 50 20 JCGD CN1Cc2ccccc2C[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028586 NBPYRKIMWSYZHX-OFVILXPXSA-N 478.553 0.185 50 20 JCGD CC(C)(C)OC(=O)CCCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029762 YHQXEFZOBYDYLY-QHCPKHFHSA-N 475.546 0.641 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)C2)C1 1779045509 FZJLAVVARLHDHF-WHLIWEHUSA-N 464.352 0.698 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1779204224 VPOBKROJYPPJSY-QQHRNGFRSA-N 454.293 0.255 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(Br)CC1)C2 1779374655 WIYCKEJCDBPNKA-DNVCBOLYSA-N 480.363 0.740 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)csc2n(C)c1=O 1780924856 WDXGAVONMRFXKP-AUUYWEPGSA-N 472.926 0.206 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1782553038 GNIMQPADDMKAHT-AUSIDOKSSA-N 462.595 0.466 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3cc(C)c(O)nc3=O)CCO2)C1 1783354785 WORNWGJWGHPMFH-SCLBCKFNSA-N 457.325 0.261 50 20 JCGD COc1cccc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1783412403 KIDGOGDPNBBRCF-QQHIZMLBSA-N 465.510 0.851 50 20 JCGD CC(=O)C[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783829801 YEYZTFPISJZFTB-UUOWRZLLSA-N 473.574 0.778 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1)CCO2 1783882244 WWGMKJPEXUXRAO-JHVJFLLYSA-N 475.970 0.754 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1 1783966277 CIKRCUYGRCTPTF-KFFAWSGCSA-N 477.352 0.492 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)C1CCN(c2ccccc2)CC1 1784015647 KYCCWNNRQVJDKS-TUSQITKMSA-N 491.397 0.876 50 20 JCGD COC(=O)CSCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1784511890 AGQXZCXZUSBRSD-GLYSVQQSSA-N 479.559 0.006 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCOCC4)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786983556 XHEHNIXNCHJJSU-OYDLWJJNSA-N 493.369 0.110 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnc4ccccn34)C[C@@H]21 1788607908 UOZFFOQYJBSYEO-YSSFQJQWSA-N 477.525 0.169 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610162 NEFJNFYMLDNBNE-XERREHJYSA-N 483.573 0.932 50 20 JCGD Cc1cccnc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611615 MPNJNINAHLSTOX-LRQRDZAKSA-N 466.542 0.615 50 20 JCGD C[C@@H]1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)O1 1789726679 MPJFWJPWNZVQNS-KHSAKVFQSA-N 487.601 0.880 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ncc[nH]3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726876 YWEJFAMMTJEACL-ACRUOGEOSA-N 497.600 0.668 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(N4C(=O)C=CC4=O)cc3)[C@H]2C1 1792071606 BIVSUBADJFKFFC-WNHJNPCNSA-N 475.929 0.963 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc(Br)nn3c1)C2)[C@H](O)CCl 1792976726 LLBZEFBLFQDXNU-GFQSEFKGSA-N 472.727 0.295 50 20 JCGD CC(C)c1nn2ccccc2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1796082776 KCMGIXKUHBRKND-FEJSZKPUSA-N 476.342 0.655 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)C2 1797751509 BRNVLMYZDVALBL-ONRLFPQESA-N 479.562 0.776 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cncnc1)C2 1798522681 MAUTZYYIIVZOPP-VPTLXERWSA-N 469.454 0.756 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(C)(C)C(=O)OC(C)(C)C 1799042311 PCAITZQIOYUBCP-CWPLJXCYSA-N 468.595 0.707 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc(Cl)cc1[N+](=O)[O-] 1799765119 ONSHJGCKSVCTSV-YVWYUNDQSA-N 487.705 0.753 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2 1801287190 RIRCOIUOBVUEQR-IQWHIPCCSA-N 460.362 0.283 50 20 JCGD Cc1ccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)s1 1801328441 LXKCPQMKLSLEKF-QKBRYTTJSA-N 455.540 0.972 50 20 JCGD C/C(=C\c1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801353358 HUKYRSLZGUUDMZ-KWEICLLLSA-N 450.499 0.387 50 20 JCGD CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1801786699 GYZKLWIHRAFPPN-CWPLJXCYSA-N 466.498 0.161 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C2 1802128096 NBLUQBVXCWIQHQ-QEOTZNIISA-N 457.955 0.746 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1802134159 LIMYQJQRYQAVIX-ZXPKRNLXSA-N 457.955 0.574 50 20 JCGD CC(=O)NCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1803720317 OCMMRMCFBCQUDI-RXVVDRJESA-N 460.579 0.623 50 20 JCGD O=C(CN1C(=O)CNC1=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1 1804094860 VESNUXRYUZHTOZ-TUKIKUTGSA-N 456.272 0.330 50 20 JCGD COc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1804396243 BYSSYNNZWLQASJ-YADARESESA-N 474.326 0.727 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cncn1-c1ccncc1 1805105937 ZPMDXFIMLCGAMB-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807366089 SCOBOTUGZXZPID-YJBOKZPZSA-N 466.332 0.288 50 20 JCGD Cc1noc(C)c1CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807369217 CIHKCODTTNKGLH-XXBNENTESA-N 462.315 0.929 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1 1808278395 KGXFFZUIFQIAKL-WMIURUSNSA-N 492.496 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1 1808285426 BOKGIKXOMNRFPM-GUYCJALGSA-N 476.440 0.510 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1808451135 ZRNMEJCFHPFIOL-UWJYYQICSA-N 480.525 0.909 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CCN3CCOCC3)C2)CC1 1809588361 VQISTKUDRKSEGV-UHFFFAOYSA-N 458.563 0.252 50 20 JCGD N[C@@H](CC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)c1cccnc1 1809967241 ZKLWEOOEBQVJPG-NRFANRHFSA-N 450.348 0.696 50 20 JCGD Cn1ccc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810303697 UUTXJIZLSKOLJU-KKSFZXQISA-N 462.514 0.376 50 20 JCGD CN1CCCn2nc(C(=O)NC[C@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@H]3c3cccnc3)cc2C1 1812287668 JWKIPJUYTTZFOM-DVECYGJZSA-N 496.616 0.806 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)C(=O)C(=O)O 1812390579 ZNRAQPNRXQKQPW-CJNGLKHVSA-N 455.309 0.415 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1812810790 OZVPCBONURMTML-WIYYLYMNSA-N 482.346 0.606 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)n[nH]1 1815799987 VNQRXLBIUWGXQX-TZMCWYRMSA-N 490.952 0.867 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnn3ccncc23)[nH]n1)c1ccc(B(O)O)cc1 1817471594 JVXSQSHVAPWYIT-GOSISDBHSA-N 459.275 0.752 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)COC(=O)C(F)(F)F)sc2C1 1819616376 PXVZDAVCNMPPSM-VIFPVBQESA-N 465.454 0.534 50 20 JCGD CCn1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819795543 OADPBABNJPCWQL-NSHDSACASA-N 454.516 0.898 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1820141743 KBNOIMZKWZJWNF-RWIVRHQRSA-N 471.543 0.880 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cncc(S(C)(=O)=O)c2)[nH]n1 1822410438 JQRAKLJPLCNSJP-KRWDZBQOSA-N 491.574 0.887 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1 1822417965 SWUSSQUORLBVLU-ZDUSSCGKSA-N 481.604 0.635 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCSCC1)CC2 1826080967 JUZTZNVYJFIBAT-ZDUSSCGKSA-N 454.622 0.477 50 20 JCGD C[C@@](O)(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)C(F)(F)F 1827055590 DZISWDGJXCYNAH-FXAWDEMLSA-N 456.270 0.913 50 20 JCGD Cc1cc2nnc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)CC3)c(C)n2n1 1827059724 UJVVFOVTTRSSDI-NRFANRHFSA-N 490.373 0.968 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060210 SJSHTHHRUORUFY-FCHUYYIVSA-N 457.380 0.905 50 20 JCGD O=C(Cn1cnnn1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829056779 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CN[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1)C(=O)O 1834741658 BQCSDSLXTVVLFF-HNAYVOBHSA-N 451.395 0.857 50 20 JCGD CN(C)c1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834801080 KAJXMJJVAGTMRE-UHFFFAOYSA-N 478.402 0.931 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4cnccc4[nH]3)CC2)CC1)c1cccc(B(O)O)c1 1834801101 LSLGWRVEVACHSJ-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c(=O)[nH]c1C 1834819363 OIRMEZVALSSIGT-SFHVURJKSA-N 457.325 0.242 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835118055 LXBATSIADDWASA-GTPWMTBTSA-N 480.997 0.946 50 20 JCGD C[C@@H](CN)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835520471 HFKBISLDIMQGSI-AUSJPIAWSA-N 462.975 0.170 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc2ncsc2[nH]1 1835850338 IKVYEXOMFBLJGA-UHFFFAOYSA-N 481.387 0.803 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1nn[nH]c1C(F)(F)F 1836175888 QKIXLNVTKLXVKK-LBPRGKRZSA-N 452.865 0.608 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1837117718 QFXSVEFOMNDJJS-LSDHHAIUSA-N 473.368 0.757 50 20 JCGD CC(C)(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837456997 VGKLTMJMFIWCOE-RUZDIDTESA-N 496.568 0.761 50 20 JCGD CCC[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1cccc1 1837457620 LFTCKDLATAYNHI-GBXCKJPGSA-N 484.557 0.598 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1 1837459976 PZNGGGIYWKRRLX-QFIPXVFZSA-N 491.907 0.861 50 20 JCGD Cc1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919364 JFWWHEUMACHENQ-UHFFFAOYSA-N 451.332 0.996 50 20 JCGD O=C(CC[C@@H]1CCOC1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920772 DHXPWWARDKNQTQ-GOSISDBHSA-N 458.364 0.795 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1839144970 PNOXHKVGBBJIPG-QFBILLFUSA-N 466.000 0.132 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 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CN(CC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)c2)C1)NC(=O)NCc1ccccc1 1843250336 MHNIYLNZARYRNQ-UHFFFAOYSA-N 468.514 0.656 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)COc1ccc(O)nn1)C2 1844693283 PCTDVJOPWDUWGJ-UHFFFAOYSA-N 471.426 0.912 50 20 JCGD COc1cc(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(OC)c1OC 104535188 RCTFWTQXARVNDE-SFHVURJKSA-N 460.439 0.786 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)CNC(=O)c1ccco1 725739680 LZCITENQJSTPCN-CYBMUJFWSA-N 472.520 0.396 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNC(=O)Cc2cccnc2)c([N+](=O)[O-])c1 728850899 GGBZTQUGOZTGFE-UHFFFAOYSA-N 465.488 0.789 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)Cc2c(C)nc3cc(O)nn3c2C)cc1OC 729288693 UAXOSYOZCBLOGR-UHFFFAOYSA-N 457.443 0.616 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2c(C)nc3[nH]n(C)c(=O)c3c2C)cc1 729511806 UYOKMBUEPIRQRA-UHFFFAOYSA-N 488.570 0.588 50 20 JCGD COC1CCN(C(C)(C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1 730907784 LEPRQUNPUCQZJS-UHFFFAOYSA-N 455.581 0.770 50 20 JCGD NS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccs2)sc1Br 744686550 HGOPGIPUYRCYNU-UHFFFAOYSA-N 468.332 0.838 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cn1cccn1)c(=O)n2Cc1ccccc1 842479410 NSRFXGQEHFWFQB-UHFFFAOYSA-N 478.513 0.108 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1 912920238 ZQRPYRQRFHHCEF-INMHGKMJSA-N 490.623 0.872 50 20 JCGD NC(=O)c1cn(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c2ccccc12 917393806 WLSXYIDLFNGUIA-UHFFFAOYSA-N 469.523 0.986 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)N(C)c2ccccc21 920431414 ZPDLQBWVWYYXCE-QGZVFWFLSA-N 471.583 0.988 50 20 JCGD Cc1cc(/C=C(/C#N)C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c(C)n1C[C@H]1CCCO1 921165418 IEBJNJNJPCEWGV-OKPNHQCWSA-N 463.604 0.884 50 20 JCGD CN(C)N(C(=O)c1cn(C2CCN(C(=O)OC(C)(C)C)CC2)nn1)[C@H]1CCS(=O)(=O)C1 1324510798 GVMXACRJGKAXDG-HNNXBMFYSA-N 456.569 0.956 50 20 JCGD C[C@@H]1CCc2c(C(=O)N3CC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)n[nH]c21 1777849274 DVFBHLDWFPULBL-MCMMXHMISA-N 453.503 0.215 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc2c1OCCO2 1779030775 XDMPPNOMRUAKCM-DEOSSOPVSA-N 481.509 0.522 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Cn3cncn3)C2)C1 1779221049 MJJLBDKGQNGSPJ-NYHFZMIOSA-N 486.485 0.891 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374677 BZICLNKBILZFHW-IOHHAYIISA-N 468.352 0.596 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccnc(Br)c3)C2)C1 1779400520 VHWGXPKGKLTTMW-FQEVSTJZSA-N 474.120 0.281 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(Cl)ccn1 1779643941 QOBAZEZFYZBVOC-DENIHFKCSA-N 457.723 0.856 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]nc2C)C1 1780145032 PTGXUAJFFGCVQM-VWCSSDMBSA-N 455.519 0.980 50 20 JCGD CC(=O)C[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968573 NVFIATJKRVBMQO-UUOWRZLLSA-N 473.574 0.778 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4nccn34)C2)C1 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O=C(c1cnc2c(c1)CCNCC2)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809979948 GHKRENMIBUFCME-UHFFFAOYSA-N 476.386 0.608 50 20 JCGD Cc1cc(NC(=O)CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)no1 1818093393 CCYDYOORQYIACW-KRWDZBQOSA-N 480.290 0.721 50 20 JCGD Cc1nnc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)o1 1819796704 ARGLVSWCYOTVGL-SNVBAGLBSA-N 456.488 0.302 50 20 JCGD C[C@@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1 1820868462 JAYYLIYDUSQMKC-KBXCAEBGSA-N 450.367 0.925 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1820954792 QTWGDLXZOCAGLA-CVEARBPZSA-N 454.491 0.335 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)CC1 1822413367 SWDKULLWOIABCD-SFHVURJKSA-N 462.599 0.412 50 20 JCGD C[C@](O)(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)C(F)(F)F 1824832188 WXCQHKIZMIPSMJ-XLIONFOSSA-N 456.270 0.913 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN)CCN2C(=O)OCc2ccccc2)C1 1828961286 NEOGPQBKETTYRT-DYESRHJHSA-N 452.939 0.651 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1830353235 WENMQJPOOWUVDS-VUMVONDWSA-N 496.004 0.887 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1 1830539243 FNFCRLHGUNKWMV-FWQQEFPFSA-N 459.385 0.946 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2N1 1830735052 CLOPQMFBAHHDDX-UWJYYQICSA-N 451.907 0.241 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873405 IXCFUVCHKSVPDP-SJLPKXTDSA-N 452.600 0.687 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(C(F)F)c1)CCO2 1833318991 JALQTXHBWURGCG-JOCHJYFZSA-N 475.257 0.083 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)n1 1833765030 OUERONBILXWRTB-LRULAXNGSA-N 484.513 0.294 50 20 JCGD Cc1ccccc1OCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834533561 CIMCJAKHPIJTFV-UHFFFAOYSA-N 479.386 0.939 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1 1834543951 TWYFIWPUHHTLIN-FQEVSTJZSA-N 486.034 0.940 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](N)c3ccccn3)CC2)CC1 1835118313 NMIYGHSPAHNPTO-ZUXQIOPWSA-N 494.600 0.787 50 20 JCGD CN1CCN(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CC1 1835482732 OOEJHBOSUDRNJG-GOSISDBHSA-N 462.408 0.496 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc4nncn4c3)CC2)CC1 1835585536 TWONSELJYVEAOE-UHFFFAOYSA-N 470.578 0.288 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737833 FYQSDIXZTUBAFZ-INIZCTEOSA-N 487.605 0.175 50 20 JCGD CCSc1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934198 PIGJYSGQVNZZIY-HSZRJFAPSA-N 485.371 0.257 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4sccc4[nH]3)C2)C1 1835937184 RIXVCJASWOYIBM-JOCHJYFZSA-N 469.328 0.293 50 20 JCGD COc1ccccc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836234680 IIRYZVZIGLXFIP-UHFFFAOYSA-N 465.359 0.874 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1 1836413764 OTWQUTLICAVXAO-SWLSCSKDSA-N 470.405 0.929 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1 1837458984 GZIPJRDXPGDJQY-NRFANRHFSA-N 474.905 0.117 50 20 JCGD Cc1noc(CC(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1837951257 MYEOTHKSULTDKJ-UHFFFAOYSA-N 450.540 0.292 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)nc3)CCO2)C1 1838645552 KASCHPIZWARWKW-AOMKIAJQSA-N 498.964 0.989 50 20 JCGD Cc1cc(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1838947136 YPFDIBJRQYOKBR-XMMPIXPASA-N 452.316 0.367 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCOCCOCCOC)C2)C1 1839148847 LVHFXXIAIJTLDW-XLIONFOSSA-N 450.960 0.530 50 20 JCGD O=C(c1cc2n(n1)CCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200486 IHLFJPWDMRSIJE-YJBOKZPZSA-N 459.316 0.980 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201171 YNHGJKDCPOPPHB-FBXRYMRHSA-N 466.304 0.662 50 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458.559 0.548 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CNCP(=O)(O)O)C2 1841924524 WFUWMISXADKMLS-LBPRGKRZSA-N 468.875 0.047 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1 10149998 VCVTZVYLWRXMBT-UHFFFAOYSA-N 479.486 0.773 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1 16231268 LEHHZJLJTCYITA-AWEZNQCLSA-N 488.526 0.400 50 20 JCGD O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 23697149 TWKHKILYLYJYRB-SNVBAGLBSA-N 457.306 0.131 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)cn2C)c2ccccc2c1=O 26791205 AADQBQIKBPOMRS-UHFFFAOYSA-N 460.516 0.647 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)CNC(=O)c1cccs1 725740063 AUQQYRATEXGZHM-CYBMUJFWSA-N 488.588 0.865 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCCCCC#N)N(S(C)(=O)=O)CC2 729056616 KQSULUINLBVPIE-INIZCTEOSA-N 467.548 0.977 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)cc1 729275731 QZEQHVITMKEFFS-CQSZACIVSA-N 468.557 0.519 50 20 JCGD O=C(NCCCN1C(=O)CNC1=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1 731117868 LBEPRGRWJHQCTR-HXUWFJFHSA-N 464.526 0.886 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)[C@H]2c3ccccc3C(=O)N2C2CC2)c1 744322468 YLTJRLZAZPILIN-LJQANCHMSA-N 470.507 0.327 50 20 JCGD CC(C)[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1C(=O)c2ccccc2C1=O 748098319 XXCOLIKPHUQMCE-ICSRJNTNSA-N 481.461 0.838 50 20 JCGD CCOc1ccc(C(=O)NCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 802303332 DWYQJLLEWWICAZ-GOSISDBHSA-N 457.439 0.346 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)C[C@@H](C)O1 912920171 XIGGIWDAXITUJS-CALCHBBNSA-N 452.577 0.734 50 20 JCGD O=C(COC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)NNC(=O)c1cccs1 914945133 VLHWTGODZKEOKC-UHFFFAOYSA-N 452.514 0.548 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)cc2)cc1 915184985 QNNDWXJKPQCETP-UHFFFAOYSA-N 471.513 0.089 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)NCC(=O)N(C)C)cc2)cc1 915912910 BZMJBTIGHLIDDG-UHFFFAOYSA-N 461.544 0.848 50 20 JCGD O=C(NNS(=O)(=O)c1ccc2nc(O)oc2c1)c1cccc(S(=O)(=O)N2CCCC2)c1 916644171 VLYDMUOPGXOXFK-UHFFFAOYSA-N 466.497 0.941 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1)N[C@@H]1CCS(=O)(=O)C1 919885565 MAACTTXYVIRHBF-CYBMUJFWSA-N 470.504 0.758 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCCN2C(=O)Cc2ccccc2)cc1 920285154 LYAUOUUPZRNLEL-FQEVSTJZSA-N 472.567 0.997 50 20 JCGD CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)s1 1115872245 DWIVFYPUHBJMGK-JTQLQIEISA-N 459.575 0.862 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Cn1cncn1)C2 1778091236 RNFGTVKLVAXIGW-NZWQFLGHSA-N 484.561 0.562 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2c1 1778503157 PIIJWHYOHCVBPY-DEOSSOPVSA-N 463.299 0.614 50 20 JCGD O=C(C#CC1(O)CCCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779395344 WGQGPKNTRQPYCP-ZJSXRUAMSA-N 468.359 0.193 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccc(F)cc1 1780914300 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O=C(/C=C/c1cnccn1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813483808 XANXVOVBDLOVRJ-WMEGFXLRSA-N 457.299 0.584 50 20 JCGD O=C(CC(F)(F)C(=O)O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815341249 URPVZDGROGVDNT-LLVKDONJSA-N 453.232 0.159 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(Cl)ncn1)CC2)c1ccc(B(O)O)cc1 1815344102 HZQJQEIUETXZEJ-GFCCVEGCSA-N 457.708 0.806 50 20 JCGD O=C(/C=N/N1CCCCC1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344233 OXXAAMIFWQXAHN-OHHQFBAHSA-N 455.349 0.520 50 20 JCGD COc1nccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1F 1815818972 IGCDCWKQEDUWHK-CYBMUJFWSA-N 470.291 0.905 50 20 JCGD Cc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c(=O)[nH]c1C 1816112306 AOSPDWKMYWVEHA-QGZVFWFLSA-N 464.291 0.409 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)n(C)c1=O 1817118152 UEAHZEGUWJORND-SDBXPKJASA-N 483.913 0.037 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C3CCN(S(C)(=O)=O)CC3)sc2C1 1818644342 ZKAZTWZKBNEGJD-OLZOCXBDSA-N 479.024 0.981 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1819837575 XYNTVHDBMUVJAC-STQMWFEESA-N 460.564 0.719 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cnn4c3CCC4)sc2C1)c1cccc(B(O)O)c1 1824043337 AKMAWFWJNCTMKM-AWEZNQCLSA-N 451.317 0.505 50 20 JCGD CN1CCCn2nc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC4)cc2C1 1824385771 YMJLCIUKKKAGBE-AWEZNQCLSA-N 488.618 0.774 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@@H](F)Cl)CC2)n(C)c1=O 1825105629 WBDPCNWLHRRDER-WMLDXEAASA-N 482.944 0.588 50 20 JCGD O=C(c1cn2cccnc2n1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052040 MXDOUAYVOXTHBS-NRFANRHFSA-N 461.331 0.956 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057502 GLBHFHBEUICJIM-UTKZUKDTSA-N 457.380 0.905 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cnc3ncccn23)CC1 1828248023 MOFHLVPNUOXLCS-HXUWFJFHSA-N 461.331 0.956 50 20 JCGD O=C(Cn1ccnn1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551098 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O=C(NCC(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)c1cccnc1 1834819482 OZMRVMVELONVRH-LJQANCHMSA-N 469.336 0.053 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1 1835171821 COQVPHZCQOFZGO-IIBYNOLFSA-N 454.907 0.668 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cnn2ccccc12 1835307514 JEAZYSUUHMEGMF-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD CC(=O)O[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)C(C)C 1835737836 GDRZOBDUWJECHO-NRFANRHFSA-N 488.589 0.458 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1 1835840205 FXBDLEJEESNAJN-KBXCAEBGSA-N 475.428 0.740 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C2)C1 1835931949 IRWBOYQNNAJBEQ-XMMPIXPASA-N 498.772 0.822 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933927 HAGOBIIBABGBRT-HSZRJFAPSA-N 492.259 0.096 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc4ncsc34)C2)C1 1835936912 JOWPOSMLFCDSPA-HSZRJFAPSA-N 481.339 0.360 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)C1 1836712296 RRFASRWFWQUJOP-RTBURBONSA-N 486.374 0.568 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837219403 INIZHPRPZAHPOV-GOSISDBHSA-N 468.363 0.511 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2 1837297657 YCQQNASTKRWKPX-VHKYSDTDSA-N 482.331 0.961 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(F)cccc3F)C2)C1 1837460105 VEPSIVBMVQOVOZ-HSZRJFAPSA-N 489.479 0.276 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](COC(C)=O)OC(C)=O)CCO2 1837497290 UDQVFKJBRFWLCV-SQGPQFPESA-N 462.927 0.345 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnc4[nH]ncc4c3)CC2)CC1 1838304801 OPOUOZAVPMVHFE-UHFFFAOYSA-N 492.540 0.882 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C3CCCC3)C2)C1)NC(=O)NCc1ccccc1 1839054422 YKNZGKDPGXWXFV-RUZDIDTESA-N 487.601 0.979 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1839147395 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O=C(CCn1cc([N+](=O)[O-])cn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 919818932 XOFJQHKEFXHCBX-UHFFFAOYSA-N 450.477 0.817 50 20 JCGD O=C(CCNC(=O)c1cc(F)ccc1Br)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919885746 NKAZUXVGJBMVSS-SNVBAGLBSA-N 465.301 0.226 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccccc2Br)C1)N[C@@H]1CCS(=O)(=O)C1 919885978 OPIUVNDSKHJCGC-GHMZBOCLSA-N 459.322 0.320 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c1C 920290681 NITNQHZYCJXGME-LICWHBFXSA-N 450.561 0.981 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1 920827156 VJNAVKDKWDCOLW-UHFFFAOYSA-N 480.543 0.018 50 20 JCGD COc1ccc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)[nH]c2c1 1777769611 MXNFUJWFSHATOZ-DEOSSOPVSA-N 478.509 0.932 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@](C)(O)CC(=O)O)C2 1778095137 UOSZUZVOBVEWFR-AJHDLPATSA-N 491.545 0.250 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1778103003 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C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936133 RQCUPCTWLOZBGS-LLJLJFOGSA-N 495.621 0.692 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784084287 PJGMMFNGOOMNJZ-SRQBIAJPSA-N 473.954 0.144 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3cccn3)[C@H]2C1 1785439395 XQTRKBUNUSOWBK-VDTQALLHSA-N 469.546 0.633 50 20 JCGD CC(C)(C)n1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)n1 1785703405 YGSUNXNKLNBGEX-FNHZYXHNSA-N 469.546 0.544 50 20 JCGD O=C(CCN1C(=O)C=CC1=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1786553413 GYIOYOVVHPXBLC-UHFFFAOYSA-N 461.283 0.429 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1 1787450118 MHLOYGUHYITSFY-HAFSJTIUSA-N 479.933 0.957 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)n4ccnc4n3)C[C@@H]21 1787507937 ZTJUMQXUQNCJEN-DUYHWBDASA-N 492.540 0.765 50 20 JCGD C[C@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)n[nH]c21 1787950760 OQLFAMZZCGHWKB-BMIPRAEKSA-N 452.320 0.046 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2CO[C@@H](CNC(=O)[C@]3(F)CCCCC3(F)F)[C@H]2C1 1788172591 MYLUQQWXVGYRNC-QUJKESNLSA-N 468.281 0.877 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1OC 1788610017 LWJPPHDPGMEHRB-XERREHJYSA-N 483.525 0.609 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1788640511 UZOKKGBTTYSWPN-YHUYYLMFSA-N 463.325 0.246 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1 1788762469 WBRIDUDHFHSTQP-NXOAAHMSSA-N 473.643 0.703 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1 1788763700 POKDAGLIMIMEOB-QBYUYEEZSA-N 459.616 0.661 50 20 JCGD CCn1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)n1 1789724823 PDTAARWHCUYNSS-ONTIZHBOSA-N 497.600 0.843 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1789853493 MXLDEQYDYMPCKD-JONQDZQNSA-N 463.959 0.107 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21 1791057620 NFEIBMZNSXBUMR-QPSCCSFWSA-N 466.398 0.175 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1793086175 YGNLAVKBAUDVQQ-HLPPOEQASA-N 478.384 0.637 50 20 JCGD CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1Cl 1795905452 ZXUCMPKHSRNZQP-CULMDFNYSA-N 461.910 0.141 50 20 JCGD Cc1ncc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)s1 1797754456 YFZILRYBURZPRL-XCRGKXPMSA-N 456.528 0.367 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc[n+]([O-])c1)C2 1798522727 RPSJYAJARRJWAM-CWPLJXCYSA-N 470.438 0.671 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(O)nnc2O)cc1 1798599119 UJEUXKAEHMMKBM-OCVGTWLNSA-N 465.894 0.136 50 20 JCGD 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CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2)C1 1839147289 MICBTRQVGOBMMB-GCKMJXCFSA-N 477.986 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2 1839922247 OAMCUSPAGIZZNP-MRXNPFEDSA-N 480.736 0.125 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Cn3cncn3)C2)C1 1839964895 INLZTWPOORDIRF-RVKKMQEKSA-N 458.357 0.544 50 20 JCGD CC(C)[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1840106408 FWANFFHDUAFVTH-PNLZDCPESA-N 492.013 0.982 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(C(=O)OC)cc3)C2)C1 1840156587 WNYHFXGUWWQFQH-AVRDEDQJSA-N 468.934 0.726 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4ncccc4c3)C2)C1 1840182518 LLEKRPIVEDZWLH-RUZDIDTESA-N 483.569 0.607 50 20 JCGD Cc1oc2cc(O)ccc2c1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184340 HNFWXVPPVKXTAW-XMMPIXPASA-N 488.541 0.890 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(F)cccc3F)C2)C1 1840184929 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CCn1c(=O)c2ccccc2n(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1=O 728209551 GCJVBCSEPRDZJK-UHFFFAOYSA-N 457.512 0.767 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NCC(C)C)cc2)n1 728723762 UTJLWIZKCRBTCN-UHFFFAOYSA-N 468.557 0.933 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)O[C@@H](C)C(=O)N2CCNC2=O)cc1 729621646 CGDVRJVXQWJUCG-HNDQUVLASA-N 480.481 0.825 50 20 JCGD CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 749174237 OHTGNUJBTNGXAD-RHSMWYFYSA-N 479.584 0.604 50 20 JCGD CC(=O)N1C[C@H](C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)Oc2ccccc21 751393820 VHLGAJWLPBGFOW-OAHLLOKOSA-N 452.876 0.563 50 20 JCGD C[C@H](O)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)c1cccs1 772937670 WUGMQLLAIXMDLV-ZUZCIYMTSA-N 475.932 0.434 50 20 JCGD C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O 874090908 IBVLEVXAVGWKNA-RCCFBDPRSA-N 456.547 0.727 50 20 JCGD Cc1cc(C)cc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1 913446114 NRBCTIBMSLJNMY-UHFFFAOYSA-N 463.512 0.969 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 914831221 GFRGFNKVQWWNME-OBJOEFQTSA-N 488.360 0.399 50 20 JCGD C[C@@H]1CCCN(CCNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 916452633 QIHZHCBPPQYYKL-GOSISDBHSA-N 481.619 0.702 50 20 JCGD CCOC(=O)NNC(=O)CSCC(=O)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1OC 916559901 JZRSDWZWQZLLLI-UHFFFAOYSA-N 490.560 0.165 50 20 JCGD CC(C)C(=O)Nc1nc(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cs1 917290763 VLIRCMJHZGCLBZ-HNNXBMFYSA-N 462.484 0.811 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)C[C@@H](C)O1 917362904 RFRITAKKBHBPNX-ZIFCJYIRSA-N 452.577 0.877 50 20 JCGD COc1ccc(CC(=O)NCc2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)cc1 918551329 SKPHUFBDKKQIBR-SFHVURJKSA-N 459.524 0.750 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H](C)OCC(C)C)c(=O)n2Cc1ccccc1 918755722 CXYUWVJJVHYMLQ-MRXNPFEDSA-N 470.530 0.636 50 20 JCGD N#Cc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779029224 OFNKKKBFBPEQAH-XMMPIXPASA-N 462.510 0.633 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2 1779375639 QJZQZNPTBIOMEF-QQQUVDROSA-N 481.557 0.341 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3ccncc3O)C2)C1)NC(=O)NCc1ccccc1 1779411174 PITBOVLVIOWKMA-XMMPIXPASA-N 482.541 0.577 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779517797 LDUBPUQPBSLAGO-TUVUNVSASA-N 474.562 0.117 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1780118047 YMQBEUJRHHGGJW-HSZRJFAPSA-N 482.302 0.098 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781334018 UIXABVDXHLCKLY-GLKRBJQHSA-N 454.293 0.350 50 20 JCGD COC(=O)N(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)Cc1ccccc1 1783691015 JHNVALLILFLEAE-VWLOTQADSA-N 495.341 0.079 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21 1784446582 YGZJLFKQNVFCLK-GGOFEBJYSA-N 458.408 0.530 50 20 JCGD NC(=O)CC[C@H](N)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)Cc3ccccc3)C[C@@H]21 1786804018 SQUMLTQHKSIRIU-VMXHOPILSA-N 495.418 0.565 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786983690 QOERAZVEQLKCGX-LFBFJMOVSA-N 491.397 0.624 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccnn3)[C@H]2C1 1787119110 LAZXBYLPNGNGMZ-VGWMRTNUSA-N 470.958 0.390 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)C3(O)CCC3)C[C@@H]21 1787507012 DWQQPZZHVLKBOK-ULLROFKNSA-N 459.547 0.651 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](N)c3cccc(Cl)c3)C[C@@H]21 1788610838 XQANZYDECLUNHT-DILOTOHQSA-N 486.960 0.632 50 20 JCGD CC[C@@H](C)[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724952 SSEWKHHJYRPSLQ-NSMXDQILSA-N 489.617 0.719 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791294024 ZQRUVJHACGMOJP-QOKNQOGYSA-N 477.518 0.575 50 20 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C[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1ccccc1 1835932012 KNNKUUOGJLOVSS-UQBPGWFLSA-N 466.343 0.630 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836679983 NEXSKRAGRHZPBC-SANMLTNESA-N 494.353 0.004 50 20 JCGD O=C([C@H](O)CCl)N1CCC(OC2CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1 1836717838 KFQHLBXNWKKXFS-FRQCXROJSA-N 455.983 0.986 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1836723705 PSYOMKCWTHVPKR-BTYIYWSLSA-N 475.970 0.300 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836780585 DOLPSQINXLLICJ-WOJBJXKFSA-N 488.372 0.323 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn3nccc3c1)CCO2 1837158380 DFGWLHATXNGYJO-VNSNFZHPSA-N 493.524 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)COC4)C2)C1 1837458816 DVANLTQANPFDJH-XMMPIXPASA-N 481.509 0.099 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1837711305 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COc1cc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)ccn1 1794165005 JAHKAOLPBHQRCT-BJWYYQGGSA-N 452.515 0.973 50 20 JCGD Cc1cnc(Cl)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1794968821 YNQKKFSDSDFUHG-FVCICTRLSA-N 458.906 0.559 50 20 JCGD O=C(Cc1ccc(C(F)(F)F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1795263922 QIBITQYIDWMYPL-UPHUGPLXSA-N 476.260 0.831 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(OC(F)F)cc1Cl)C2)c1cccc(B(O)O)c1 1795737219 GNVQRRYEIPTDCP-FVCICTRLSA-N 495.675 0.533 50 20 JCGD Cc1cc2nnc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)CBr)C4)c(C)n2n1 1796923860 OIDMYEHUPYWQHC-JAMKOXHTSA-N 465.352 0.975 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(N2CCN(C)CC2)CC1 1799190706 YUOURYZGQDAFBQ-NXOAAHMSSA-N 457.413 0.387 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799869145 IEUBTJNSCCSFNX-QLIIJSOBSA-N 458.563 0.495 50 20 JCGD N=C(N)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800434860 FYARJCPXAXXUAP-IVSAIRAKSA-N 452.353 0.065 50 20 JCGD COCCOCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br 1800760001 WNHMNFYRUBMDHO-BMFAXAFESA-N 495.411 0.446 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]13C[C@@H]1CN(C(=O)OC(C)(C)C)C3)C2 1801013213 XRMRAWVRGJEMKY-AGYLXNLDSA-N 493.605 0.206 50 20 JCGD CN1CCC(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1802644127 PTHXOAUYWXNFQJ-URXFXBBRSA-N 464.375 0.813 50 20 JCGD CN(C)c1cncc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1804849157 BVYZKJCKCGRCTP-WMZHIEFXSA-N 473.342 0.856 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1806038643 JTRJIMFQPAOLFD-LAUBAEHRSA-N 461.287 0.193 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CS(C)(=O)=O)[C@H]1c1cccnc1 1806765938 HIPLGNYUYOEVQU-VMGGIKTDSA-N 474.543 0.266 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807155001 GSQSUPRZGSUQIG-WGGBDISSSA-N 473.342 0.977 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2csc(N)n2)[C@@H]1c1cccnc1 1807231680 BNLMNRHQDCTSIY-DYVFJYSZSA-N 466.527 0.752 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(C)(C)C 1807359372 HYXBIEPGWBOYAU-CEMLEFRQSA-N 480.374 0.632 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)s1 1807371195 QWUHITQANDLFLN-UWJYYQICSA-N 465.344 0.484 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1 1808413445 AWBWAICMNCEVIK-KIKGRTIKSA-N 464.486 0.964 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1 1809743752 VSEYYBJYOWKZEV-JXFKEZNVSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(CO)on2)[C@H]1c1cccnc1 1811591294 ALPWYZNHOGJLGK-AUUYWEPGSA-N 465.470 0.194 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(Cl)nn1)CC2)c1ccc(B(O)O)cc1 1815344135 JYRYDJASXXQKJC-LBPRGKRZSA-N 457.708 0.806 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1COc3ccccc3O1)CC2)c1cccc(B(O)O)c1 1815350281 OAROAQDVVLRFAV-BEFAXECRSA-N 479.323 0.889 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1 1815672066 BFAVWFHLZSJPJP-SWLSCSKDSA-N 480.360 0.823 50 20 JCGD C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNCP(=O)(O)O)n[nH]1 1817235025 LLXVSFIGYBWSHH-KOLCDFICSA-N 452.246 0.910 50 20 JCGD COC(=O)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1 1818113744 VUCSEHBKEQDLKM-ZIFAQYRBSA-N 458.479 0.892 50 20 JCGD CC[S@](=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403632 XQMKKXYYSNSKTF-FTDQSSOUSA-N 461.548 0.873 50 20 JCGD Cn1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c1=O 1819793543 PQXNENGUMRUQSR-LLVKDONJSA-N 467.511 0.380 50 20 JCGD Cc1nccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819797259 RXYXLBVGXUFGHH-LLVKDONJSA-N 452.500 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCc3nc[nH]c3C1)CC2 1819801229 HAMXCEMNCOVDGW-RYUDHWBXSA-N 480.554 0.896 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2 1819837574 XYNTVHDBMUVJAC-QWHCGFSZSA-N 460.564 0.719 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)n1 1820087586 FJKFHYIVYJWVJB-YPMHNXCESA-N 453.952 0.955 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CCc3ccc(O)nn3)sc2C1 1824492115 YAITWTWYPPQWLK-ZDUSSCGKSA-N 461.548 0.557 50 20 JCGD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)[C@H]1SC(=N)NC1=O 1826086531 XQWQUCMRGZMKEM-AMJWSMQMSA-N 481.604 0.231 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCc3nc[nH]c3C1)CC2 1826092299 YGKUZSCYPFHKGJ-OLZOCXBDSA-N 459.576 0.956 50 20 JCGD Cc1nccn1[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1827030295 CKBYOKFUXWDSJN-MLGOLLRUSA-N 453.333 0.815 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828593268 ACZRIUOKXFWQMQ-UQNRQAKVSA-N 494.976 0.550 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)no1 1828988814 WFNFDVCMZYFPSI-LJQANCHMSA-N 476.578 0.706 50 20 JCGD CC[S@](=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830541377 ZORYNONRONKKMP-UVVOCLOQSA-N 453.399 0.633 50 20 JCGD O=C(CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)Nc1ccccc1 1830668267 SHLQGQGATUVFGX-AVRDEDQJSA-N 467.950 0.852 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccc1C 1830733299 HZVFHUHNPPBHKE-GHTZIAJQSA-N 453.923 0.623 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN(CCO)CCO)CC1 1831486968 SDLONERCAYEZQA-AFDYPQSWSA-N 490.605 0.027 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1831654390 KQPMTKRKUKFSDH-KKSFZXQISA-N 485.006 0.755 50 20 JCGD Cc1nn(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831867348 POFMRNRDKUURPD-HTAPYJJXSA-N 499.996 0.931 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccc(N(C)C)c3)CCO2)C1 1832531544 TYTHDDPYIORYDL-KNQAVFIVSA-N 469.966 0.842 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)cco3)C2)C1 1832549676 WYQIKUZISUXQSY-AOMKIAJQSA-N 499.948 0.842 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)no1 1833310446 IQCRDFJBKAGFSC-INIZCTEOSA-N 455.943 0.483 50 20 JCGD N[C@@H](CC(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)c1cccnc1 1834822480 PZAMNFUUCJDXKI-LPHOPBHVSA-N 455.353 0.713 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1 1835022395 ZMNKRDOXVCBGQF-FXZATJRASA-N 485.516 0.959 50 20 JCGD O=C(c1ccnc(C(F)(F)F)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929203 HNOFXVHIBZXXIX-NRFANRHFSA-N 493.247 0.164 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1 1835935525 JGINFPPDIHBYKY-IBGZPJMESA-N 470.253 0.169 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCCC3)CCO2 1836976356 LOKBVVKLUWRKGJ-OTZYPNAKSA-N 497.556 0.423 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3ccc(F)cc13)CCO2 1837042650 IGKZSSBYOGWUHE-QFIPXVFZSA-N 476.509 0.145 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CS[C@H]3CCCCO3)C2)C1 1837458754 AGESPRSKUWQKPW-UGKGYDQZSA-N 493.586 0.015 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1837710287 SUXWNAQGEIACEX-IVZQSRNASA-N 494.621 0.301 50 20 JCGD COc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838299711 PSUSIDRFBJPXNR-HXUWFJFHSA-N 454.549 0.200 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CNC(=O)OC(C)(C)C)CC2)CC1 1838768015 AOQVNEWKJCABLV-UHFFFAOYSA-N 483.610 0.883 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccon3)C2)C1)NC(=O)NCc1ccccc1 1839054392 WRHLRVQILRXZPG-HSZRJFAPSA-N 486.529 0.091 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)o1 1839201061 VKJWESANYOEGKK-PBHICJAKSA-N 462.272 0.999 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)(C1)C2 1840003397 NWSHWKZEFOKVDO-QNZNJHBPSA-N 487.981 0.490 50 20 JCGD C[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1840028267 SABHCZFTVSPOCK-RIFZZMRRSA-N 455.349 0.830 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1 1840494592 JCZSCJKJFRCUGF-IFXJQAMLSA-N 456.337 0.817 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(Cl)c1 1840694756 ZAIYUQGNCXVQEP-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CN2C(=O)COc3ccc(Cl)cc32)C1 1841856878 WUJMCCMUKTWJQG-UHFFFAOYSA-N 477.949 0.642 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C[C@H]2C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012309 AYAJEBCAJZBJPV-YADARESESA-N 483.374 0.831 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014955 UKGMHCOZTGJHKN-BXKMTCNYSA-N 469.347 0.583 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(S(=O)(=O)NC2CC2)ccc1Br 10214676 NDIVLYSGPMOQTP-VIFPVBQESA-N 480.362 0.086 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc2c(c1)OCCO2 17822270 AATBZRVELKZCAG-UHFFFAOYSA-N 475.523 0.873 50 20 JCGD O=C(CC[C@@H]1NC(=O)NC1=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 725908349 OILHTPYNCQSRGC-LBPRGKRZSA-N 451.486 0.298 50 20 JCGD Cc1oc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1S(=O)(=O)N1CCCC1 728846215 UZBBQWHHJVXVSS-UHFFFAOYSA-N 462.532 0.840 50 20 JCGD O=C(CNc1ccccc1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O 729513340 KTTQUKAVMYXDRD-MRXNPFEDSA-N 458.496 0.883 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)COc1ccccc1O 730779263 ZYTWMECNRCOGQM-OAHLLOKOSA-N 483.930 0.805 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(N2CCCS2(=O)=O)cc1 751230500 PEPGDLBIGONOEG-UHFFFAOYSA-N 451.530 0.594 50 20 JCGD O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cc(S(=O)(=O)N2CCCC2)ccc1O 806668662 TXPSYFFYZGLBEA-UHFFFAOYSA-N 457.468 0.900 50 20 JCGD O=C(COC(=O)c1cccc(NC(=O)[C@@H]2CCCO2)c1)NNC(=O)[C@@H]1COc2ccccc2O1 907762014 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C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1 1782217933 BIINMTHPVILJQM-BBEJJTJUSA-N 458.346 0.913 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)CCO2)C1 1783872508 ADHJDVQXZWMHAK-OPAMFIHVSA-N 479.965 0.105 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCc3noc(-c4ccccc4)n3)CCO2)C1 1783935857 XHKAZQWMDKUUNK-XMMPIXPASA-N 484.557 0.872 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3nnc(C)o3)C[C@@H]21 1787508773 JAEFYZDTZSNQLK-XUFZZIBESA-N 457.491 0.034 50 20 JCGD COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610797 VDYIHCHOLSSNSU-NDXORKPFSA-N 467.526 0.530 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnsn3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724621 CFBFBMQUNODWIL-LNLFQRSKSA-N 487.586 0.478 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726622 GMRQORGYARBHTK-HAGHYFMRSA-N 496.008 0.566 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCO3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726882 ZCBAWOLPHWUKLN-BURNTYAHSA-N 473.574 0.491 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1790175938 SYLIHZXDJPXLKP-QCQGSNGOSA-N 464.357 0.594 50 20 JCGD C[S@@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793105878 FMIZQYPJESPQBC-SJMNVYRFSA-N 480.027 0.886 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)c2C1 1793111613 RUTSEJQZNWEQLE-HLPPOEQASA-N 482.969 0.880 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1C(F)(F)F)C2)c1ccc(B(O)O)cc1 1795734790 QMIITZJGVLPUMW-UPHUGPLXSA-N 476.260 0.831 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccccc1Cl)C2)c1cccc(B(O)O)c1 1795737560 VMNFFXRDCRVHIZ-OPMZPASUSA-N 456.735 0.856 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)[C@H](O)C1 1796361770 TWQFEECYRAUFCE-AYCBFJCHSA-N 463.934 0.728 50 20 JCGD 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O=C(Cn1nnc2ccccc21)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804015518 CREIWJYCYAAFKY-CYFREDJKSA-N 484.325 0.526 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1 1804046548 AYSSLNUENKAOQD-XJKSGUPXSA-N 491.442 0.816 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807362620 LSUUATFITUBMPS-REWPJTCUSA-N 461.331 0.595 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(-n3ccnc3)ccn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376616 WOYIVUNWZPWJGD-YKSBVNFPSA-N 496.336 0.976 50 20 JCGD C[C@H](NC=O)C(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1808373362 SFGBWANISSNIGN-ZEYPLWLESA-N 495.584 0.568 50 20 JCGD Cc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c(=O)[nH]c1C 1816114445 XZONXGLUPVJRBY-INIZCTEOSA-N 479.501 0.728 50 20 JCGD CN(C)c1ncc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)o1 1816327432 GREHDYJJOJULSA-MRXNPFEDSA-N 452.280 0.763 50 20 JCGD O=C(CC(F)(F)C(=O)O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1817092177 ZHQPCOCOGGFOBD-LLVKDONJSA-N 453.232 0.159 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CC(F)(F)C(=O)O)n[nH]1 1818025580 CAZXSQOMMAIKQZ-ZDUSSCGKSA-N 465.417 0.824 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1822574299 DQMFSDXCNSRHBF-OAHLLOKOSA-N 488.375 0.962 50 20 JCGD O=C(c1cnc(O)nc1O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052972 QWQHCHUXYHDLCC-GOSISDBHSA-N 454.292 0.115 50 20 JCGD COC(=O)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828834610 KZXRQMHTLCMZPV-JPYJTQIMSA-N 495.960 0.991 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=CCN(C(=O)OC(C)(C)C)C3)CCO2)C1 1831141540 KDYSDJBWTBRNDW-VGOFRKELSA-N 487.981 0.874 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1831513350 VSMNOJIFAQBCMB-RWAHWCJQSA-N 493.513 0.997 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833312488 WBBVQYYDPLQFFJ-KXBFYZLASA-N 465.982 0.371 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)[nH]n1 1834798357 LIQRWBQHVKNIBK-UHFFFAOYSA-N 481.406 0.886 50 20 JCGD Cc1c(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc2ccccn12 1834798524 GMMWHZNGIVVLIN-UHFFFAOYSA-N 489.385 0.822 50 20 JCGD COc1cc(C(=O)N2CCC(N3CCC(NC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CC3)CC2)n(C)n1 1835118308 NBLNQOWTIYTBNF-JVWAILMASA-N 498.588 0.748 50 20 JCGD CC(=O)O[C@@H](C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)C(C)C 1835651548 WZXJVNRUTJNBIW-JOCHJYFZSA-N 467.611 0.519 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1835935652 XCWUPAXFSMHXAB-QFIPXVFZSA-N 473.722 0.107 50 20 JCGD CC1=CC[C@@H](C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1 1837458825 FEVLKQNAEVSCNU-HXOBKFHXSA-N 457.531 0.502 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccoc3Cl)C2)C1 1837459263 ALERHMVELADRIJ-FQEVSTJZSA-N 463.878 0.315 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)cc12 1837459476 RCJSZKJPHPTFIJ-VWLOTQADSA-N 492.536 0.859 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1cnccn1)CCO2 1837605551 BIBPOIRJGMDBTF-CKJXQJPGSA-N 467.954 0.459 50 20 JCGD CC(C)n1cnc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1838148228 HVKYXKAOWFCOAP-UHFFFAOYSA-N 484.561 0.784 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1839198450 DTGDPZQMKWFWDU-QPUJVOFHSA-N 483.184 0.489 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3ccnn13)CCO2 1839498311 PWYLDYSWONETRU-FXZATJRASA-N 493.524 0.538 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839677187 IFGJQMYHELVCJG-ONGMEVFLSA-N 490.605 0.555 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839935747 GUDMAPDJXZUXHB-DEOSSOPVSA-N 460.575 0.675 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1839964730 AZPGBIQKGJCWNX-IFXJQAMLSA-N 466.336 0.973 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CCO2 1840049520 SVHZCFWMFVZNRR-XATPPMESSA-N 473.530 0.144 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)nc1 1840182732 ROEGATYZEFZXKW-HSZRJFAPSA-N 461.563 0.152 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c[nH]c4ccccc34)C2)C1 1840185121 JMPRJHZLQJAKTP-XMMPIXPASA-N 471.558 0.540 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)CCO2)C1 1840772200 GIXGYIBHGVTCKY-FOIQADDNSA-N 492.953 0.553 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014817 FDLKGDRWEFNDMF-SFHVURJKSA-N 469.347 0.440 50 20 JCGD O=C([C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014965 VAKNYVGIEPEIPW-ZDUSSCGKSA-N 462.237 0.340 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCOCC3)n1)C2 1843416004 NDOFXRFADNGEGI-WPWMEQJKSA-N 479.541 0.869 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1846354522 XWEFQSGHHLZDQS-UHFFFAOYSA-N 480.326 0.864 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c1 725873849 RFFDMNOVKGREEF-UHFFFAOYSA-N 475.527 0.694 50 20 JCGD Nn1c(SCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnc1C1CCCCC1 728317724 BCKMOZDDCDFLEI-MRXNPFEDSA-N 490.542 0.662 50 20 JCGD COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNC(=O)Cc2cccnc2)CC1 728856702 VMDKYFVXJIPDOW-UHFFFAOYSA-N 460.512 0.659 50 20 JCGD CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728889909 SNQJRAIRNIQFJJ-SFHVURJKSA-N 499.597 0.994 50 20 JCGD CCS(=O)(=O)N[C@H](CCSC)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1 730542396 WKQYCKAJMRAQCZ-OAHLLOKOSA-N 450.608 0.631 50 20 JCGD Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1OCC(=O)O 748689158 IEGBNSDZXCVBQY-UHFFFAOYSA-N 471.513 0.332 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)n1 825436206 HEYWFQNDVICNRP-VMPITWQZSA-N 452.514 0.770 50 20 JCGD CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)COc3ccc(C#N)cc3)cc2)CC1 916389967 FNZCVKVYPYQXNO-UHFFFAOYSA-N 450.499 0.855 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3c(C)nc4ccccn34)n[nH]c2n1 917392572 JORRNKHYNRBAHX-UHFFFAOYSA-N 469.535 0.314 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc2[nH]ncc2c1 1778938792 FUJPCAZMXLRBSV-AUSIDOKSSA-N 463.303 0.079 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1779010739 CXNDCNORAVDBEI-QHCPKHFHSA-N 459.547 0.219 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779036804 GCCLIHLWBRIQCQ-DEOSSOPVSA-N 490.524 0.332 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(-n3cccn3)nc2)C1 1779814664 BDSKBILVUNMZQX-NTKDMRAZSA-N 483.573 0.768 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C)cn1)C2)NC(=O)NCc1ccccc1 1780558679 CDDWBLZDYMQSMA-PXDATVDWSA-N 497.600 0.894 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(=O)c1cccn1C)CCO2)NC(=O)NCc1ccccc1 1780970698 XFERKKLHGLTTEO-RUZDIDTESA-N 496.568 0.384 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1)[C@H]1SC(=N)NC1=O 1781229468 HZBONWLQRVRZIQ-YGSYIFCWSA-N 451.376 0.855 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781330955 JBMFZYLXVLMHJM-JKDFXYPNSA-N 468.320 0.392 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CNC(=O)C2)C1 1781778342 RDDCMFULNKGBJW-NFHUAXAMSA-N 488.497 0.784 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2 1782212278 OTMZBMAZBHAAHT-FOIQADDNSA-N 450.496 0.423 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(-c3ccncc3)[nH]n1)C2 1782212316 RFVGLZPCKMWQND-HYBUGGRVSA-N 483.573 0.972 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2 1782214012 HRWBPDIEPSZQMP-XKDCRVNJSA-N 460.579 0.402 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782536047 VXFVMZNKUQLSQW-WPSZSDGUSA-N 467.331 0.356 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)C1 1783032655 UQBCVWJCVPQDGG-XMSQKQJNSA-N 465.934 0.685 50 20 JCGD C[C@H]1Oc2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2NC1=O 1783934471 ASCYGSSURJAEGT-CMJOXMDJSA-N 473.530 0.223 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1 1783964167 LUYQVIDIDZPKRB-MRLBHPIUSA-N 468.414 0.325 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(c4cc(OC)ncn4)CC3)[C@H]2C1 1784242843 NZAXUJWINHTVGU-VJANTYMQSA-N 496.008 0.935 50 20 JCGD COc1ccc(F)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981838 BDGLNNPFQRKOIH-ZRCAFCQKSA-N 456.279 0.421 50 20 JCGD Cc1cc(C)c(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(C)c1 1786982755 GRHCYEXDLHSJGL-PMVMPFDFSA-N 480.370 0.964 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)C[C@@H]21 1787507737 NSIFFUACIOQLFR-MLOSVMDKSA-N 457.556 0.975 50 20 JCGD COc1ccccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609913 SETKOLCGYQFYBC-LRQRDZAKSA-N 467.526 0.530 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1 1789923505 QVRMJAOIDWQABQ-SBJFKYEJSA-N 496.374 0.932 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1792587014 VUPBKXHDWSWPAS-NRSFXHEJSA-N 451.531 0.942 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1792925772 GHTYMJAYWODJTB-GPVSGQMNSA-N 465.290 0.364 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)O2)C1 1792972505 SCWXLFHSBRQXQV-BPKGMFCQSA-N 487.981 0.344 50 20 JCGD COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1C 1795740635 FKLLTSBUYUBSRR-BBIADKPPSA-N 452.316 0.129 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(c3cccc(OC)c3)C1)C2 1800973380 HUDDLRIXMHGRQI-GGTBVAQXSA-N 479.961 0.892 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1 1807364777 KCKMSAVFDPFJNH-XHYAQGIWSA-N 479.342 0.670 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374100 XUPLUNCKQWZNGQ-PZJWPPBQSA-N 496.373 0.994 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807376705 XLAUWODAOWDRKO-GHTZIAJQSA-N 473.298 0.115 50 20 JCGD Cc1noc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1807525827 QVCOMYSVVDOVAC-FOIQADDNSA-N 464.486 0.334 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1 1809986175 ZDEUIQZUWPHYDZ-HTAPYJJXSA-N 453.547 0.917 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(O)nn2)[C@H]1c1cccnc1 1810297687 CMJOCKGIWUWXEX-KUHUBIRLSA-N 462.470 0.209 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1 1810637844 DXULSNLAHLASIM-KUHUBIRLSA-N 458.479 0.406 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343976 AALNZRZYQKPEGW-BBRMVZONSA-N 465.344 0.944 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362018 YSRQTHUTSAFLOF-XJKSGUPXSA-N 466.328 0.911 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)N2CCOCC2)n[nH]1 1819445414 XWJSQDJTSSXSTN-VLXMVTKESA-N 486.533 0.186 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1820192409 XMSANKXDVIOAJS-QYYIONLISA-N 489.558 0.340 50 20 JCGD COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)ccn1 1820541196 XAZVNIMJCSSESN-OAHLLOKOSA-N 452.301 0.766 50 20 JCGD O=C(NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccc[nH]1 1825158541 ZZFQCNCBWMVFAZ-QFIPXVFZSA-N 480.374 0.748 50 20 JCGD C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1829267268 NRBVJGRFMJTQTR-DEOSSOPVSA-N 469.542 0.445 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1830357504 CXWAFGUCWSZDNJ-IBGZPJMESA-N 466.000 0.133 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(C)(C)CCl)CCO3)no1 1830364511 MPNMVDWVXKSCQW-FQEVSTJZSA-N 456.927 0.434 50 20 JCGD O=C(c1cc(=O)c2ccccc2o1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830719284 BPCFGBSXDXJVIQ-IIBYNOLFSA-N 450.875 0.463 50 20 JCGD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726164 OFHOMMJUJMEFBK-VQIMIIECSA-N 459.858 0.333 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1F 1830730739 DGDSKFBSPKJVFV-HRAATJIYSA-N 472.897 0.672 50 20 JCGD Cc1c(Br)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nn1C 1830730953 GUCPDQXLAGRSJH-SJKOYZFVSA-N 479.759 0.161 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(C#N)c1 1830732764 AFZQRURVESXTDG-WIYYLYMNSA-N 451.907 0.165 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1 1832209194 OIUOVXMLXGTWJB-LIRRHRJNSA-N 466.336 0.671 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1833262272 LXIJPNPRJROALX-CJNGLKHVSA-N 460.417 0.182 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833309004 ISDXJQCCVGWGAF-MSOLQXFVSA-N 490.045 0.400 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccccc1F)CCO2 1835007795 DYRXYSXFRBWEKH-QFIPXVFZSA-N 450.511 0.198 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](N)c1ccccn1)CCO2 1835695564 MRSBBEJZARKCLE-IDHHARJASA-N 455.353 0.569 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(Cl)cccn34)C2)C1 1835928122 FDDRRTBHRDPLAF-QHCPKHFHSA-N 498.732 0.051 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1 1835931660 WMKXELHREHOGRM-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(Cl)c1 1835941853 SKHYSRDQXSQARM-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cscn3)CCO2)C1 1836041309 VIZNIKKXWQYJDS-MNQDVBFDSA-N 474.543 0.276 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@@H]1CC[C@H]2CCC(=O)N2C1 1836362118 MUWGUSDYWCBQLK-AYOQOUSVSA-N 454.999 0.559 50 20 JCGD O=C(NCCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc[nH]1 1836715032 HKKGMNWLGSYAKI-SFHVURJKSA-N 454.955 0.733 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C\C(=O)NC3CC3)CCO2)C1 1837253857 PDPZDSMIWFZEAU-VKRNSVOSSA-N 458.353 0.451 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 1838568786 LRSSASYBMTYISR-YCRPNKLZSA-N 499.358 0.689 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3cc(C)c(O)nc3=O)CC2)CC1 1838786644 PXLJRBIAHXWAMY-QGZVFWFLSA-N 470.954 0.510 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1839145576 MPVIBWFKZHXWEY-QNIGJGFBSA-N 453.923 0.926 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCS3(=O)=O)C2)C1 1839155588 YDWACUAORKROKW-JQFCIGGWSA-N 457.376 0.256 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)ccc1F 1839319714 CNLIAVOVSWIBAA-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD O=C(c1c(O)cc(O)cc1O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839373016 RYGZHWOASMPUMG-PBHICJAKSA-N 463.256 0.564 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839429285 CYDXROQRWAWUTP-QFIPXVFZSA-N 495.508 0.485 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839516131 BYIVQLMYYXVIKL-IFXJQAMLSA-N 471.352 0.767 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Cc1ccncc1)CCO2 1839658755 NWXZLEZKPLKIAT-VLYKXYPLSA-N 496.568 0.851 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1839965541 BTHZHNHASMEFBT-FOIQADDNSA-N 496.362 0.575 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1839966189 XBKDZHKOKOXEFJ-JLTOFOAXSA-N 494.346 0.333 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)C1 1840032617 DSOJHXXHMCNARS-NJSLBKSFSA-N 494.383 0.112 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1 1840156882 XGDLABMOZNOJQQ-DYESRHJHSA-N 451.907 0.647 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnc4s3)C2)C1 1840184488 PXAGHBMVLOZGNF-QFIPXVFZSA-N 475.571 0.739 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1 1840185012 DPYQQVIVXHHUAN-HXUWFJFHSA-N 453.927 0.178 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CCO2 1840288449 VAWOXCYDOXARNQ-SGIRGMQISA-N 464.327 0.240 50 20 JCGD Cc1ccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1840397377 XNPWQOIGMMMHFS-XOPAWIAISA-N 464.588 0.899 50 20 JCGD C=CC[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1840794950 CIGIRXIGRGTEJY-JKSBSHDWSA-N 489.997 0.902 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)C(C)(C)O 1840916676 XHUHDVITJQXLOY-XCLFUZPHSA-N 498.404 0.911 50 20 JCGD COc1ccc(CCC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1OC 1841782800 COGSIQSGAHPAFR-UHFFFAOYSA-N 452.316 0.833 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263422 DALYOZZNLLQRFL-UHFFFAOYSA-N 490.561 0.434 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1 1845940345 KJNSEIMBCUSTLG-SFHVURJKSA-N 498.443 0.926 50 20 JCGD Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 26745929 BHBDRZSVPIIHIT-UHFFFAOYSA-N 480.568 0.761 50 20 JCGD C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)N3CCOCC3)cc2)C1 728262341 DPLHVZPDABRGAE-GJZGRUSLSA-N 460.578 0.588 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)CNc2ccccc2)c1OC 729513811 QYZKPTFCGKZRMW-UHFFFAOYSA-N 478.527 0.598 50 20 JCGD CCCS(=O)(=O)c1ccccc1S[C@@H](C)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 730532895 BTYIKXHAXPEAIH-STQMWFEESA-N 463.603 0.868 50 20 JCGD COc1cc(C=NNC(=O)c2sc(N3CCOCC3)nc2C)cc(OC)c1OCC(N)=O 730547923 NDAMKHHYCPLVDC-UHFFFAOYSA-N 463.516 0.933 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)c1 749220306 LEZTYXMIRTWANJ-UHFFFAOYSA-N 459.528 0.383 50 20 JCGD COc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)ccc1OCC(F)(F)F 750932873 RSVAIIGWWIXUNO-UHFFFAOYSA-N 461.422 0.671 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(I)ccc1-n1cnnn1 751209113 KQJWLJIHROREJP-UHFFFAOYSA-N 497.278 0.519 50 20 JCGD Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 811843403 RVGUVVIYBCGCRD-LJQANCHMSA-N 489.506 0.580 50 20 JCGD Cn1cccc1C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C/c1ccccc1 822066331 MRLXQNYIGNCCFW-DKGMDFAASA-N 468.557 0.180 50 20 JCGD O=C(COC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)c1ccccc1 825228458 AFHZGXJRRLCYLV-UHFFFAOYSA-N 477.495 0.521 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(=O)n(CCOC)c2)c1 917391619 AWTKHODXEKMOCV-UHFFFAOYSA-N 450.517 0.600 50 20 JCGD O=C(Cc1nc2ncccn2n1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 918008489 OSEUXCOOAROXPJ-UHFFFAOYSA-N 454.454 0.830 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CSc1ccncc1)c(=O)n2Cc1ccccc1 920503337 JWCZCNRHVFSGKB-UHFFFAOYSA-N 493.549 0.763 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1779000478 WQCLPDXUEKBCIG-HSZRJFAPSA-N 456.424 0.861 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4cc(O)ccc4n3)CCO2)C1 1779029924 BNDBZDNHPJADQY-XMMPIXPASA-N 476.493 0.696 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1N(C)C 1779032423 JRWMJFKVYMAWQH-XMMPIXPASA-N 482.541 0.517 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2)C1 1781356177 XMDHSRZYYKLEAA-SIFCLUCFSA-N 463.959 0.346 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1 1781771458 AVMGKAJMYUQOTP-FQEVSTJZSA-N 451.455 0.550 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nonc3c1)C2 1782212025 ORFLWCHXUXTYIK-XMSQKQJNSA-N 458.519 0.723 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)CCO2)C1 1783875730 SLNNTLAIDMQAMP-ZSEKCTLFSA-N 474.905 0.268 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CS(C)(=O)=O)[C@H]2C1 1784525048 UVUNMLDVHNKYRC-LXFSFDBISA-N 453.399 0.820 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(=O)O)ncn3)[C@H]2C1 1785640082 UYRHXUSSBXKUTA-YXMPFFBPSA-N 455.309 0.799 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1scnc1C1CC1 1785788347 IHZRXQCCGXXCCE-SZMVWBNQSA-N 455.345 0.607 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1789694299 CZSNXOWWIIJVHF-ZBKWNVLRSA-N 455.914 0.523 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726902 ZJZQSCVDPUHTHN-GBAJDQEWSA-N 488.633 0.653 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C[C@@H]21 1791257623 MAQYEPKVRFWFIK-WLNPFYQQSA-N 480.005 0.855 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cccnc1 1793146493 BWTNJULYIFYODW-ADHGMGHFSA-N 482.965 0.837 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC(CO)CC1)C2 1796439432 CXBUVLPMYAFPAT-ROGVSCEHSA-N 459.547 0.509 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc(C(F)(F)F)n1 1798513844 QPTVDCLSTSRGAS-OXIQGZBJSA-N 451.829 0.912 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)n1 1798587178 DEKZOQOQGRBONA-MUJYYYPQSA-N 467.530 0.237 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(F)(F)F)C2)NC(=O)NCc1ccccc1 1799094711 GJSLUQNODLIFMH-HGKCTWBKSA-N 471.480 0.875 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1N1CCCCC1 1799782755 VNMRFNIPKVAYIS-IRJINJETSA-N 477.370 0.874 50 20 JCGD CCN(C)[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1800164506 RCAQHGYIWLYZNR-RPUPUWCGSA-N 474.606 0.262 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Oc1ccccn1 1801363697 YPFRDPVOUYXWMU-PCZSQWGKSA-N 468.514 0.573 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CC[C@H](N)C(N)=O)[C@@H]1c1cccnc1 1803010116 ZNIYSJGBPIEQLW-VWNJHIHFSA-N 454.369 0.711 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803035813 BNWTXXPDVCOGDR-YVSFHVDLSA-N 470.954 0.573 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1 1804199430 XKWUQIFDCAWPQC-USXIJHARSA-N 491.383 0.508 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nonc3c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364267 SXQQUEDHXZZQOU-PGRDOPGGSA-N 471.282 0.931 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1 1808417631 OAYQYPXBHMGTLG-GMNIJNRFSA-N 464.486 0.964 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1 1810306128 UQRTXBWVIBXHSI-ZWWNWMABSA-N 488.552 0.928 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1 1813070178 GQTMLTCPSGEVDZ-VQIMIIECSA-N 465.518 0.212 50 20 JCGD O=C(CSc1ncccn1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354740 REMHMKVOWXLAED-AWEZNQCLSA-N 469.357 0.631 50 20 JCGD Cn1nc2c(c1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]1)CCC2 1817474512 DWSLONCRXVMEFW-LJQANCHMSA-N 462.319 0.931 50 20 JCGD Cc1cnn(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)c1 1817645482 DMIXWFWZTXOBIP-KRWDZBQOSA-N 451.491 0.919 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1 1821096539 BOYPGENABRLENF-VCEHOBFASA-N 468.499 0.999 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923992 HQOQMMZWEIKBGR-MOPGFXCFSA-N 456.547 0.539 50 20 JCGD CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCN2C(=O)OCc1ccccc1 1829001648 ZJJBUVKOHUDIQU-VWLOTQADSA-N 479.342 0.842 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(N)=O)CCN2C(=O)OCc2ccccc2)C1 1829476893 ZRVSAUZUIDUXSM-HTAPYJJXSA-N 495.964 0.361 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)[C@@H]3SC(=N)NC3=O)C2)C1 1830538954 WIGDQHYKERLGBV-ZIVKBKJYSA-N 491.408 0.276 50 20 JCGD CCNC(=S)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1831090378 CSJRNILSWVPMFQ-IBGZPJMESA-N 460.409 0.084 50 20 JCGD O=C(CSC1CCCC1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831360131 RQZXKRYUDBKRAU-JOCHJYFZSA-N 462.377 0.112 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1 1832135508 QXFXLUWAMRXXPE-CEXWTWQISA-N 453.971 0.676 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1833497596 NUJFXBCSEDPDJO-ROUUACIJSA-N 461.302 0.481 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)nc1C 1833691943 HGTAEUDVVZVHQV-QHCPKHFHSA-N 468.514 0.081 50 20 JCGD O=C(c1ccnc(C(F)(F)F)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833792323 SHQKSEIVOQJGCA-CXAGYDPISA-N 451.829 0.770 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccoc1C)CCO2 1834137738 GNIIUOIVNZBFKL-NMWDDECMSA-N 457.487 0.792 50 20 JCGD O=C(c1ccc2c(c1)CCCO2)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933662 FYEVREHRTSNFDM-RUZDIDTESA-N 480.326 0.075 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCC(N3CCC(NC(=O)[C@](C)(Cl)CCl)CC3)CC2)CC1 1836398188 HNGXFDLKGXYEFC-JOCHJYFZSA-N 490.476 0.958 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccn(C(F)F)n3)CC2)CC1 1837919172 MMZDLZCKZCKDKI-UHFFFAOYSA-N 476.289 0.884 50 20 JCGD CCN(CC)C[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920060 IKDORPDEIYMRMD-IBGZPJMESA-N 473.423 0.957 50 20 JCGD CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)n(C)n1 1838042466 YOPNKNJKPIPPQE-AJPHYDNBSA-N 485.545 0.187 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)[nH]n3)C2)C1 1838528107 FUVRGLLCRFMYQC-QFIPXVFZSA-N 487.469 0.935 50 20 JCGD O=C(CN1C(=O)C=CC1=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1838648547 YSDPOAXDMWXORI-KRWDZBQOSA-N 460.300 0.601 50 20 JCGD CSCC[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838789199 KTCXXXIMCYRYEF-SFHVURJKSA-N 458.625 0.472 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C)CC3)C2)C1)NC(=O)NCc1ccccc1 1839054292 RPRJVMCVBVVBBW-DEOSSOPVSA-N 473.574 0.589 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1N(C)C 1839114175 IYIFGNGLMWTLEI-UTKZUKDTSA-N 455.939 0.431 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(C)CCCN1)CCO2 1839122096 PZYSNTGTLKLHNB-DHIUTWEWSA-N 490.513 0.732 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1[N+](=O)[O-] 1839189556 SORSQSHYVQRGNP-FXAWDEMLSA-N 455.895 0.502 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1839444217 ABGBTUCSCKPLCY-LAUBAEHRSA-N 454.907 0.533 50 20 JCGD Cc1cc(F)c(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839459241 JDVNZTRRVNFLDV-QFIPXVFZSA-N 468.501 0.716 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1840034510 NXPLMVLAZURCLP-LIRRHRJNSA-N 466.336 0.512 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ncc[nH]3)CCO2)C1 1840323459 IVDZXRKAZNYKKN-KSFYIVLOSA-N 499.996 0.931 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2 1840949007 XHKYYOPYPNTICY-FCHUYYIVSA-N 464.274 0.182 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1F 1845261835 DARWDYARUVUZSH-HSZRJFAPSA-N 467.306 0.374 50 20 JCGD CNC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 15756431 QODKQAQDAYGVJA-UHFFFAOYSA-N 466.541 0.454 50 20 JCGD O=C(COc1ccccc1Cc1ccccc1)NNC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 25416319 HWTJFNMSAJMCJM-IBGZPJMESA-N 498.561 0.969 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)CNC(=O)c1cccs1 725740323 CRTVICDEVDJQLV-UHFFFAOYSA-N 450.542 0.699 50 20 JCGD Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1F 729837510 UMWXCYOJROQIBY-UHFFFAOYSA-N 457.505 0.778 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)COc3ccccc3O)CC2)cc1 730781674 WXIMFQCGSKPFJM-UHFFFAOYSA-N 462.528 0.233 50 20 JCGD O=C(COC(=O)c1sccc1S(=O)(=O)N1CCC(O)CC1)NNC(=O)c1ccccc1 745506504 FRJDSYFRTSVILK-UHFFFAOYSA-N 467.525 0.512 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1 745837576 BUTKPDKEUDLRFP-IBGZPJMESA-N 451.483 0.172 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H]1CCc3nccn3C1)c(=O)n2Cc1ccccc1 746307954 MHONATMZJSHXNL-KRWDZBQOSA-N 490.524 0.034 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1OC 769685355 JFSZIQBSUPDTAS-UHFFFAOYSA-N 450.473 0.077 50 20 JCGD Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cc2ccccc2cc1O 792520484 CFKPJHLXCRQPGF-UHFFFAOYSA-N 458.496 0.980 50 20 JCGD O=C(COC(=O)CN1C(=O)COc2ccc(Cl)cc21)NNC(=O)[C@H]1COc2ccccc2O1 817810883 AXNAWABSYSLMFW-QGZVFWFLSA-N 475.841 0.596 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)CNc2cccc(OC)c2)c1 825782134 RSGSUWALDNQQGW-UHFFFAOYSA-N 465.532 0.147 50 20 JCGD CN(C1CCCCC1)S(=O)(=O)N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1 914789264 YNCOXLRBZMPOTB-UHFFFAOYSA-N 455.556 0.714 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)CN2CCCC2=O)c1 914831331 WJYGLFYYGKMPIR-UHFFFAOYSA-N 475.365 0.863 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1[C@]1(C)NC(=O)NC1=O 917718027 RLJDXLRABUFQEF-IBGZPJMESA-N 462.440 0.102 50 20 JCGD C[C@H](CN1CCCC1=O)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 918099905 GSRAPBOYFCFWOM-OAHLLOKOSA-N 451.549 0.816 50 20 JCGD C[C@]1(NNC(=O)NCc2ccc(N3CCN(c4ncccn4)CC3)c(F)c2)CCS(=O)(=O)C1 919785469 ZRVWEGJYKZGOMQ-NRFANRHFSA-N 477.566 0.823 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)c1 920284811 IOTIBMHLTUYAQH-LJQANCHMSA-N 458.540 0.932 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nc3ncccc23)C1 1777912565 GAFSXVDWEROZPO-UZUQRXQVSA-N 478.513 0.398 50 20 JCGD C=C(Oc1ccccc1O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1778083023 WRVIEVVTFQVXOK-RCZVLFRGSA-N 480.326 0.792 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1778382903 VNQBAEJRBNKNEQ-YJYMSZOUSA-N 468.352 0.634 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cn3ccc4sccc4c3=O)CCO2)C1 1779029551 ZCHFTCHOXMUICQ-HSZRJFAPSA-N 496.549 0.205 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n(C(F)F)n1 1779032188 FXLJNGIBVZTIGP-FQEVSTJZSA-N 463.445 0.342 50 20 JCGD COc1nc(C)ccc1C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1779740163 HHQCLEUITJSEQB-LRULAXNGSA-N 468.514 0.976 50 20 JCGD CC(C)(C)n1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)nn1 1780192321 DZASWCXWUQFGOE-AUSIDOKSSA-N 469.351 0.154 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCc3nc[nH]c3C2)C1 1782460556 NAAYYUUQZSFMRQ-ZDWFVDTJSA-N 460.579 0.402 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1 1783538126 UCBYYRBBEHRJNG-FXAWDEMLSA-N 495.411 0.686 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1783575035 BWOGWXJLLBLEGA-YADARESESA-N 487.362 0.209 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1 1784370498 HEFTUEFQHLKWBM-NRXGSXMXSA-N 470.368 0.318 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1785106246 SXFMAWUHARQRTC-HSZRJFAPSA-N 466.498 0.401 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Cl)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984513 NUTNAVRKYXLZJV-YYWHXJBOSA-N 456.735 0.856 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnn(C)c3)C[C@@H]21 1787508601 CHMLIVCZYVNTJX-QARUKCAUSA-N 469.546 0.466 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1ccc(C2(NC(=O)CN(C)C(=O)C(=O)O)CCC2)cc1 1788645355 FRNGFLWMYGGMTI-MZJWZYIUSA-N 482.497 0.798 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccnc3C(N)=O)[C@H]2C1 1789092286 VIKLZHXLEMNRII-CYDGBPFRSA-N 454.325 0.342 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4c(O)nnc4O)cc3)[C@H]2C1 1789273331 GDPSNCLBRIDXRM-HJWJTTGWSA-N 479.921 0.526 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)c1ccc(O)cc1 1789886530 OBGFBWYLYQOMMN-CLUDHOEWSA-N 467.526 0.788 50 20 JCGD C#CCO[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1793345187 NTLZOHKMCOSSCC-BCEDRHLLSA-N 459.455 0.762 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(F)cc1 1795200142 KSHBJQYAJBKLLP-VTEUUUEMSA-N 457.462 0.106 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)C1 1796192134 MBRBLFNQLCVTBQ-IYWMVGAKSA-N 483.374 0.875 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1O 1797121987 WOSRUNZCKACBCV-COZGXFGHSA-N 489.997 0.448 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1797587709 IXGJAXSROSSDPA-MUDKKEKZSA-N 498.374 0.647 50 20 JCGD COc1cc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)ccn1 1798440638 FYCNAQMCDRIEDW-BJWYYQGGSA-N 452.515 0.973 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc(-n2c(O)nnc2O)cc1 1798598867 IDRHWEYPOFQDEJ-ZMJPVWNMSA-N 484.282 0.572 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3sc(C)cn3c1=O)C2 1800977692 CTLPXFJFMBDPEE-AYRXBEOTSA-N 454.936 0.521 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2csnn2)[C@H]1c1cccnc1 1803749601 DQKQWFCCCSCXJC-CXAGYDPISA-N 452.500 0.565 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cc2cncnc2)[C@H]1c1cccnc1 1804647825 SXHJFHGUAFARQE-LAUBAEHRSA-N 460.498 0.432 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n[nH]1 1805259403 UKKHLEWKGFVAJX-YWZLYKJASA-N 476.497 0.639 50 20 JCGD Cc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1805553466 CHPLETRHWBZNJJ-UZLBHIALSA-N 460.498 0.812 50 20 JCGD COc1cccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807369187 CAPUDAXFZZBEIV-XMSQKQJNSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374325 GSLBCQIJDBYNET-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD O=C1CSc2ncc(C(=O)N3CCC4(CCCN(C(=O)c5cccc(B(O)O)c5)C4)CC3)cc2N1 1809980779 RYXDOXIZJSHAOB-UHFFFAOYSA-N 494.382 0.964 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1 1810293865 DXOYONVQSPTLFZ-GCJKJVERSA-N 476.298 0.946 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1811068632 SONAKPUQKVRVKX-WMZHIEFXSA-N 473.342 0.856 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815340708 OFAYWXVDYMFRBL-OAHLLOKOSA-N 480.311 0.544 50 20 JCGD CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1C 1815344378 WKVUWWUYBKQOMJ-AWEZNQCLSA-N 453.333 0.658 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)nc3sccn13)CC2)c1cccc(B(O)O)c1 1815361113 XVIOGQUYINZOKJ-ZDUSSCGKSA-N 495.351 0.432 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(-n3cccn3)nc1)CC2)c1cccc(B(O)O)c1 1815361138 YSFOWRMMNBAGKN-QGZVFWFLSA-N 488.338 0.943 50 20 JCGD O=C(CCNC(=O)c1ccccc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361489 GXJVNHPGXCROHY-SFHVURJKSA-N 492.366 0.869 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3[nH]nc4ccncc34)sc2C1)c1cccc(B(O)O)c1 1816857740 NKHZARPWRJSJEQ-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD N[C@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cccnc1 1817405831 PUWBMTNGQQJZCH-QUCCMNQESA-N 462.319 0.881 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472199 AKAKKURUWALZNZ-LJQANCHMSA-N 450.308 0.978 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)C3CCC(O)CC3)sc2C1 1826354340 RWSLVOCHQXKTLF-CPCZMJQVSA-N 458.544 0.919 50 20 JCGD N[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1 1827054442 AVSVPWJXXDPOHA-FGZHOGPDSA-N 450.348 0.695 50 20 JCGD CC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551881 XAKLYNVPWXKOFZ-PGRDOPGGSA-N 480.949 0.174 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](N)CN)C2)C1 1829138317 YHVOOVVQYWLJOC-WMZHIEFXSA-N 491.665 0.576 50 20 JCGD O=C(c1cnc(O)[nH]1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829153236 ZPFQDRYWFNBPSM-VGSWGCGISA-N 491.932 0.781 50 20 JCGD O=C(c1ncsc1Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728555 UPKMZVSCTMOZKL-BONVTDFDSA-N 468.757 0.575 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831156640 BZFJWXBDXPHCLJ-MHECFPHRSA-N 484.383 0.617 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551652 RCTHBSHEBPLVNJ-WDUKFBBWSA-N 490.985 0.100 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832723880 HQHFVDYBVJBFNH-FOIQADDNSA-N 483.363 0.299 50 20 JCGD COc1ccc(CCC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1834799832 GAHXUXLKFUJKAN-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801468 MWFMRAVQYAMHOR-QHCPKHFHSA-N 470.423 0.424 50 20 JCGD Cc1scc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1C 1835935334 OSOHFFMLCDNBSL-JOCHJYFZSA-N 458.345 0.429 50 20 JCGD O=C(Cc1c[nH]c2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939351 NGWHEJOUJMONOP-VWLOTQADSA-N 477.326 0.160 50 20 JCGD Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)sc1C 1836074132 IIORXCKIBPHLLK-UHFFFAOYSA-N 470.404 0.939 50 20 JCGD O=C(NCC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)c1ccco1 1836124956 DJVHBTGUPMOOOD-SFHVURJKSA-N 458.309 0.251 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1 1836414707 ZBAKSRMVBBPNFF-WMZOPIPTSA-N 466.348 0.864 50 20 JCGD O=C1NC(=O)[C@@H](CC(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)N1 1837116042 XPHYKFOAHAURSG-CQSZACIVSA-N 459.341 0.368 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C3CCCCC3)C2)C1 1837459972 PXPMBKWAKNDQBU-JXSPYEIYSA-N 471.558 0.892 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C(C)(C)NCCC#N)CC2)CC1 1837869364 LOMOHEXADPVUJF-UHFFFAOYSA-N 464.611 0.640 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1 1838051635 NMPPIUMLDJSOIT-YCRPNKLZSA-N 463.922 0.796 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn[nH]c3)C2)C1 1838528137 GYSBBGGNBDJLEI-OAQYLSRUSA-N 473.442 0.627 50 20 JCGD C[C@](O)(C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1)C(F)(F)F 1839198664 MKTBHOWCUZMIRT-XDTLVQLUSA-N 451.211 0.447 50 20 JCGD CC(=O)O[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)C(C)C 1839201116 WCBGQKFYVPXRNT-VBQJREDUSA-N 453.305 0.721 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(NC(C)=O)c(O)c3)CCO2)C1 1839473484 BIWDESYOZJQMAO-IERDGZPVSA-N 469.922 0.674 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=S)NC)C2)C1 1839965504 ZWVHKQURZUYYCQ-SUMWQHHRSA-N 465.414 0.100 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1839967025 WZOKYNDACGBHJD-CKJXQJPGSA-N 497.390 0.830 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1840033750 OVSRBAKVIORSCI-PIGZYNQJSA-N 457.281 0.028 50 20 JCGD CO[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1840209831 AGXIZJUDRXZQSL-LHSJRXKWSA-N 465.459 0.625 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840960809 UTICWFDNOCNNPL-BTYIYWSLSA-N 477.986 0.593 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010407 MOTZQEXQGQJEGT-GOSISDBHSA-N 457.336 0.653 50 20 JCGD O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012145 JDSXLCSDRSQIIC-UHFFFAOYSA-N 458.283 0.660 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)CC2=O)c1 1843012935 UOMJOSWHPMZLOG-GOSISDBHSA-N 477.326 0.245 50 20 JCGD C[C@@H](C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1)n1ccccc1=O 1845039038 WZJVBJBUAXHXTB-IBGZPJMESA-N 480.569 0.959 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc3nc(Br)nn3c1)C2 1846384610 MBCIIYYWMVAWBZ-UHFFFAOYSA-N 478.351 0.682 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)OCC(=O)NNC(=O)c2ccccc2)[C@@H](C)O)cc1C 9083976 SHROOQBXFUZTCK-DNVCBOLYSA-N 463.512 0.336 50 20 JCGD CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1 728502931 GGSGGNXBWWSPTL-SNVBAGLBSA-N 469.335 0.370 50 20 JCGD CSCCCNC(=S)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 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CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1 1781016190 ZBKZKJHNEBQMNF-ZHRRBRCNSA-N 467.567 0.199 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781509673 LMVHJWZCIRBBRW-YBOAYWMSSA-N 462.308 0.056 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNCP(=O)(O)O)C2 1781899927 HRABENRCNWLQPQ-WOSRLPQWSA-N 470.301 0.399 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N1CCN(C)CC1)C2 1782003347 JZSUBLBPHFCAHC-MIALQEHNSA-N 459.429 0.920 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1782036648 BUNHOSWDFODQPZ-XRGQIBNMSA-N 489.997 0.470 50 20 JCGD COc1ccc(F)cc1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782299345 WXAZOJULTVSYBQ-RCZVLFRGSA-N 484.333 0.884 50 20 JCGD CCN(CC)[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1782813278 CAJLCOJBXZOYOI-JYFHCDHNSA-N 479.386 0.893 50 20 JCGD Cc1cccc(C)c1N1C[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1=O 1783933257 FYCAWXPEVBFQPG-RXFWQSSRSA-N 499.612 0.859 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1)N1CCN(C)CC1 1783971512 BBZDYVWJASEGPA-ATIWLJMLSA-N 459.429 0.633 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccnc3)[C@H]2C1 1786157525 ODCDBZOMEQLQDW-QAETUUGQSA-N 469.970 0.995 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(S(C)(=O)=O)CC3)[C@H]2C1 1788111071 JGKDYIHXXNWWNE-QAETUUGQSA-N 494.452 0.811 50 20 JCGD O=C(COc1ccc(O)nn1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788150422 KBDGYPDZDFSVOC-UHFFFAOYSA-N 462.271 0.689 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C[C@@H]21 1788610590 IOXCGQWGACCVBB-GKCIPKSASA-N 471.489 0.497 50 20 JCGD O=C(CCCCn1cccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1788711478 IPLYYYKNECTVTF-BVSLBCMMSA-N 453.348 0.632 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)nn1C(F)F 1789329092 ACKMCHUOCCFPBI-ZVZYQTTQSA-N 462.262 0.174 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCN(C)C3)[C@H]2C1 1789740973 BQLRJINHJNVCFE-OWDVSOMSSA-N 458.563 0.442 50 20 JCGD COc1c(C)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1C 1790182912 AHEDYKBXKWWXDH-NYVOZVTQSA-N 466.343 0.899 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr 1792872041 KBIHREGQFLHZRC-MCKBVIGDSA-N 470.368 0.078 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)cc1 1793106771 KKQPMALJUNJWAO-RNGZQALNSA-N 457.980 0.900 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(S(C)(=O)=O)cn1 1794429318 YBKTVLWEASNVNC-MCYUEQNJSA-N 460.350 0.472 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(Cl)ccc3n1)C2)c1ccc(B(O)O)cc1 1795734543 SHXBXPQDIJLFRD-YVWYUNDQSA-N 468.706 0.185 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1ccc(C)cc1)C2 1796444549 YQPAINMIVDZYDX-IIMWNBLQSA-N 494.552 0.448 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(C)CCCN1C(=O)OC(C)(C)C)C2 1801010746 UEIWUVGRIFIDEG-NPGKMWDHSA-N 495.621 0.739 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCCO3)C2 1801011730 YRHXZIWGFHKNOU-NHKMSHSESA-N 458.559 0.517 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1CCCN1Cc1ccccc1 1801191235 NPXQMASLTXUZFG-DVKRWUGUSA-N 477.370 0.234 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]cc1I)C2 1802337697 PZTHASJGVOWAAO-ZSBIGDGJSA-N 488.330 0.639 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1802617626 MKPMFBXOZMBKCZ-FCGDIQPGSA-N 485.346 0.544 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(-n3c(O)nnc3O)cc2)[C@H]1c1cccnc1)[C@@H](O)CCl 1803140823 IKGUKQYQNGVQET-SZMVWBNQSA-N 486.916 0.993 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)C[C@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1804354474 OSIMWHNYTBMWDS-XXZHDZSNSA-N 456.330 0.922 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H](N)c2ccccn2)[C@H]1c1cccnc1 1807170888 XHSJUDCMYDOSKA-MAODMQOUSA-N 474.525 0.495 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361026 GFUPLYZUIFOJAK-DYESRHJHSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376054 RPBAROYHMLJTPU-UWJYYQICSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1)[C@@H](F)Br 1808660966 FNXMVONWRPCPGL-FPMFFAJLSA-N 467.232 0.503 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810507848 JXUOWLMCVQKSLL-CEQIKUNHSA-N 481.557 0.705 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@@H]1CCc2nc[nH]c2C1 1813323439 FXQQYMKKUFVCKV-FHJLPGHOSA-N 473.342 0.609 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3c1CCC3)CC2)c1ccc(B(O)O)cc1 1815348117 DVCZFYULDSUGDH-CQSZACIVSA-N 451.317 0.505 50 20 JCGD Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)s1 1815583936 SEFDJSOWECKDJS-LLVKDONJSA-N 451.578 0.831 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4ncnn4c3)sc2C1 1819397425 RKHQTSXGHDPCIV-GFCCVEGCSA-N 477.510 0.724 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CNC(=O)C1)CC2)NC(=O)NCc1ccccc1 1822518823 VKABJHVCTIVWRW-HZPDHXFCSA-N 499.597 0.537 50 20 JCGD C[C@@H](NC=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2 1822898136 NMVZVFFSXYAOLC-GDBMZVCRSA-N 487.586 0.536 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826088573 YHYPQFXSMKSOMN-VXGBXAGGSA-N 453.569 0.136 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ccc(F)cn3n1)CC2 1826090175 YJODXYBQFCZVQJ-LBPRGKRZSA-N 474.522 0.924 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2)n1cncn1 1826790124 OJRHXHHTRFKJKN-GHMZBOCLSA-N 455.504 0.220 50 20 JCGD O=C(/C=C\C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)NC1CC1 1828789925 KCSSCZUKMQSZQH-XPTLAUCJSA-N 453.348 0.435 50 20 JCGD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)nn1C 1829844393 JAIDMNVDRILGAG-IBGZPJMESA-N 469.546 0.974 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1 1830213448 IKVNXEFDFTWXGA-QUCCMNQESA-N 471.348 0.970 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1830543940 IVIJASYROJOZPK-ORAYPTAESA-N 484.326 0.969 50 20 JCGD O=C(c1ccc(OCCCO)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830730592 AIZXHYUGTTXFON-RXVVDRJESA-N 456.923 0.118 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CCN1C(=O)OC(C)(C)C 1830738974 WQARMSBSVKZKOC-DOWNOZBLSA-N 489.997 0.688 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCOCCOCCOC)C2)C1 1831657459 OLEOXNKDQMDRRQ-GHTZIAJQSA-N 464.987 0.920 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc[nH]n3)C2)C1 1832551341 KEQMFQOPMCUXAG-KKSFZXQISA-N 485.969 0.541 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3C[C@H]3C3CC3)CC2)CC1 1833249657 WQVCPKUOOCLFHO-VQTJNVASSA-N 454.575 0.916 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@@H]1CCc2nc(O)nc(O)c2C1 1833831486 IVSHKFHPHVLUFS-ACJLOTCBSA-N 481.981 0.164 50 20 JCGD Cc1oc(C(C)(C)C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1834198563 JRMXWLZJLGTUQB-RUZDIDTESA-N 484.358 0.949 50 20 JCGD CCOC(=O)/C=C/C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1834406361 WNGKWONBOVSEOS-SOFGYWHQSA-N 451.568 0.050 50 20 JCGD CCc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1834797379 HJRJNTDUDIMMDT-UHFFFAOYSA-N 464.375 0.823 50 20 JCGD O=C(NCC(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)c1cccs1 1834819531 USXGREPYRVWHGB-SFHVURJKSA-N 474.377 0.719 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1834823503 YAZFOBNNFCIHFJ-GOSISDBHSA-N 452.309 0.584 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738156 VZLKZXYMRFJCTD-INIZCTEOSA-N 495.588 0.161 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835767485 AHVQODUFJLGNAG-NWJFTTBMSA-N 486.378 0.081 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836775715 ARNNHKINBWZBOO-XOBRGWDASA-N 498.378 0.118 50 20 JCGD COc1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1F 1837285532 GVYGFYIDAYEESU-UHFFFAOYSA-N 485.321 0.835 50 20 JCGD Cc1ccc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461265 RVMBKPXLBODFDM-XMMPIXPASA-N 467.526 0.686 50 20 JCGD CCn1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1837538483 YGYGIVKKSCVJDR-UHFFFAOYSA-N 454.336 0.509 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CCOC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cnc2s1 1837713166 LEZMQUINODXGPM-NRFANRHFSA-N 494.646 0.986 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)C3CCC(O)CC3)CC2)CC1 1837921054 VVUAOTBFTTWHMU-UHFFFAOYSA-N 458.364 0.530 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)/C=C/c3cnccn3)CC2)CC1 1838788986 FTBCXNZUFZBBQH-HWKANZROSA-N 458.563 0.861 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C3CC3)C2)C1)NC(=O)NCc1ccccc1 1839054009 BJROZHFINSGITH-ZUCPIXAKSA-N 485.585 0.755 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1839153767 RUFNXSDCSHBTJE-HOTGVXAUSA-N 450.279 0.624 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839156588 VHQISLMSELYRAB-KKSFZXQISA-N 453.923 0.298 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3cccc(F)c13)CCO2 1839599333 AXYMXKIGGVBFSW-QFIPXVFZSA-N 476.509 0.145 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1839726330 IKIITWWWBPJSNM-DQJRMYJUSA-N 488.585 0.928 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1840153609 VGDVNZYKYJUMIL-JLTOFOAXSA-N 456.927 0.249 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840186679 MLZHDNNVPJKEJK-VLIAUNLRSA-N 496.388 0.882 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840736645 AMBVPDBAPBJBLI-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2COCCN2C(=O)OC(C)(C)C)C1 1841751712 JOWVPFLHEXCDTI-MRXNPFEDSA-N 467.567 0.199 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2=NN(c3ccccc3)C(=O)C2)C1 1843441972 WREZMSXFUBZRON-UHFFFAOYSA-N 461.482 0.295 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)/C=C/C(=O)NCc1ccccc1)C2 1844263394 ZTRMUIHZQQKGMX-BQYQJAHWSA-N 462.510 0.375 50 20 JCGD C[C@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)N1CSCSC1 1844318440 OBEJQCJYDKADAZ-CYBMUJFWSA-N 450.590 0.545 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)C[C@](C)(O)CC(=O)O)C2)NC(=O)NCc1ccccc1 1845039404 MIOIXLDKXKTTCG-QFIPXVFZSA-N 475.546 0.152 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCC(=O)N1CCCC1)NC(=O)NCc1ccccc1 1848055968 XRKAXPRSNCQWKJ-SFTDATJTSA-N 484.601 0.937 50 20 JCGD CNS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)ccc1OC 10793407 UHAAREIDJDNKGB-UHFFFAOYSA-N 481.483 0.239 50 20 JCGD C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)C2=O 15314606 SHVCXJGAINEIIP-KOSHJBKYSA-N 470.574 0.847 50 20 JCGD COc1cc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2F)cc(OC)c1OC 26955372 ISBLVDOZVSELGU-UHFFFAOYSA-N 455.464 0.981 50 20 JCGD Cc1cc(C)n2nc(C(=O)NNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)nc2n1 28663412 CPBVEINEZMFZFY-UHFFFAOYSA-N 487.542 0.156 50 20 JCGD Cc1cc(C)n2nc(NC(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cn3)nc2n1 725853180 MHOZKTCAIYBDJQ-UHFFFAOYSA-N 460.524 0.221 50 20 JCGD O=C(CC1CCCCC1)NCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 726260577 CTRRDEGZMNWLGV-UHFFFAOYSA-N 495.602 0.738 50 20 JCGD CCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 730007154 PHZKVJDDPDWEMP-QHCPKHFHSA-N 495.448 0.898 50 20 JCGD O=C(CCC(=O)N1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 913151325 AFFXCVALTYZDDL-UHFFFAOYSA-N 452.533 0.261 50 20 JCGD CCOCCCNC(=S)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916112698 GUXPDYILSVMVET-UHFFFAOYSA-N 458.606 0.562 50 20 JCGD O=C(NCCNC(=O)c1cccnc1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 916443468 IIBVXHPWKLLRQT-UHFFFAOYSA-N 496.549 0.934 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1cc(Br)c[nH]1 920429844 HLCOPKKPWLLWTD-UHFFFAOYSA-N 460.266 0.815 50 20 JCGD COCCCNC(=O)NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1 920862573 WCNBPRMKUARMJI-UHFFFAOYSA-N 483.591 0.283 50 20 JCGD CCN1C(=O)C(=CNNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)C(=O)N(CC)C1=S 920977588 DSCDGFCHVWNEPB-UHFFFAOYSA-N 467.573 0.116 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(Br)cc3)c2)CCN1 1321558600 MGJNWDSNRFIIRI-UHFFFAOYSA-N 481.328 0.644 50 20 JCGD Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1csc(N2CCOCC2)n1 1330236249 HVRCOJBIUZRLAO-CQSZACIVSA-N 452.562 0.917 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2c(c1)COC2 1778639922 JMOQJADTVBKXSD-RCZVLFRGSA-N 464.327 0.838 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)[C@@H](O)C1 1779300785 ZANCFLYGOPAQLI-PNLZDCPESA-N 485.654 0.896 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ncccc2F)C1 1779893359 CRWLTIPYIBXEHS-VGOFRKELSA-N 456.478 0.661 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCC(=O)N2C)C1 1780790237 PHHCBRDZXFVSSP-RJMNOMDGSA-N 472.546 0.255 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nn1C 1780968710 PGHPTPOCHBZACH-XMMPIXPASA-N 499.572 0.218 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnn(C)c1)CCO2)NC(=O)NCc1ccccc1 1780970299 UGHQAODEMHASJA-QHCPKHFHSA-N 469.546 0.210 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782788377 VCBKMUROGFBENB-MSOLQXFVSA-N 461.302 0.823 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)cn2[nH]cnc(=O)c12 1783969310 GIHACABQUATUFW-MZGVZZPPSA-N 480.363 0.955 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1C 1784841850 VZMINTNWTSVJOD-XJABCFGWSA-N 481.553 0.838 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2)CC1 1785238175 PWQVRSZTWKOSRF-NZQKXSOJSA-N 464.994 0.872 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983695 SXOJCSMFQXLWAH-WDSOQIARSA-N 489.378 0.263 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786986482 FGZPKPQPUBEFBR-NYVOZVTQSA-N 465.315 0.232 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)CN)[C@H]2C1 1787426748 AMHREHYIWOFLIE-COUMVOCASA-N 476.375 0.622 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCN3C(C)C)C[C@@H]21 1787508201 PCZYKGBWPRAOKY-LNQUCMTBSA-N 472.590 0.973 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4c(Cl)cccc4n3)[C@H]2C1 1787863525 ALWRSAJAXLYYPW-ZOBUZTSGSA-N 476.965 0.954 50 20 JCGD Cc1ccc(C(=O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1 1788610050 YWTJADGBGLGIQG-VDGAXYAQSA-N 465.510 0.470 50 20 JCGD COc1cc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1OC 1790192747 FGBWTMSBPLCHCN-NYDSKATKSA-N 482.342 0.599 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1790316483 RMXSIPIOZZEMSZ-HARLFGEKSA-N 489.341 0.163 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCNC4=O)C[C@@H]21 1790961728 PGNMQDAAJCUPMK-ZJOBFFGXSA-N 482.379 0.783 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3nc[nH]n3)[C@H]2C1 1791553722 AWQKTCDEQSYWTH-HVEJOWRVSA-N 474.547 0.011 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2 1792872409 FRUAKVJGPNTKJP-MCYUEQNJSA-N 469.361 0.990 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H]2C[C@H](F)[C@H](C2)[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792983494 KMQHFHFGFDJUQE-BAUITVHYSA-N 489.972 0.912 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)[C@H]2C1 1792984070 RUWDFQFQQJUICP-MCZKYTFGSA-N 487.981 0.058 50 20 JCGD Cc1nocc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1794838733 CMAGNVSKFDUVFO-RMFSNUHRSA-N 470.530 0.532 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@@H]1CNc3ccccc3C1)C2)c1cccc(B(O)O)c1 1795737435 FVACSQHHLXIKJI-OTQUPPRASA-N 477.370 0.634 50 20 JCGD CCn1nc(C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796440071 CONXJZBEHKNKAJ-ZPHZMXASSA-N 455.519 0.549 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1F)C2 1796446470 YKLHEDCUBXQKNB-GYGSIYFNSA-N 471.489 0.928 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1 1798547877 SWEMNMLZPGZKPY-GFENJXEQSA-N 466.510 0.419 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnncc1C(=O)O 1798777933 IDFCSBYYSOIZQN-SIENDBQGSA-N 453.459 0.561 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3ncccn3n1)C2)NC(=O)NCc1ccccc1 1799871427 CZYMGWSRERBISB-REPLKXPHSA-N 491.556 0.722 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cn1ccnc1 1801371483 XYCYXCWCBMFGBT-ZTRWLKRLSA-N 455.519 0.243 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc([N+](=O)[O-])o1 1802259012 IVXBJLFWHPPZJQ-JXFKEZNVSA-N 464.243 0.896 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CN2CCOC2=O)[C@H]1c1cccnc1 1803334527 LBNZFIJVYUPIQE-BLCOGNGMSA-N 481.513 0.674 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1 1806700706 HSVUWLRRNQAKFI-OAHLLOKOSA-N 468.389 0.639 50 20 JCGD N[C@H](CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccnc1 1807364214 PIWGWVBCLOXPNS-FJIJXJHWSA-N 473.342 0.566 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365860 ZXMIUAZIRSCPCP-GCJKJVERSA-N 467.331 0.813 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1 1807371193 QWUHITQANDLFLN-LAUBAEHRSA-N 465.344 0.484 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)s1 1810302486 KNJFQKPNOSRZGF-FOIQADDNSA-N 480.554 0.802 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1 1810306064 SERROAMPOHOLMU-RDTXWAMCSA-N 481.542 0.310 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1 1813070243 FKLXMJWRRSLAMM-LAUBAEHRSA-N 464.530 0.817 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1 1813071634 VBFFRJYJWXQPOQ-KSSFIOAISA-N 458.479 0.406 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1813073054 FLMRSMOSIMXMKX-QRWLVFNGSA-N 492.627 0.321 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2cn3c(nc2=O)SCC3)[nH]n1)[C@H](O)CCl 1814873785 ZSORCKRDGZHOCM-UONOGXRCSA-N 466.951 0.907 50 20 JCGD N[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccccn1 1815011995 PJAISEGOEJUGEO-KDOFPFPSSA-N 451.317 0.144 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474121 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O=C(NCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1cccnc1 1827050812 ZJOHPEHABWCOBK-JOCHJYFZSA-N 478.358 0.425 50 20 JCGD O=C(COCCO)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551699 SWFIVYZTSGTVGV-PGRDOPGGSA-N 483.949 0.047 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C2=NNC(=O)C2)CC1 1828861225 NYXQHYFYQKZKCH-MAKCPWPFSA-N 455.519 0.616 50 20 JCGD C[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCN2C(=O)OCc2ccccc2)C1 1829355690 DSCKRNBBXKLRQI-KOSHJBKYSA-N 489.573 0.192 50 20 JCGD CNc1nsnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1829756138 SXNJXUVKTKKOPB-HOTGVXAUSA-N 452.364 0.886 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@H](O)c3cccc(Br)c3)C2)C1 1830733187 GEBYMGCKLNXSHG-GPMSIDNRSA-N 491.766 0.539 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C[C@H]2C[C@H]21 1830748096 FZSYNBASZHZHRU-GQTOQBHESA-N 487.981 0.440 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(O)cn2)CC1 1832318177 ZIAJWNPMWMHKGZ-QFIPXVFZSA-N 451.332 0.943 50 20 JCGD C[C@@H](S)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551425 NSMUZZUXPKJFCU-TYILLQQXSA-N 466.000 0.893 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc4snnc4c3)CC2)CC1)[C@H](O)CCl 1833312707 XYGWYWIWVMMKNU-MRXNPFEDSA-N 452.968 0.871 50 20 JCGD O=C(c1cnccc1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1834108677 HDIVHNICZFYORH-YOEHRIQHSA-N 451.829 0.770 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnnc(Cl)c3)CC2)CC1)c1ccc(B(O)O)cc1 1834797355 FMOQTNMAIFGVTK-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD CC1CCN(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1834798123 UPGBLYVUKSFPRK-UHFFFAOYSA-N 470.423 0.284 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1835069808 KTIDWNDTYPYPRU-XMMPIXPASA-N 483.525 0.006 50 20 JCGD O=C(CCc1ccccc1Cl)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835174968 KWLHEHPSFCNDLF-XMMPIXPASA-N 486.761 0.723 50 20 JCGD C[C@H](Sc1cccs1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930768 YWEUNRGUIDCNHB-AOMKIAJQSA-N 490.412 0.679 50 20 JCGD Cc1cc(C)cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835933608 DJMRBVVSWRMSAU-AREMUKBSSA-N 480.370 0.686 50 20 JCGD Cc1cc(Cl)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835941541 NRSHOIZCPBMWQT-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cc3)C2)C1 1837459724 MNTNBYVQDWTTFV-QFIPXVFZSA-N 473.917 0.722 50 20 JCGD O=C(c1nnc(-c2ccccc2)o1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837534393 LWFCVBZTYDWOCU-QRWLVFNGSA-N 450.879 0.406 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cccn1 1837920993 PYZAHQAZCZRQQC-KRWDZBQOSA-N 454.336 0.436 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccn3)C2)C1 1838527471 VPCHFDRNHLNBQU-JOCHJYFZSA-N 485.453 0.694 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)cc3nn[nH]c13)CCO2 1838620027 MXHOBQDXNPOPMK-OAQYLSRUSA-N 493.952 0.054 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cnn4c3OCCC4)CC2)CC1 1838700593 ISYUAJVGRBMJDH-UHFFFAOYSA-N 476.578 0.651 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn(C(C)C)n1)CCO2 1838783733 NVFLAOUMBMOCOK-VAHWYXDJSA-N 485.545 0.668 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1 1839035259 GNDIZKIAHGYRQM-QRWLVFNGSA-N 474.963 0.787 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1839198451 DTGDPZQMKWFWDU-UFBFGSQYSA-N 483.184 0.489 50 20 JCGD O=C([C@@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839201940 NZELCILMHQSKJJ-SBMIAAHKSA-N 450.074 0.824 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(S(C)(=O)=O)c3)C2)C1 1840149460 PKBXLQMPISCUOP-PXNSSMCTSA-N 474.963 0.414 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1840154442 XCQHVDSLSXYVSX-DJJJIMSYSA-N 470.935 0.080 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)C2)C1 1840154738 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COc1cccc(N2C[C@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3ccc(B(O)O)cc3)CC2=O)c1 1847213376 HZFYTCYERSQYPM-WTNAPCKOSA-N 477.326 0.244 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cc1c(C)nn(C)c1C)c(=O)n2Cc1ccccc1 10634167 AOWNVJRYOXBSCL-UHFFFAOYSA-N 492.540 0.168 50 20 JCGD C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 728204054 RJJQIFQRNFGRNS-CQSZACIVSA-N 484.538 0.927 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(CCNS(C)(=O)=O)cc3)cc2)CC1 728214095 XSRWQVWHKOGZII-UHFFFAOYSA-N 495.627 0.471 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2cccnc2)c1 728527332 GHSFVWCRJQLRFW-UHFFFAOYSA-N 457.306 0.934 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 729298886 XMILYAOVKYRZHU-HXUWFJFHSA-N 490.520 0.333 50 20 JCGD C[C@@H](Cn1cncn1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 749211267 LUYREOIBJICGBK-HNNXBMFYSA-N 457.516 0.789 50 20 JCGD COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1 751281867 HNPXPARKFPHSNZ-SREVYHEPSA-N 483.524 0.691 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(S(N)(=O)=O)ccc2Br)n1 761711875 KAOCKFLTCXSLNR-UHFFFAOYSA-N 491.345 0.408 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)cc1OC 848978473 CBPABKCBIHPVKK-HNNXBMFYSA-N 499.476 0.832 50 20 JCGD Cn1c(=O)c2nc(Br)n(CC(=O)NNC(=O)c3ccccc3Cl)c2n(C)c1=O 914527094 HRKALVCDNITZDL-UHFFFAOYSA-N 469.683 0.311 50 20 JCGD NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 915884591 JQWDIQQPCWTOID-UHFFFAOYSA-N 481.556 0.263 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1O 917717273 CIDZHNDJOFMQAP-UHFFFAOYSA-N 483.524 0.587 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1[C@]1(C)NC(=O)NC1=O 917733110 RSTQCEVAFKBDGV-INIZCTEOSA-N 486.304 0.464 50 20 JCGD COc1cccc(-n2c(CC(=O)NNC(=O)CS(C)(=O)=O)csc2=NCc2ccco2)c1 919689329 JTZXQKIOFUFMKA-UHFFFAOYSA-N 478.552 0.976 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC(=O)N3CCCc4ccccc43)nc2)CC1 920045578 PLMRSSJRCKXGBH-UHFFFAOYSA-N 487.586 0.623 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C\c1nccs1)c(=O)n2Cc1ccccc1 1520838484 NUTOWRLUZYCBKO-HJWRWDBZSA-N 479.522 0.745 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1 1778026224 OLSUGXCVIJPQHZ-FGBSKUFISA-N 451.923 0.920 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)CC(=O)N3)C1 1778922764 VJEMZBPTAQTCEO-NTKDMRAZSA-N 471.558 0.682 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)NC(=O)c2cnccn2)C1 1779474154 WVGUPPASQFXCKT-QSLMVLCRSA-N 467.954 0.363 50 20 JCGD CN[C@@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1)C(=O)O 1780097166 RNBGXOLXEUNCPF-KKSFZXQISA-N 478.458 0.026 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1781445979 WJXMIMITKGEHSS-HSZRJFAPSA-N 482.497 0.621 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1 1782438093 VRNOLORLVVIBNF-JKJLQIMHSA-N 467.530 0.486 50 20 JCGD CN(C)[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccc(Cl)cc1 1782822303 RPZSKGAZHMJWGG-QPPBQGQZSA-N 485.777 0.766 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1c(F)ccc(F)c1F)CCO2 1783933038 BMGSMTJWCTYZIA-OAQYLSRUSA-N 456.465 0.849 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)CCO2 1783933541 PPOIAAUJQNNZRP-HSZRJFAPSA-N 471.558 0.608 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21 1783969374 LSFPGXYRRQUDOR-DHMWGJHJSA-N 458.313 0.802 50 20 JCGD Cc1ccn2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cnccc5C(=O)NN)C[C@@H]43)c2c1 1787373288 QUTZNKTYNBYLQS-ZRCAFCQKSA-N 477.525 0.548 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccoc4C3)C[C@@H]21 1788607718 AXEBXPBPXPIEBL-DFPKUZHUSA-N 467.526 0.677 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1791254873 VOXHKKVGJHFGIR-WFHGCUKPSA-N 453.927 0.354 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)nc4n[nH]cc34)C[C@@H]21 1791289205 NVQFMVJXGOSOEJ-RCBQFDQVSA-N 477.953 0.578 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NN(C)C(=O)CC1 1793786143 ARSHEIKKFTZJEN-VTEUUUEMSA-N 487.469 0.332 50 20 JCGD Cc1noc(C)c1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793883521 FHGLXLYOQDYDQW-IRJINJETSA-N 498.584 0.770 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1F 1795740364 YGOWOSSDFFPTJP-VPTLXERWSA-N 484.289 0.199 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2ccc(Cl)cc2nn1 1796244474 ZXGUFUVJOHXWMP-VPTLXERWSA-N 480.717 0.480 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C)c1Cl)C2 1796441716 VCMKTFVMWBHWIX-OQLCOEBBSA-N 461.910 0.411 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccncc13)C2 1796442183 VKUPNJPDOLJLBN-RVQRMFQJSA-N 464.486 0.067 50 20 JCGD COCCn1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n1 1796892505 IOUWGPQROBMWQA-GSWMANSFSA-N 455.519 0.915 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)CC1 1798442622 HXADSSOZZOHMDZ-QDMKHBRRSA-N 472.546 0.994 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2sccn12)c1cccc(B(O)O)c1 1799095659 WRLTZIWLVJQFII-MUJYYYPQSA-N 452.301 0.001 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)cnc2c1 1799347309 LCYVLKVEGZHIDW-VZAMPYOESA-N 467.295 0.897 50 20 JCGD O=C1CN(c2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)n2)CCCN1 1799347359 GWBBMUZZISTUDA-JGTCGTHISA-N 498.353 0.302 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCNC(=O)OC(C)(C)C 1799353450 DERCYSXBIOOJRZ-YIDVYQOGSA-N 463.959 0.106 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]12C[C@H]1CCN2C(=O)OC(C)(C)C 1800773072 AVXMDGDBOVMIQU-AGYLXNLDSA-N 493.605 0.349 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)n1)C2 1800978560 UXRBUIJDNPRODY-YYAJDYIMSA-N 452.939 0.375 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)c(F)c1)C2 1801008872 FVELIPZFKJFFGW-USGNIVHTSA-N 454.930 0.984 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)CSC1=S 1802105168 XZDJBVYWUNQNKY-NJBDSQKTSA-N 464.407 0.467 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1 1804601190 KWBQSIHGRUGHRS-BCDXTJNWSA-N 460.531 0.863 50 20 JCGD Cc1ccn(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1804622644 CQHYOPCMFUUQNN-UWJYYQICSA-N 462.514 0.605 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807360185 HYVPIUGHJLYQDM-NQIIRXRSSA-N 455.396 0.933 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc1 1807361185 FFVRQEYTONGPRT-WMZHIEFXSA-N 473.342 0.856 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1n[nH]c2c1CS(=O)(=O)C2 1807737716 MRJWCHLMDAURSO-YLQAJVPDSA-N 467.935 0.152 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807949152 NCDQHMMAABCEDL-ODYMNIRHSA-N 479.328 0.764 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)[C@@H]1SC(=N)NC1=O 1808398946 HDWXHUCKIPAITD-JOQQVMPUSA-N 489.602 0.263 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C#CC(=O)O)[C@@H]1c1cccnc1 1812878825 MHKBCSDQWNFYIL-OMSYZAOGSA-N 450.455 0.309 50 20 JCGD N[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccn1 1815012143 UAUFTYRPVUBGJI-KDOFPFPSSA-N 451.317 0.144 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnc(N)s3)sc2C1 1815191021 HIPHZBYWMOCYSO-QMMMGPOBSA-N 458.529 0.720 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)C3CCN(S(C)(=O)=O)CC3)sc2C1 1818644341 ZKAZTWZKBNEGJD-CHWSQXEVSA-N 479.024 0.981 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)N1C[C@H]2C[C@H]2C1 1819569809 MBBXKKAYPGWAQN-JJAZEVLHSA-N 454.361 0.389 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)[nH]n1 1822410553 LYYRJVQMQLSQSI-HNNXBMFYSA-N 458.479 0.577 50 20 JCGD CN(C)C(=O)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1823880086 NFYCRXWKCNPHIB-SFHVURJKSA-N 459.551 0.190 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCNC(=O)C2)CC1 1828925325 IREATELPHGGCNF-QFBILLFUSA-N 456.547 0.445 50 20 JCGD O=C(c1cnc(C(F)(F)F)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830722724 HFNCRORWAWOBCV-BLLLJJGKSA-N 452.817 0.165 50 20 JCGD Cc1c(Br)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nn1C 1830730945 GUCPDQXLAGRSJH-PXAZEXFGSA-N 479.759 0.161 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCOC3)C2)C1 1832551175 GSMJOSZVORTZPZ-QYWGDWMGSA-N 475.970 0.611 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccnc3Cl)CCO2)C1 1832718304 INPJIMDZFGOAQC-JOCHJYFZSA-N 488.932 0.046 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)n1 1833310686 YLPILBRFGLBZSG-INIZCTEOSA-N 469.926 0.783 50 20 JCGD Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)on1 1833733465 RKDGTGYNNNBIPK-UHFFFAOYSA-N 469.546 0.409 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnn1C)CCO2 1834236332 WDTXOEGKWWREJQ-JOCHJYFZSA-N 487.469 0.637 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)nc3)CC2)CC1)c1cccc(B(O)O)c1 1834800258 AJWDPAMPTQYVFW-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)c3ccccc3)CC2)CC1)c1cccc(B(O)O)c1 1834800989 GGORQZWWKYWMSM-HSZRJFAPSA-N 465.359 0.285 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cnc2ccccc2n1 1835276254 GIFABEYCPNCKON-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD O=C(c1cccc(C(F)(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939662 WWIIIYVOVHHOBJ-JOCHJYFZSA-N 492.259 0.769 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3ncn(C)n3)CC2)CC1 1837380249 FIEFTIRCQFOXKO-MFKUBSTISA-N 470.534 0.561 50 20 JCGD COc1ccccc1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461122 OKSDCMRXAHYACD-XMMPIXPASA-N 483.525 0.006 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922213 YMZVIYVUGDYRSI-UHFFFAOYSA-N 482.390 0.572 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)C(=O)NCC(C)C)CC2)CC1 1838101275 DQAPQSOAPUITJQ-WPWMEQJKSA-N 488.589 0.891 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCOCCOCCOC)C2)C1 1839148846 LVHFXXIAIJTLDW-PXNSSMCTSA-N 450.960 0.530 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1839152182 PZARPZKKHKROME-RBUKOAKNSA-N 472.329 0.741 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1840032627 FHJAWOJKCPVHGL-BFUOFWGJSA-N 470.320 0.706 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1 1840033573 JTPMEBIUSJXWQD-XCLFUZPHSA-N 482.331 0.871 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4ccccn34)C2)C1 1840152537 LMFCSWSMPSWBCU-IIBYNOLFSA-N 450.923 0.967 50 20 JCGD CCSc1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183240 VJNOLUIUKICAEY-JOCHJYFZSA-N 479.603 0.637 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1 1840187086 JYKOEHOQKYNNRM-XMMPIXPASA-N 486.573 0.325 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cc(O)ncn2)C1)NC(=O)NCc1ccccc1 1841693409 YARAQWSJQJHHBB-UHFFFAOYSA-N 453.503 0.345 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CNC(=O)c2cccs2)C1 1842064236 ALKGHGBMJINBMU-ZVHZXABRSA-N 456.528 0.815 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846129124 DYHYWYIPKPWDMO-BVZFJXPGSA-N 483.374 0.831 50 20 JCGD O=C(COC(=O)c1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1 756832941 OWJZKDYACOCPSH-UHFFFAOYSA-N 462.440 0.753 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)n1 763185934 XMOIBBYZOLFCSG-UHFFFAOYSA-N 468.557 0.670 50 20 JCGD CS(=O)(=O)Nc1cccc(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1 857430397 FYXCXRNNEVKRPF-UHFFFAOYSA-N 459.572 0.960 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)c1 873821272 HMGBCWZWMRWDIZ-HZPDHXFCSA-N 450.517 0.263 50 20 JCGD Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)c3nn(Cc4ccccc4)c(=O)c4ccccc34)cnc21 879450778 GMAWUMRKZFLHMQ-UHFFFAOYSA-N 497.471 0.867 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)c2)CCN1 912684741 ARWSUINVDNJWAC-UHFFFAOYSA-N 494.913 0.079 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(OC)cc2)c2ccccc2c1=O 913597008 HXTHCTDJGNDBAJ-CQSZACIVSA-N 487.538 0.943 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(N3C[C@H](C(=O)O)CC3=O)cc2)cc1C 914746670 TUMWFYOZIXLPSS-CQSZACIVSA-N 474.495 0.689 50 20 JCGD CCOc1cc(C(=O)NNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)cc(OCC)c1OCC 919689809 CSZQHKCSEIAWFX-UHFFFAOYSA-N 487.513 0.847 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(NS(C)(=O)=O)cc2F)cc1C 919955968 POMPHRLOHSFFAT-UHFFFAOYSA-N 458.493 0.762 50 20 JCGD CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)s1 1317962061 WHNGBYQMUYLXGW-UHFFFAOYSA-N 473.602 0.652 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CS(=O)(=O)C3)C1 1777715885 YLLHSSGPCJILCR-ZBQZNYHESA-N 474.967 0.219 50 20 JCGD Cc1nn[nH]c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1777743732 RMAXRXUGQQMZGX-NTKDMRAZSA-N 498.588 0.587 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)C1=NN(c2ccccc2)C(=O)C1 1778126672 IHOWYAYQTXXREJ-NJNPRVFISA-N 462.934 0.893 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnnc2ccccc12 1778530918 SQYVAFOMXYSNDL-RCZVLFRGSA-N 474.326 0.751 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2ON=C(c3ccccc3)O2)C1 1779262971 YSTUJSUFAXZSPP-PUZWTLIVSA-N 487.557 0.608 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1779293925 GZHQLQZYKZPNRJ-SZNDQCEHSA-N 464.595 0.674 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1 1779508381 ARNRKRVRDMYZJG-FQEVSTJZSA-N 478.431 0.856 50 20 JCGD COc1nc(C)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779847036 RUAHRWTZZGEFGN-HYBUGGRVSA-N 467.331 0.520 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CC(=O)Nc3ccc(F)cc3)C2)C1 1780884366 XPTIXHSPSRTQFG-QFIPXVFZSA-N 463.510 0.357 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1781023702 NPWLXMIUONNJJP-OAQYLSRUSA-N 455.556 0.103 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781331051 JXUOJOFODDMISZ-SNUQEOBHSA-N 481.363 0.749 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)Cc2ccccc2)C1 1781895096 HJXHWSOOSOGYLR-BPYKYCOYSA-N 481.553 0.416 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)c(N(C)C)c(F)c3)C2)C1 1782110246 RTVYTBZKHAGDPZ-QFIPXVFZSA-N 467.517 0.847 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)COCCOCCOCCOC)C2)C1 1783685539 DISDXSDYORVURU-YLJYHZDGSA-N 495.411 0.686 50 20 JCGD CNC(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785075615 SBHOKPWSJDUBAY-AJNGGQMLSA-N 460.959 0.234 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)c2c1 1785179864 JSPOHQYUFOBCQD-OEOAZWSVSA-N 475.354 0.992 50 20 JCGD Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)s1 1785251138 FHHZULQIVPBDBL-YYWHXJBOSA-N 456.373 0.962 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978815 YZWDEYQFTJLYPB-YSMRIERISA-N 469.259 0.174 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cncn3)[C@H]2C1 1787084849 KIDVXZWAVLGMPS-VGWMRTNUSA-N 470.958 0.390 50 20 JCGD N#Cc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1Cl 1789268005 MBVAJEBBISBPCK-VDGAXYAQSA-N 467.718 0.799 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3CCN(C)CC3)[C@H]2C1 1789801837 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IBCPJQCZPIQIGN-MFKICJERSA-N 464.283 0.644 50 20 JCGD CCOc1c(F)c(F)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1F 1799771698 OARNHZFUFVGAGT-VTEUUUEMSA-N 492.259 0.699 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCNC3=O)C2 1800759598 XOHBLVWHXZHIFG-OHTBPHCPSA-N 454.325 0.003 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS(=O)(=O)c1ccc(C)cc1)C2 1800974968 CCFYDBCNCPBEGI-LORHWOILSA-N 458.964 0.612 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)c1 1803141456 OEFTWBBJZGOXDS-OLMNPRSZSA-N 466.947 0.799 50 20 JCGD Cc1noc(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804244256 JLGACEDCJUDIKL-XXBNENTESA-N 462.315 0.929 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCC4(CCCN(C(=O)[C@@H](O)CCl)C4)CC3)n2)CCCN1 1805517801 HSGDWMJWDBAJAX-SFHVURJKSA-N 477.993 0.852 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)Cn3nnc4ccccc43)C2)CC1 1806511616 SUQSUCBWILOJSE-UHFFFAOYSA-N 476.541 0.975 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CN2CCNC2=N)[C@@H]1c1cccnc1 1807114961 GOLUPMDLWZXBFP-SSZMOEMMSA-N 479.545 0.061 50 20 JCGD CCOC(CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)OCC 1807375670 UMWYGRWLFXSDGE-AUSIDOKSSA-N 469.347 0.870 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807943298 TVCCAEQEEQDAIU-MLGOLLRUSA-N 475.307 0.312 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)N1 1808321867 LWINCNFIAMRUIZ-DTYCBIMDSA-N 497.980 0.802 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)[C@@H](N)Cc2cccnc2)[C@H]1c1cccnc1 1808365217 VPYGRGFZBJOWQG-SXWKCWPCSA-N 467.574 0.425 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC2(CCCN(C(=O)[C@@H](N)CCC(N)=O)C2)CC1 1809684220 OSPVGWGJLVEATF-SFHVURJKSA-N 489.529 0.958 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810324901 YUHQNRAMVZJYSY-XWFZLUIHSA-N 474.330 0.372 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(Cl)nn1)CC2)c1cccc(B(O)O)c1 1815360263 DHHFEGCEOXYABJ-GFCCVEGCSA-N 457.708 0.806 50 20 JCGD COC(=O)C12CC(C(=O)N[C@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)(C1)C2 1815361899 TWRXSDVGCXGTJE-DRKNDHHNSA-N 469.328 0.392 50 20 JCGD COCCOCC(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817279927 LYIQNXFBGHSOEY-XIXVAHAYSA-N 462.532 0.852 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnn2ncccc12 1817954144 NVFNMMQMUVSLRO-LJQANCHMSA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(=O)oc2)[nH]n1 1819401945 GPKVTXKTYUGDRU-MRXNPFEDSA-N 451.443 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCC3)CC2 1819798140 YVHKWUFCVSDCRO-NSHDSACASA-N 466.527 0.824 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1820142845 RFPXGHOQWYBBEP-GHMZBOCLSA-N 457.516 0.058 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3n[nH]cc3[N+](=O)[O-])sc2C1 1820300037 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JGTADQFHDVXNPA-QEOTZNIISA-N 466.332 0.691 50 20 JCGD Cc1noc(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804246422 ZNZGGPWOLCRHLU-AUSIDOKSSA-N 462.315 0.929 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n(C)n1 1804928664 LBLAAOGEZKDEIM-KKSFZXQISA-N 457.535 0.516 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807360284 JVOSXMPCAQRLIQ-NQIIRXRSSA-N 473.298 0.115 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807367610 TYEPNAYIASMJPE-DENIHFKCSA-N 465.315 0.590 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2ncnn2c1 1810053064 SEUQUVTXGYLYNP-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)o1 1810293280 BGNZQTCLOBQQAB-GCJKJVERSA-N 476.298 0.946 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1nc(O)n2c1CCCC2 1810589691 JIUPNQTZSPLCEB-AVRDEDQJSA-N 489.341 0.633 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccn(C)c2=O)[C@H]1c1cccnc1 1813069191 VUWKAMAKZBVAIR-UTKZUKDTSA-N 454.531 0.473 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1)C(Cl)Cl 1813079887 JFXNSOWORDEKBZ-GWCFXTLKSA-N 451.274 0.331 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813419022 YGILUCVZVFRAEH-SFGWALBWSA-N 455.563 0.993 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)CC2)c1cccc(B(O)O)c1 1815360089 LVAPEQPFVISHTA-CQSZACIVSA-N 482.283 0.976 50 20 JCGD CC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)n[nH]1 1815799984 VNQRXLBIUWGXQX-JSGCOSHPSA-N 490.952 0.867 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4c(n3)OCCO4)sc2C1 1816955342 NJARRRXIACHRPP-LLVKDONJSA-N 495.521 0.847 50 20 JCGD COCCn1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)n1 1817618372 PBFMXNYDRNSHKT-ZDUSSCGKSA-N 463.564 0.585 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(C)C(=O)C(=O)O)[nH]n1 1818113414 KUQFBMZNVMGTJQ-ZWGXDWAISA-N 486.489 0.079 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1 1821658113 OWGDTPPSNRRXSS-HSOLMKNUSA-N 479.501 0.793 50 20 JCGD COC(=O)C12CC(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)[nH]n3)(C1)C2 1822145226 ZQTZWGYVWOIEHP-UIFUMHDPSA-N 466.303 0.739 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CSCC(=O)O)n[nH]1 1822430374 PJXKMNWJMIWINF-AWEZNQCLSA-N 461.504 0.532 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2cncnc2)CC1 1825286597 FJJHIZJQVYICEH-FQEVSTJZSA-N 451.531 0.951 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1825731471 CDKXMNIBWVHXAY-IBGZPJMESA-N 469.546 0.974 50 20 JCGD CCOc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1 1826080529 PHSSYMWCFMCIFT-LBPRGKRZSA-N 461.548 0.931 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1Cl)CCO2 1829498012 YJWWBICDSLGLGR-WGLQLPMYSA-N 488.932 0.939 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1 1829771173 JRPOIFMZQHAIOI-RVBASHTNSA-N 458.353 0.475 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc(Cl)c(F)c1)CCO2 1830296380 ZUBXISHWISISJR-JOCHJYFZSA-N 484.956 0.851 50 20 JCGD CCOC(=O)C1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](C)CBr)CCO3)C2)CC1 1830544150 OPNLDYSXFMCMEX-KDOFPFPSSA-N 461.353 0.817 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(C(F)(F)F)o1 1830728732 XJCQJORLMXYSAW-BZNIZROVSA-N 455.817 0.672 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830738631 RAMYQLYUWXDQDI-YVHKJVDXSA-N 489.997 0.736 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1832296883 WXLBNWBHBVRXRG-FQEVSTJZSA-N 451.332 0.821 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CNC(=O)OC(C)(C)C)CC2)CC1 1833271984 DUPDJWNIPOOPOI-QZTJIDSGSA-N 491.029 0.697 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833317346 MGLIXGOLMHPYED-JOCHJYFZSA-N 456.396 0.036 50 20 JCGD CN(C)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1833665204 GARVNSXPCPOPJA-QAPCUYQASA-N 459.316 0.908 50 20 JCGD Cc1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)cn1 1833808027 BNAPVYUSUFTMNL-HTAPYJJXSA-N 497.980 0.987 50 20 JCGD O=C(c1scnc1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1834570912 SGIZEHNPGCXGAV-BONVTDFDSA-N 457.858 0.832 50 20 JCGD Cc1nc2ncccn2c1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835374853 AZMHMJHWTFWCBG-UHFFFAOYSA-N 484.605 0.596 50 20 JCGD Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c2cccnc21 1835638345 YRBCXYPRHWNUDW-UHFFFAOYSA-N 489.385 0.752 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1 1835837550 MFRADWSUHZYVKY-UHFFFAOYSA-N 451.600 0.925 50 20 JCGD O=C(CCCC(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927166 JQAIMIVRHSGAJS-LJQANCHMSA-N 458.242 0.169 50 20 JCGD C[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1ccccc1 1835932011 KNNKUUOGJLOVSS-KBMIEXCESA-N 466.343 0.630 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCCC3(F)F)C2)C1 1835934112 OLASLWWUOPCFFC-GHTZIAJQSA-N 466.290 0.262 50 20 JCGD Cn1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ccc1C(F)(F)F 1835936794 DMLACLSLROMAKP-OAQYLSRUSA-N 495.263 0.108 50 20 JCGD Cc1oc2cc(O)ccc2c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835937486 ZJAQVFJJPVGZHM-VWLOTQADSA-N 494.309 0.510 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c12 1835939203 HFTAFDVIKDZDRM-VWLOTQADSA-N 493.325 0.240 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1 1837715705 FVGKPPOQOVWPRH-DENIHFKCSA-N 450.608 0.898 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1837835439 INJVVGQFHSELKF-HNNXBMFYSA-N 484.328 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C3CCCCC3)CCO2)C1 1839184690 YXTBLLBSCMRQJT-YIEPXFBBSA-N 450.580 0.952 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201928 NUZXLSRNSACDBA-SJLPKXTDSA-N 470.299 0.419 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nsnc3NC)C2)C1 1839961950 OAPASYYRSGOKRW-ZBEGNZNMSA-N 462.370 0.823 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)C(=O)c3ccccc3)C2)C1 1840030688 SWQCJELTXSJNST-KKSFZXQISA-N 482.375 0.998 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)c(F)c3)C2)C1 1840184110 SLODIWWWRALPCY-QFIPXVFZSA-N 468.501 0.337 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(F)(F)F)n3C)C2)C1 1840184354 HTUSNZMJIPWAQB-HXUWFJFHSA-N 489.495 0.487 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc(=O)c(OCc3ccccc3)c[nH]2)C1 1842131604 VQMNOOFMHPWEET-UHFFFAOYSA-N 487.321 0.765 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1843382706 HZMJAQBUAOYVRK-MRXNPFEDSA-N 476.534 0.042 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1 1845823377 YEZHZSSTIILWNG-UHFFFAOYSA-N 473.574 0.668 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@H]2Cc3[nH]nc(C(F)(F)F)c3C2)C1 1845857566 VEIIOWSQQRLFFA-LLVKDONJSA-N 477.447 0.659 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@@]21C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846190935 LGJOSLXMJIYKOO-OWJWWREXSA-N 484.557 0.902 50 20 JCGD Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)CNC(=O)c2cccs2)c1 725740012 AMBHGQMVMUQACI-UHFFFAOYSA-N 473.540 0.798 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNC(=O)CNC(=O)c2cccs2)CC1 726099234 IHCZAIVIJIODRE-UHFFFAOYSA-N 468.580 0.751 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)c3cccn3C)CC2)c1 726538546 OSQRQHXBBRDHSM-UHFFFAOYSA-N 475.571 0.716 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc2)cc1 726613028 CPPNAENUNJSASH-UHFFFAOYSA-N 460.512 0.653 50 20 JCGD CS(=O)(=O)Nc1ccsc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728329183 KAGRJWZLBIIQDZ-CYBMUJFWSA-N 455.470 0.264 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)c1 728529543 COADBGZWPNOASC-UHFFFAOYSA-N 462.260 0.478 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)C1CCN(c2ncccn2)CC1 728848133 WSKBNHFQIXLENL-AWEZNQCLSA-N 471.449 0.941 50 20 JCGD NC(=O)[C@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)CNC(=O)c3cccs3)c2)C1 731043264 DRLRVORDAFWXCE-KRWDZBQOSA-N 472.571 0.706 50 20 JCGD COC(=O)c1c(C)cccc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 747407998 AAYPVTZYEFHVIP-UHFFFAOYSA-N 469.541 0.720 50 20 JCGD COc1ccc(N2C[C@H](C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)cc1 913395351 FPDVHSURVNDISF-AUUYWEPGSA-N 469.450 0.579 50 20 JCGD Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 913600793 KEXSJSRXDGTCTB-UHFFFAOYSA-N 480.568 0.519 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(S(=O)(=O)N(C)C)cc1 918104350 IACDYPBMHLKOMN-CYBMUJFWSA-N 482.588 0.935 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1)N[C@@H]1CCS(=O)(=O)C1 919886348 RHDPHHOAOUUKRC-TZMCWYRMSA-N 462.450 0.571 50 20 JCGD COCCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1 920814206 FUFNLTWYHULBLH-UHFFFAOYSA-N 467.592 0.916 50 20 JCGD O=C(COc1ccccc1F)NNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 921199512 KVZYKLGWPDBLEX-UHFFFAOYSA-N 455.424 0.422 50 20 JCGD CCc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc(C)n1 1779030246 LUCAOQMTGIYIBH-HSZRJFAPSA-N 452.515 0.708 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CC(=O)Nc3ccc(F)cc3)CCO2)C1 1779032852 YKWWIYYXQQQAKN-HSZRJFAPSA-N 484.488 0.297 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc(Cl)s1 1779837746 LILDVRWUEFUWKU-OXQOHEQNSA-N 463.752 0.918 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnc[nH]1)C2)NC(=O)NCc1ccccc1 1780559395 JRUAHMRSGIFNRZ-PXDATVDWSA-N 497.600 0.812 50 20 JCGD Cc1ncoc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968595 CAYZQTAKVREGTJ-HSZRJFAPSA-N 470.530 0.773 50 20 JCGD O=C([C@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1781325958 KDHUUENWGBIIHX-WRWORJQWSA-N 453.158 0.862 50 20 JCGD COc1c(C)cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1C 1781871830 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CC[C@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1792536778 YWAFPAXRULKNLD-ZDUSMZPESA-N 476.486 0.638 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1793088877 OYLWKZLMKSOJSA-FONWIUJUSA-N 492.342 0.845 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCN(Cc2ccccc2)C1 1793754335 VDRKFARHMQDEJS-FUCAVZNHSA-N 485.629 0.861 50 20 JCGD O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1795115020 YSDVWSKEZYKOID-YWVIFJGQSA-N 471.377 0.266 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(C(F)(F)F)c1)C2)c1ccc(B(O)O)cc1 1795732473 JXMXYBVWOWEPFC-JLVBRIDZSA-N 463.221 0.297 50 20 JCGD COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c(Cl)c1 1795737263 MDNFPAKDXBGQFK-FAQVEIGNSA-N 472.734 0.474 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)nc2n[nH]cc12 1796057853 NQNKQUFHPWBKLC-KSPBDQMDSA-N 463.926 0.188 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)Cc1ccccc1)C2 1796446451 XQOFWHWPJKEXMX-LDYDBURKSA-N 467.526 0.314 50 20 JCGD COc1ccc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)[nH]c2c1 1796916166 IYCZJCHAWUGMHU-FAQVEIGNSA-N 463.299 0.373 50 20 JCGD Cn1c(=O)n(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c2ccccc21 1797172080 YQWFUHOIRRQWEF-LZDSYCOUSA-N 469.311 0.620 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)c2n1 1797435356 RQJQSUDRFBFMLN-MUJYYYPQSA-N 462.514 0.910 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)NC(=O)NCc1ccccc1 1799094989 OGNIWWFWEQLPQX-CYGHRXIMSA-N 455.918 0.457 50 20 JCGD CO[C@H](C)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)N(C)C(=O)OC(C)(C)C 1799169758 JQCJWCNYZXLOTC-BPXZUEPWSA-N 477.986 0.446 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 1799198598 WNJJQXRECKXHCZ-KLOLGFOXSA-N 490.395 0.587 50 20 JCGD 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495.536 0.581 50 20 JCGD O=C1NCc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Br)C4)C3)ccc21 1837152528 RSOLGEKRLHJFGE-BEFAXECRSA-N 470.295 0.691 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)nn1 1838754707 RJHDKMMUDRFQQO-SFHVURJKSA-N 458.357 0.888 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839144848 MGYGKHJVQWNOSG-BUFPBVFASA-N 453.927 0.594 50 20 JCGD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200624 MSDGHGBQUQQQQG-RISCZKNCSA-N 450.221 0.078 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CCO2)C1 1839789242 SXAGXTIKBQVNKA-JXFKEZNVSA-N 473.885 0.987 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS(=O)(=O)CC)C2)C1 1839962392 CSAKNDZFGCJYEL-XJKSGUPXSA-N 455.371 0.051 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccc(F)cn34)C2)C1 1840154821 HKJWRCCHNSTVFW-QRWLVFNGSA-N 454.886 0.797 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccoc3)CCO2)C1 1840515080 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CCCOc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCSCC2)cc1OC 730583138 JCMDIRNOAPRENP-UHFFFAOYSA-N 460.578 0.807 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COc2ccccc2O)cc1 730782798 VVYIJEAVPIWXEL-UHFFFAOYSA-N 450.473 0.198 50 20 JCGD O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 742457537 HMYSOACXYYOTMC-ZDUSSCGKSA-N 475.449 0.701 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCC2CCN(S(=O)(=O)c3ccccc3)CC2)c2ccccc2c1=O 747310334 KXNBEVURCKFRJG-UHFFFAOYSA-N 498.565 0.978 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)c1ccccc1 750225304 JKBWIYLIVSBMSL-UHFFFAOYSA-N 476.330 0.793 50 20 JCGD CCCn1nc(C(=O)NNC(=O)Cn2cc(Br)c(O)nc2=O)c2ccccc2c1=O 753118065 NBWSOPHLCRCCSQ-UHFFFAOYSA-N 477.275 0.293 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)NC1CCCCC1)c(=O)n2Cc1ccccc1 771814234 CRSOAOFLKLAPSS-UHFFFAOYSA-N 497.556 0.718 50 20 JCGD C[C@@H](NC(=O)c1cccs1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 812553078 LHAYYNTYQCZDBL-CYBMUJFWSA-N 466.541 0.349 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=C1CCn3cccc31)c(=O)n2Cc1ccccc1 818248111 HJEBTFODFUBRPL-UHFFFAOYSA-N 475.509 0.780 50 20 JCGD O=C(NNS(=O)(=O)c1cc(C(=O)O)sc1Br)c1ccc(-n2cnnn2)cc1 915185176 VKOPCCQKVNXOHE-UHFFFAOYSA-N 473.290 0.808 50 20 JCGD CCn1nc(C(=O)NNC(=O)[C@H](Cc2cccc(OC)c2)n2nnnc2C)c2ccccc2c1=O 916123242 RQFDQFKBOBDWCI-IBGZPJMESA-N 476.497 0.965 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)Cc3nc4ccccc4n3C)CC2)cc1 916736239 BSQNATXVNYATRX-UHFFFAOYSA-N 484.582 0.578 50 20 JCGD O=C(CCCOc1ccc(I)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919889010 SYVPSTRJDPADOV-GFCCVEGCSA-N 481.312 0.968 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc4c(F)cc(F)cc4[nH]3)C2)C1 1777797404 NPJMWBSTUQQBDT-HSZRJFAPSA-N 469.253 0.883 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028728 OKXSVORIKWVKTK-DEOSSOPVSA-N 496.524 0.403 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3nccc3c1)C2 1779372416 HXOXYJGBFNTIIZ-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD CCC1(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)COC1 1780969065 UQVSGIHWCVFCIP-DEOSSOPVSA-N 473.574 0.589 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccco1)CCO2)NC(=O)NCc1ccccc1 1780969509 MOGJUJLQTMQRQI-ZJSXRUAMSA-N 485.541 0.489 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1N(C)C 1781128960 ZBQDJVJQUHRAKB-XMMPIXPASA-N 467.331 0.198 50 20 JCGD Cc1cc2nnc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)c(C)n2n1 1781329176 ANCFCQVIFCJKFL-WMLDXEAASA-N 455.288 0.875 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1782040877 HPRPJHSYNYIBMB-QHCPKHFHSA-N 460.531 0.680 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1782103252 RANNIWKOMDDXCQ-QFIPXVFZSA-N 484.469 0.365 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782213928 ATFSONLSPREYFV-ZVVFGRKBSA-N 478.590 0.629 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3ccnc13)C2 1782214815 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50 20 JCGD CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792978165 IJXPYOUZWNBGKS-NPJQDHAYSA-N 480.027 0.822 50 20 JCGD CC(=O)NCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793879243 SADUWEXCOBQTHT-IVSAIRAKSA-N 460.959 0.234 50 20 JCGD CC(=O)N(C)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793993853 VFPRJMHWOUYGLM-WKCHPHFGSA-N 472.590 0.839 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(N(C)C)c1 1794294857 WBYPPGQXBDOKKN-KEMUROEHSA-N 467.530 0.485 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)CO2 1797449387 PYDANUSOPIODHA-CNWLLUGOSA-N 494.508 0.355 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(F)cc13)C2 1797751914 ZDSMCPUTHMCHIB-KSPBDQMDSA-N 467.461 0.218 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1799796966 ZVMPKGBOZSGPQM-VTEUUUEMSA-N 497.512 0.176 50 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C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1810356022 APQMWGMVMNNIOQ-YBKUAAOGSA-N 455.353 0.521 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnc(N(C)C)o2)[C@H]1c1cccnc1 1813069772 BPCIIFAYXKHLFV-UZLBHIALSA-N 457.535 0.828 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCNC(=O)C2)[C@H]1c1cccnc1 1813134108 MCBLNHKPWDVMSN-DYSWHZDDSA-N 479.541 0.748 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1nn[nH]c1C(F)(F)F)CC2)c1cccc(B(O)O)c1 1815360341 GGAAMVROURKFAR-JTQLQIEISA-N 480.237 0.499 50 20 JCGD NC(=O)c1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1 1815361709 OBCHBDBTGZEZIM-INIZCTEOSA-N 464.312 0.461 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3n[nH]c4c3CS(=O)(=O)C4)sc2C1 1815854750 WVOGKVKUIXQXRX-SCZZXKLOSA-N 473.964 0.774 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470489 SGFBSHJAIPDPSC-RXQFDZFGSA-N 451.292 0.254 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ncnn2C)[nH]n1 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COc1ccc([C@@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1830450573 VJMURTSVCXJQFL-CRICUBBOSA-N 497.552 0.567 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830739181 ZALKVMGSTPLEKH-UWJYYQICSA-N 453.923 0.058 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cc(C)on3)C2)C1 1831652108 WEPUXZQQAHDDMY-QRWLVFNGSA-N 456.927 0.577 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1832904267 YEVMOAXNZMOWCD-XMMPIXPASA-N 482.541 0.091 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)C(C)C)CC2)CC1 1833347616 NJCFAXAJXPSNIK-NTRYICDMSA-N 460.579 0.709 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cccc(=O)n1O 1833962534 GPWKYMCIBAQJAI-MRXNPFEDSA-N 459.316 0.961 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)cco3)CCO2)C1 1834600612 PYMHTOQVIZPEHP-KSFYIVLOSA-N 499.948 0.842 50 20 JCGD CCc1[nH]nc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1Cl 1834800042 NKONUITUTNPPFF-UHFFFAOYSA-N 487.797 0.804 50 20 JCGD Cc1cc(C)nc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834800094 PURUCVOBGCZWSV-UHFFFAOYSA-N 464.375 0.877 50 20 JCGD Cn1c(=O)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)nc2ccccc21 1834821207 BHOZMYJECQAMIC-OAQYLSRUSA-N 493.358 0.789 50 20 JCGD CC(C)Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n(C)n1 1834946700 HCWXZYDRZNQLPP-UHFFFAOYSA-N 495.433 0.797 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)C3CCC(C(F)(F)F)CC3)C2)C1 1835927569 TWDJDYXRUGZLOE-CWZMJNCASA-N 498.307 0.805 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931792 CVEUBRADHCBQPX-RUZDIDTESA-N 482.342 0.376 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn3nccc3c1)CCO2 1837158379 DFGWLHATXNGYJO-FXZATJRASA-N 493.524 0.538 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)N1C[C@@H]3C[C@H]3C1)CCO2 1837279187 NULWEDALXSFCFB-WDHIOAMHSA-N 458.397 0.814 50 20 JCGD CC(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)on1 1837459359 DINYPFZWHNXWHP-JOCHJYFZSA-N 472.502 0.180 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837636867 PPLKQGRVQLNEIC-RAIXIZIVSA-N 453.923 0.926 50 20 JCGD O=C(CCc1ccc[nH]1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919355 IKBNIAZQNHOOCK-UHFFFAOYSA-N 453.348 0.940 50 20 JCGD O=C(c1ccnc(Cl)n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837924428 AUBJEXMTLDMENE-XHDPSFHLSA-N 451.680 0.891 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)Cn3ccccc3=O)CC2)CC1 1837934405 IJNCBCMZFXXVLW-UHFFFAOYSA-N 461.563 0.220 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn(C(F)F)n1)CCO2 1838033665 PEZAVIUMUQILTN-NFCNUSAFSA-N 493.471 0.482 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)cc(Cl)n1)CCO2 1838242808 SBAJZBIEAYSYAG-FQEVSTJZSA-N 488.372 0.831 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838501477 GYVCHHGSYKMQFP-PMACEKPBSA-N 484.340 0.396 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN(C)C(=O)C(=O)O)CC2)CC1 1838729187 RHRAMMGJBRDZFN-HNNXBMFYSA-N 476.368 0.702 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2 1838862862 RLWHFENUQWGFTP-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD O=C(c1ccc2nn[nH]c2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839203055 YIDNOFWAVSJPIB-PBHICJAKSA-N 456.272 0.718 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C4CC4)cc3)CCO2)C1 1839439624 VMKOSTIHLUOPDM-VWLOTQADSA-N 479.537 0.946 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840045235 YRAIIRASFOZPJM-YVHKJVDXSA-N 489.997 0.832 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1 1840185291 JIEOGAJOQRRBDI-NRFANRHFSA-N 493.952 0.054 50 20 JCGD Cc1nnc(CC(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)o1 1845038668 GPNZVABPBVRKGJ-UHFFFAOYSA-N 455.519 0.470 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@]1(C)CN(C(=O)OC(C)(C)C)CC[C@@H]1O)C2 1846383541 IPSSQTCYYUPIMJ-SBUREZEXSA-N 495.621 0.571 50 20 JCGD C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)C2=O 15314605 SHVCXJGAINEIIP-MHECFPHRSA-N 470.574 0.847 50 20 JCGD COC(=O)CCc1c(C)nn(-c2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)c1C 16786250 VDNZOWATOFZVQY-MRXNPFEDSA-N 462.528 0.790 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2cccc(N(C)C)c2)c1 17252024 VAXAKQOSYFVSLX-UHFFFAOYSA-N 475.571 0.974 50 20 JCGD COc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1 725871071 BYZWOHJMWLKCCS-UHFFFAOYSA-N 481.556 0.234 50 20 JCGD O=Cc1ccc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 727366492 KJKQWASTLOSSCX-UHFFFAOYSA-N 475.523 0.679 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 728377878 RDQCANFNJUPNFI-SECBINFHSA-N 491.897 0.609 50 20 JCGD COCCCN1C(=O)C(=NNC(=O)[C@H](C)NS(C)(=O)=O)c2cc(Br)ccc21 728434781 PXEWRYWWVJQFPY-JTQLQIEISA-N 461.338 0.590 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Br)s2)n1 728728979 GYCSBGTWUZBQHX-UHFFFAOYSA-N 475.346 0.939 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(COc2ccccc2)o1 746385472 DOTVDMQEFMVCGN-KRWDZBQOSA-N 456.499 0.800 50 20 JCGD COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(C)c1 747692330 LECCWTXQQFRFAO-UHFFFAOYSA-N 461.905 0.706 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1cccc(-n2cnnn2)c1 912643254 MSLXEMKUFBTUNF-UHFFFAOYSA-N 455.500 0.912 50 20 JCGD COc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)ccc1OCc1ccncc1 912808692 OJCJQMBRKUMFFS-UHFFFAOYSA-N 470.511 0.704 50 20 JCGD CCn1nc(C(=O)NNC(=O)Cc2cc(F)c(OC)c(S(N)(=O)=O)c2)c2ccccc2c1=O 915594613 SOSHKYHITPLTEM-UHFFFAOYSA-N 477.474 0.215 50 20 JCGD CCN1C(=O)c2ccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2S1(=O)=O 917520964 GMHZTQXABCQSRU-UHFFFAOYSA-N 465.513 0.219 50 20 JCGD CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(OC)c([C@@]3(C)NC(=O)NC3=O)c2)cc1OC 917727125 CWIPBVFOPDZULA-OAQYLSRUSA-N 492.510 0.780 50 20 JCGD COc1ccc(CC(=O)NCc2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)cc1 918551321 SKPHUFBDKKQIBR-GOSISDBHSA-N 459.524 0.750 50 20 JCGD C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)C1 919886393 WDNKOWYLRNINLS-HIFRSBDPSA-N 458.562 0.238 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1)N[C@H]1CCS(=O)(=O)C1 919889493 NBSLWUBWJNZYIC-HNNXBMFYSA-N 498.608 0.626 50 20 JCGD NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 920017798 DVWXEJJMAQYBRZ-IXRWAAFTSA-N 464.478 0.777 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1 920030198 UHXMAPMVZYMYQT-HXKWKUIBSA-N 461.478 0.888 50 20 JCGD CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)CN2CCCC2=O)ccc1Br 920435942 QGFDRWDGFHDLPK-UHFFFAOYSA-N 475.365 0.909 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)Cc1cccnc1 1115984551 KFSIBIAXYUXTGE-MRXNPFEDSA-N 497.371 0.767 50 20 JCGD COc1ccc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)[nH]c2c1 1779030194 IPWNXMOBPYCULM-DEOSSOPVSA-N 478.509 0.932 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2 1779036090 WZJPGDZQWZNXPU-HSZRJFAPSA-N 467.501 1.000 50 20 JCGD CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCS(=O)(=O)CC1)C2 1780700064 LELWWPMQULSTMG-GPMSIDNRSA-N 450.001 0.248 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1780931379 NKGHJIFEYYTRDG-WWMYMODYSA-N 491.894 0.581 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1)NC(=O)NCc1ccccc1 1780970633 WEEALFSGRTYESS-BWKNWUBXSA-N 487.601 0.979 50 20 JCGD Cc1c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc(Cl)cc1[N+](=O)[O-] 1781999484 IBODZXSTUCEECH-JOCHJYFZSA-N 487.705 0.994 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@]2(CN(C(=O)CNC(N)=O)CCO2)C1 1782871237 QHZDXPAXBATROY-ULXKQSRTSA-N 476.331 0.854 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCNC(=O)C3)C2)C1 1784031665 NNEXVXAAIZNIEQ-LRAJWGHMSA-N 472.970 0.475 50 20 JCGD CCc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)c1Br 1784089477 DITXWGMEFMMXTD-IMIFBBOLSA-N 477.787 0.938 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1CCc2ccccc2[C@H]1O 1784149078 OJUWISQPUXDFJV-KGZUAYNTSA-N 478.354 0.256 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785583873 QRGLNMPWSXTYGO-SBUREZEXSA-N 483.610 0.883 50 20 JCGD CC(C)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)C(C)C 1786962124 KPZXBKBRYMJWGT-KNTRFNDTSA-N 460.579 0.301 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C[C@@H]21 1789867977 KIBGVGBBVKUVNG-IUVQAAGXSA-N 484.446 0.874 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)c1ccc(O)cc1 1789886528 OBGFBWYLYQOMMN-ACRWPFGISA-N 467.526 0.788 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C[C@@H]21 1791058287 VPWTWRKGZDNBPM-CWVYHPPDSA-N 491.427 0.992 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)OC(C)(C)C)[C@H]2C1 1792125202 BXSPEYDVBPFCHC-ULQDDVLXSA-N 469.583 0.254 50 20 JCGD O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1795111520 VGZZMZVUPKAEJI-OVZMXSCWSA-N 469.336 0.367 50 20 JCGD O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2 1795117384 VGPZRGHJPVEEMN-WDAIWFPHSA-N 450.380 0.221 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc[nH]c2nccc1-2 1796185059 HJHXDBCZLJEKMW-UTRJNVLQSA-N 463.498 0.852 50 20 JCGD Cn1cnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1C(F)(F)F 1796190935 FIQMKZZTPOIFQJ-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2Sc3ccccc3[C@H]21 1797762662 AIHROSWFHBXNBW-LDDAGVOWSA-N 479.562 0.776 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799098197 BBWJYUBTBFOJFI-DXKRWKNPSA-N 497.600 0.455 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1800710371 FUPQWGDJBMCDQF-VPEYGQHGSA-N 477.961 0.915 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2 1800754545 RBMNHDGUAHNLSS-RKQHYHRCSA-N 464.357 0.245 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)C2 1800758442 ZEJIPRFNROSXNE-BKEDOTJMSA-N 494.390 0.395 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800779339 CVTQZKSNEHFCHC-BPKGMFCQSA-N 459.971 0.965 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)C2 1800980924 HKKOBOULSHUXMN-SVZOTFJBSA-N 491.969 0.286 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1C(=O)Cc3ccccc3C1=O)C2 1802333861 DHEYHYDLRWKGFR-REPLKXPHSA-N 483.569 0.613 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC2(CCN(C(=O)[C@@H](O)CCl)CC2)C1 1805256367 ZYPPARCUJPEBAE-NEWSRXKRSA-N 465.978 0.997 50 20 JCGD 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486.342 0.929 50 20 JCGD Cn1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(C(F)F)n1 1837919283 BOBNGPRFZNYBHT-UHFFFAOYSA-N 490.316 0.964 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1 1838051634 NMPPIUMLDJSOIT-VFNWGFHPSA-N 463.922 0.796 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3cnnn3)CC2)CC1 1838103012 KSWYHMIXKZAKPN-JZCUADNKSA-N 485.549 0.367 50 20 JCGD O=C(NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1ccco1 1839198932 GLXLPYQTRFCWSY-RHSMWYFYSA-N 462.272 0.156 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1839961579 BODMKXVAHXFDFF-CRAIPNDOSA-N 464.426 0.665 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1840034402 JTTRXFJUEPFGIA-VQIMIIECSA-N 473.412 0.006 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840105518 OCDCOHPFKOZYML-RTBURBONSA-N 450.363 0.692 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)C1 1840150484 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CC(C)(C)OC(=O)NCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1827971775 MJMGBPGUXQSSTG-OAHLLOKOSA-N 488.375 0.964 50 20 JCGD COC(=O)CSCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923316 DLFCECLMDHHIHZ-SFHVURJKSA-N 477.587 0.825 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1C1CC1)CCO2 1830492974 BCSZHNQBZCNEHJ-ICPIIWFBSA-N 457.531 0.623 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1NC(C)=O 1830732995 ZISFJIMCTJWJJO-LAUBAEHRSA-N 469.922 0.323 50 20 JCGD O=C(C1CCN(c2ccccn2)CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733524 OMXILSBYHDQCOT-PGRDOPGGSA-N 466.966 0.354 50 20 JCGD COc1ccccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830991997 IJUSPUYVPZYBHB-VWLOTQADSA-N 482.342 0.078 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc(Cl)s1)CCO2 1832607639 OVYZYDQUFAJASF-HXUWFJFHSA-N 472.995 0.773 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ncc(F)cc3F)CC2)CC1 1833601648 IZIQERNQGPNFJI-UHFFFAOYSA-N 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CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(-n3cccn3)cc1)CCO2 1783935437 SXOAZUXUEOCOBC-QHCPKHFHSA-N 454.531 0.689 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)nc1Br 1783935450 UIEAWCOPRXORKK-HXUWFJFHSA-N 498.378 0.669 50 20 JCGD COc1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)ccn1 1785105172 AQENVYPNJNUIAQ-VDGAXYAQSA-N 482.541 0.315 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)n1 1787506790 NIUSGENPDWYKIP-VCNDSEKESA-N 495.540 0.767 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21 1787508408 WKGDPOUITYIUNO-RUMLJDHFSA-N 468.352 0.884 50 20 JCGD COc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)c1F 1787508648 FLDFUVXBFMGOEA-ZEYHFOIASA-N 486.504 0.957 50 20 JCGD NC(=O)c1ncccc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788146001 QDKHCASMZJAIQW-UHFFFAOYSA-N 458.283 0.922 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)cn2[nH]cnc(=O)c12 1788763251 AUKHXKFRZPOOHZ-XIRDDKMYSA-N 461.595 0.776 50 20 JCGD CSc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789069183 MZTGUJFWOSKYKK-SNRMKQJTSA-N 455.345 0.390 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)cc([N+](=O)[O-])c3)[C@H]2C1 1790216926 XKNGLHVMYSJEQC-KKXDTOCCSA-N 463.491 0.267 50 20 JCGD N=C1NCCN1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)Cc3ccccc3)[C@H]2C1 1790780879 YJSFLULCTKFIQH-VJANTYMQSA-N 492.418 0.812 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(S(C)(=O)=O)c3)C[C@@H]21 1791252879 VHRUMRRICPCEEW-SJWGOKEGSA-N 459.952 0.332 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21 1791543024 QCEJECTZFPLTPS-KANFNMMFSA-N 465.627 0.288 50 20 JCGD CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792981850 XUYRROPJASWLSS-NNXHMXCWSA-N 475.970 0.202 50 20 JCGD Cc1cc(Br)cnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1794965600 BYRAFJGHDGJUKV-HBCWATKFSA-N 482.379 0.729 50 20 JCGD CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736939 PCKXZKHZKRQCRH-PIKOESSRSA-N 489.378 0.263 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c(Cl)c1OC 1795737675 IWTYSTDEWJUPSP-YVWYUNDQSA-N 488.733 0.554 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(Cl)cccc13)C2)c1cccc(B(O)O)c1 1795741287 RYSXPPWPFRFEIY-ZSBFGKGUSA-N 468.706 0.413 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)n[nH]1)NC(=O)NCc1ccccc1 1796146339 YTTIJRFAEGQFOE-BJWYYQGGSA-N 455.519 0.713 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cn2cc(Cl)ccc2n1 1796849180 MFDCGMUEHDLUHR-YVWYUNDQSA-N 468.706 0.185 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc(C)c(C)[nH]c1=O)C2 1796890685 FBEWBLVUUCWTIV-LCFLCXBCSA-N 453.503 0.773 50 20 JCGD C[C@H](Sc1cccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1797596504 BEIABHAAIZIPAH-AMVTXUCVSA-N 460.386 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(N3CCOCC3)n1)C2 1798440229 HSUAOEUKCZYYNT-BJWYYQGGSA-N 479.541 0.482 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccnn1)C2 1798523173 VEFRSGXEVNIJSE-USGNIVHTSA-N 485.453 0.592 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCn1cncn1)C2)NC(=O)NCc1ccccc1 1799869611 UJRONFSAFZVORP-ACDBMABISA-N 468.562 0.653 50 20 JCGD Cc1ccn2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)cnc2c1 1800084953 FUIOGIZCVGOTAA-YVWYUNDQSA-N 463.498 0.158 50 20 JCGD O=C(CCc1cncc(C(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1801234946 AKQAOVKORJYRBZ-UPHUGPLXSA-N 491.275 0.616 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@H](O)CN2)[C@H]1c1cccnc1 1804241359 LZOWLUCVYHLHBP-BCYZHJNNSA-N 496.008 0.942 50 20 JCGD Cc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1805553464 CHPLETRHWBZNJJ-OXJNMPFZSA-N 460.498 0.812 50 20 JCGD N=C(N)SCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1807004431 VMFVVNPJVRIZLF-SUMWQHHRSA-N 456.532 0.026 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360595 LJBXVCVRYZIPQK-PGRDOPGGSA-N 459.315 0.538 50 20 JCGD O=C(O)c1cc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)ncn1 1807573345 PBJIKUPBIPLNCX-UHFFFAOYSA-N 452.276 0.013 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1 1807933831 ASRYRGISVTVAHY-JXFKEZNVSA-N 485.508 0.756 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cn2cccnc2n1 1809778376 RQMWODGCQKIRNY-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccn(C(F)F)n1 1810906807 IROAFPWGSADTBX-LPHOPBHVSA-N 469.257 0.986 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCc3nc[nH]c3C2)[nH]n1)c1ccc(B(O)O)cc1 1817475660 QLTGOXOOJTWRPK-YWZLYKJASA-N 462.319 0.924 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4c(c3)CNC4=O)sc2C1 1819369610 HQXZHTRJYJQFCN-CYBMUJFWSA-N 491.533 0.925 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819417498 BYSBGHBVPKPIPV-KBXCAEBGSA-N 463.307 0.686 50 20 JCGD CCn1nccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819795225 KPWZNSNSCBOMEA-LLVKDONJSA-N 454.516 0.898 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)[nH]n1 1822412111 ISIQXQPOBHQZLU-HOTGVXAUSA-N 495.581 0.660 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822792763 ZYXMTWRUUVOHBE-FQEVSTJZSA-N 464.335 0.988 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)COCCO)sc2C1)NC(=O)NCc1ccccc1 1822991726 KRPYXTCDJGXNJQ-INIZCTEOSA-N 490.586 0.410 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1824549145 QLNBYTHVNAUSQK-BBRMVZONSA-N 493.354 0.262 50 20 JCGD CN1N=C(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CCC1=O 1824924765 XNGZKIRZKSAHRK-HXUWFJFHSA-N 454.336 0.208 50 20 JCGD O=C(c1cccn2c(O)nnc12)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052975 RDWMAZNBFYLFDQ-HXUWFJFHSA-N 477.330 0.662 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1828876001 NFOOJARTHBWOBP-WMZOPIPTSA-N 452.600 0.687 50 20 JCGD O=C(CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)Nc1ccccc1 1830719985 QISLZXBVTDFLNF-GCJKJVERSA-N 467.950 0.852 50 20 JCGD O=C(c1cc(Br)ncc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728093 OXMBBMDWGRFSNV-GUYCJALGSA-N 480.718 0.653 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c(OC)c1F 1830733962 XHUXWRDTVFIVNI-RNODOKPDSA-N 478.876 0.652 50 20 JCGD CC(=O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831121657 LIMBIDGHUIUMCA-NMWDDECMSA-N 461.519 0.192 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C#CC3CC3)CCO2)C1 1831209232 UDTNAVIJGJVXDJ-JTSKRJEESA-N 469.966 0.988 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)no3)C2)C1 1832549317 MFGQOJWJVBRDJD-RBZFPXEDSA-N 488.925 0.582 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccn(C)n3)CCO2)C1 1834248194 POVIURDCPAVZKZ-QFIPXVFZSA-N 487.469 0.637 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CS[C@H]3CCCCO3)CC2)CC1)c1cccc(B(O)O)c1 1834800922 APYDDWSEASCFKT-QHCPKHFHSA-N 489.447 0.811 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cn1 1834821401 ICSWCAOYVJWWSK-LJQANCHMSA-N 470.320 0.723 50 20 JCGD CNCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1835663232 UGLLFIRNDRVEDL-QFIPXVFZSA-N 478.502 0.590 50 20 JCGD O=C(CS[C@H]1CCCCO1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835756684 JJLSDWAVDOVQHM-QHCPKHFHSA-N 489.447 0.811 50 20 JCGD O=C(Cc1ccc2c(c1)CCC2)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927146 IZKDHDJXCPINCO-SANMLTNESA-N 478.354 0.168 50 20 JCGD O=C(Cc1ccccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929628 ZIILJMRYDBPXTM-HSZRJFAPSA-N 472.734 0.333 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cnc3Cl)C2)C1 1837459457 PSVMRBPPPJMIGK-NRFANRHFSA-N 492.895 0.256 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)N1CCC(OC2CCN(C(=O)[C@H](F)Cl)CC2)CC1 1838083617 YLSNXYMMZQZBOM-KRWDZBQOSA-N 453.964 0.945 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(C3)C4)C2)C1)NC(=O)NCc1ccccc1 1839054156 JACUYLVOIULONA-LRARRHDQSA-N 485.585 0.589 50 20 JCGD O=C(c1ccc(N2CCCOC2=O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839459640 CQGADAXFIBDPDO-PGRDOPGGSA-N 481.933 0.703 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1840032878 MQCYOFTYLCHMQH-RVSPLBMKSA-N 461.382 0.253 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1 1840033126 UYWOUPFVKWGJSX-YWMUFLPLSA-N 466.376 0.941 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1840033260 YZZNYAJDUPINRW-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD CC[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1840057952 JLFZWSLXQJQTSN-QZTZHPFYSA-N 473.574 0.972 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1840083886 GDBJHOFDIFILJY-GLUMNXNNSA-N 456.898 0.904 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1cccs1 1840375809 IFNOSFYUANHBKN-OYHNWAKOSA-N 473.555 0.620 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 9930759 AUFNFDRSBHRTRI-GJZGRUSLSA-N 457.574 0.754 50 20 JCGD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2)C1 15639700 IJKCMSAUSMDDOU-IIAWOOMASA-N 457.574 0.549 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cn1nc(-c2ccccc2)oc1=O 725905297 PTTJTVHPTLPZIJ-UHFFFAOYSA-N 450.499 0.863 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(NC(=O)c2ccc(F)cc2)cc1 728510425 KBNSOLYERZTXHM-LLVKDONJSA-N 458.493 0.325 50 20 JCGD CCOc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)cc1 729274681 ABCLXPIUSSRDFV-ZDUSSCGKSA-N 484.556 0.585 50 20 JCGD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)cc1 746353507 AABMIZBWKRSVHA-UHFFFAOYSA-N 458.514 0.838 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 825785864 DGPCPGNGQIPLSZ-UHFFFAOYSA-N 476.555 0.908 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C)cc2)cc1OC 843478301 GTTKVMMJGZVHRY-CQSZACIVSA-N 479.511 0.683 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])ccc1I 915278958 JMFQENINCGMJFM-ZETCQYMHSA-N 453.214 0.395 50 20 JCGD COc1ccc(N2CCN(CCCNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1 916199009 UUGDAKUBEHLVFQ-UHFFFAOYSA-N 479.545 0.827 50 20 JCGD Cn1ncc2c1CCC[C@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916604181 CERLIGPCJLTFPG-QGZVFWFLSA-N 462.532 0.463 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cc(C)[nH]n1)N(S(C)(=O)=O)CC2 917393293 JHWSGPAKCOCENF-OAHLLOKOSA-N 451.505 0.445 50 20 JCGD CCO[C@H]1C[C@@H]1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 918017310 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NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4ccccc4o3)C2)C1 1782234891 LKNTYLOVUWUUTE-JOCHJYFZSA-N 450.455 0.584 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(S(C)(=O)=O)c3)[C@H]2C1 1783747643 ABEWCXUZLOJUSD-WDSOQIARSA-N 480.587 0.056 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1783880392 HZHQOVKPOSEEEW-QEEYODRMSA-N 463.959 0.346 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(=O)c1ccc(Cl)cc1)CCO2 1783932748 CWSWSWALUUQBLN-OAQYLSRUSA-N 450.923 0.726 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC(=O)N(Cc3cccs3)C1)CCO2 1783933018 AIFCSTNJCHEISJ-SBUREZEXSA-N 491.614 0.300 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2c1 1783936248 SQHWMFBYRVECJI-QHCPKHFHSA-N 457.531 0.993 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1783963926 FVKUOTVHHSUEBQ-CWVYHPPDSA-N 492.411 0.883 50 20 JCGD 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CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C(C)(C)C 1796439459 GGYLOHVWXFBONV-KAQDRPSSSA-N 474.562 0.261 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2c(F)cc(F)cc2[nH]1 1796934889 FUIBNTROQIHCIQ-GFENJXEQSA-N 469.253 0.643 50 20 JCGD Cc1nccn1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097175 GUNZLEPFGMPGLI-JHDGKUDLSA-N 483.573 0.127 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1 1799244995 MKVHIXVNGHRSSF-OPMZPASUSA-N 493.325 0.600 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(N2CCCOC2=O)cc1 1799815618 KHTAQGBLMMBWSL-MVJTYMMSSA-N 451.907 0.836 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)c2n1 1800138193 NQSQGPJCSVLMGC-RMFSNUHRSA-N 462.315 0.148 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1800191520 DSEFZUHYINKZCA-DFYYWFRZSA-N 452.515 0.162 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=C3c4ccccc4C(=O)N3CC1)C2 1801011882 PBSHXOMJUXYFNX-MFKICJERSA-N 481.553 0.220 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)C1 1801052485 QGHIHWMNJABDBR-UNMKOGDSSA-N 485.654 0.799 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2 1802334790 OTKUODPCURHWSB-YVSFHVDLSA-N 469.583 0.273 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803138198 YGMJJVHDMRWJDR-QZWWFDLISA-N 470.954 0.573 50 20 JCGD Nc1nc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cs1 1807233520 VZRPGVJZQNGYCT-QAPCUYQASA-N 451.317 0.434 50 20 JCGD CC(C)=NO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808845558 KJCOKOXVVMWKLD-PBEJRMEISA-N 452.320 0.882 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@H](CNC(=O)c4cnccc4C(=O)NN)[C@@H]3c3cccnc3)(C1)C2 1810305004 IOJJVASFOJGPEQ-LINFSVTHSA-N 492.536 0.743 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@H]1c1cccnc1 1812866064 GOIWIRMXWFZCDG-ADSMDIBLSA-N 457.325 0.935 50 20 JCGD COC(=O)CSCC(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813068259 KZJRLXLFMQLIRE-IIBYNOLFSA-N 465.576 0.367 50 20 JCGD CCCNC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815335639 IPOPAIXFZARTGH-HNNXBMFYSA-N 458.349 0.355 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ncnn2C)n[nH]1 1816301221 PJCUXDYCNSUCCB-HURLIOHXSA-N 452.479 0.978 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)[C@H]1SC(=N)NC1=O 1817471956 ZNIJYSRGTMZIGR-UXEPBGEESA-N 484.347 0.198 50 20 JCGD CC(=O)O[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(C)C 1817476644 YBHNHNYTBHAJTD-ICSRJNTNSA-N 456.308 0.983 50 20 JCGD Cc1cc(NC(=O)CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)no1 1819797683 XLJCPNSGKCNVLH-LLVKDONJSA-N 498.525 0.693 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCc3nc[nH]c3C1)CC2 1819801232 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Cc1ccc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1832438446 XRWSKUQPRWBTAB-RUZDIDTESA-N 497.552 0.451 50 20 JCGD N#Cc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cc1 1833107330 UOVABQYSQWDPTG-UHFFFAOYSA-N 489.580 0.985 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833599071 BOYYKYBIPDJOMK-MOPGFXCFSA-N 494.397 0.791 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1 1833621510 MHERMWVGLDPTCM-WIYYLYMNSA-N 463.922 0.591 50 20 JCGD Cc1nscc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834041795 DJQKICZAKVSUNX-UHFFFAOYSA-N 471.587 0.949 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1835272926 ZXXUNPKXBRNXPQ-GCJKJVERSA-N 470.950 0.693 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc2nc(CO)[nH]c2c1 1835315990 ARBLWUWSDIGUQI-IBGZPJMESA-N 463.966 0.840 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1Cl 1835933642 FCEKVITZHBKDQX-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD O=C(c1nc2ccccn2n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836396798 CYPUBSIVFCLHFC-GUYCJALGSA-N 456.272 0.490 50 20 JCGD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837797331 GRAURAZHBQBEPA-BXUZGUMPSA-N 450.221 0.078 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cn2[nH]cnc(=O)c12 1838471084 HGGROFNOOZWEOL-KDOFPFPSSA-N 486.298 0.092 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CN)C2)C1 1838528190 KIWDGWFBCNUZEG-SPLOXXLWSA-N 464.475 0.185 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nccn3)CCO2)C1 1839237907 JMDHUTMBTRIFGR-CQTHNFAISA-N 472.452 0.620 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc([N+](=O)[O-])c1OC 1839470452 PMWPOEIVZIFSBQ-YWZLYKJASA-N 487.893 0.282 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1 1839609550 ABXKMIZWLAKPCY-VGSWGCGISA-N 465.934 0.895 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839951895 BBLDNVHMKJRNNN-MBSDFSHPSA-N 462.547 0.283 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1 1840034197 CYIUIWFQMAUGCB-SCLBCKFNSA-N 458.357 0.887 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)nn3C(F)F)C2)C1 1840154325 SIDUKLPUAIYFQY-ACJLOTCBSA-N 450.870 0.910 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(Cl)c1 1840183029 ZNHYHVDWQJJBOH-QHCPKHFHSA-N 496.992 0.721 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1 1840184990 GTBMJIIFELVOST-QFIPXVFZSA-N 492.964 0.659 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840716820 UMSHEHRLUDZOEP-UUOWRZLLSA-N 471.558 0.757 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840730644 FDGZDXJHRJNIGA-QHCPKHFHSA-N 475.546 0.088 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)c2C1 1841351345 LZHGOFTULOGUIC-CQSZACIVSA-N 468.942 0.446 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)C1CC1 1841410566 KQEKQHULVOEEBY-IBGZPJMESA-N 471.363 0.877 50 20 JCGD CC[S@@](=O)CCC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844174401 NXDROYAGPHGMCA-JGCGQSQUSA-N 463.604 0.695 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)CC2=O)c1 1844263388 ZLYJYUCHVSCIMZ-INIZCTEOSA-N 492.536 0.564 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H]2CCCS2(=O)=O)C1 1845913933 KCHYIHIIYFOJEP-QGZVFWFLSA-N 465.484 0.914 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)ccc1Cl 10414935 UQWLNZJQCFXMSM-UHFFFAOYSA-N 472.932 0.602 50 20 JCGD CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 726273444 FLVGAKSKHPONOE-UHFFFAOYSA-N 487.586 0.792 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=S)NCC3CCC3)CC2)cc1 727866881 DPPRZGVJQJDXCE-UHFFFAOYSA-N 481.644 0.904 50 20 JCGD CC(C)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 728384514 MLMBWYIUXQDGQU-AEFFLSMTSA-N 467.569 0.725 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)c1 728525176 BWUYFZNWFAIBQP-UHFFFAOYSA-N 464.276 0.422 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1 728980667 CJPYZCXMQDWYQO-GOSISDBHSA-N 488.570 0.612 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)OCC(=O)NNC(=O)c3ccccc3)CC2)cn1C 748551690 RHSSIAOMUHAUPJ-UHFFFAOYSA-N 463.516 0.134 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)cc1OC 778209954 HMQSDMRBAWOOSS-UHFFFAOYSA-N 479.511 0.603 50 20 JCGD NS(=O)(=O)c1ccc(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 804024488 APGCDJJOEDDUFO-UHFFFAOYSA-N 467.529 0.585 50 20 JCGD Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 912848836 FZSRBKAGKCRWBF-UHFFFAOYSA-N 453.546 0.336 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1)c1csc(N2CCOCC2)n1 915063783 MAIIDIDEHJPMFL-OAHLLOKOSA-N 479.584 0.842 50 20 JCGD CCN1CCN(Cc2ccccc2CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1 916419971 OQTMRMOCYURJOE-UHFFFAOYSA-N 463.546 0.944 50 20 JCGD C[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)N1CCCC[C@H]1C 916448918 SWJCWPPFAMMOSZ-SJORKVTESA-N 453.613 0.907 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NN=Cc1cnn(C)c1)c(=O)n2Cc1ccccc1 917212112 RRXQTWLQNHYIFB-UHFFFAOYSA-N 462.514 0.948 50 20 JCGD CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 919779419 RQIFHIOHJSDJSH-GFCCVEGCSA-N 468.561 0.593 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 920826965 QKPMYARRNXEDEG-UHFFFAOYSA-N 461.456 0.779 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778054231 DGYCFJIPBVMNGR-FQEVSTJZSA-N 489.330 0.799 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032756 UGBCPKQROQUMBA-LJQANCHMSA-N 481.435 0.195 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3C1)CCO2 1779033620 AAWAUCKAQKNMHO-UQBPGWFLSA-N 463.538 0.934 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1 1779101946 SCBNEZOJJBOJDT-FZAMVRSBSA-N 474.518 0.479 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)CCO2 1779295875 DPUKUNZGLYKGMP-QHCPKHFHSA-N 489.649 0.703 50 20 JCGD Cc1onc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1C 1779371141 HSUCYVHADGYJPJ-VGOFRKELSA-N 456.503 0.731 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cncc(C(F)(F)F)c3)C2)C1 1779745260 QLUJKEXAEXJOOP-FQEVSTJZSA-N 463.221 0.538 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)C2)C1 1781116011 YQNVZUMTDTYMFZ-OSAWLIQMSA-N 475.970 0.298 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214791 ZTIFVIKDIQQYPW-SEPYTNNBSA-N 483.610 0.787 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3cncc13)C2 1782215170 WDRIRHWJLUBCNA-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782785213 DULAFGNCHXBATD-ACJLOTCBSA-N 471.308 0.617 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)C1 1783348959 OYLWVXMEWQODKJ-MPWIWIEXSA-N 489.997 0.736 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1783614880 GIWCLKAXTYAQGW-YUWJWYLASA-N 475.970 0.440 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCC(=O)NC3)[C@H]2C1 1783625719 FCIRTIFTKVHQGB-WOYTXXSLSA-N 486.997 0.624 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783942013 GDYKAEYSRQLRQS-XIKOKIGWSA-N 454.351 0.896 50 20 JCGD O=C(c1ncn2nc(N3CCOCC3)ccc12)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783945917 TUYDRDISPCWXJC-FQEVSTJZSA-N 483.356 0.813 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1 1784090022 NSTHWRKVJHNUQY-DKIMLUQUSA-N 458.964 0.212 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1786847966 PECYSWJPIWGJPC-RMEBNNNOSA-N 450.939 0.743 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCO4)C[C@@H]21)c1ccc(B(O)O)cc1 1786983590 OBFHKGATPCHQEB-RRPUWOKSSA-N 464.327 0.137 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984930 AJNRADDMRKNPEK-VJBMBRPKSA-N 474.326 0.459 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508169 LVMKVOPYWMQJNC-VUDPUYKOSA-N 474.562 0.405 50 20 JCGD CC(C)(C)c1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cn1 1787785027 FVJULJIBHULQCS-QRFRQXIXSA-N 466.347 0.361 50 20 JCGD O=C(CCN1C(=O)C=CC1=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788140476 SQEJNXBBXCCVNU-UHFFFAOYSA-N 461.283 0.429 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Nc3ccccn3)[C@H]2C1 1788778534 PTOXSXMEJAGLPZ-OFIICDBUSA-N 481.557 0.996 50 20 JCGD 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NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3[nH]ccc3s1)C2 1797750459 AOLLXKQVKWNBDT-KSPBDQMDSA-N 454.512 0.745 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797754051 JYARXSRLPJFYQP-MBWWPZBXSA-N 483.500 0.749 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798441932 PDMMJMVRAZBUDZ-FZKCQIBNSA-N 490.561 0.213 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)n1)C2)[C@@H](F)Br 1799347908 XCMPMTOOBODRGZ-DLTLXFJOSA-N 471.327 0.812 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC[C@@H]1NC(=O)OC(C)(C)C 1802142525 KTMKUXALZPSDSP-UONLAYADSA-N 495.621 0.642 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1 1802414676 OVPBJXIAUDBPBR-BMCPXHGSSA-N 481.594 0.370 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H](O)CN2)[C@@H]1c1cccnc1 1804241366 LZOWLUCVYHLHBP-VPAKFMSCSA-N 496.008 0.942 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)nc1 1805050542 DNIDLCXKLFTQKX-BMGDILEWSA-N 466.947 0.799 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(=O)OC(C)(C)C 1806722472 VTQFAYXVLZBJPD-DENIHFKCSA-N 496.373 0.948 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807949560 PNKIBOODKNLBLB-GDLCADMTSA-N 479.270 0.218 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1 1808414366 IBAHBTRGHZTCSU-SCLZEDSOSA-N 465.514 0.500 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1 1808416292 LDXUYKDJHHFNOZ-IZQKNGFYSA-N 490.524 0.478 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1 1810301667 BSRJLEOWAFEZJR-CRAIPNDOSA-N 486.496 0.151 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1 1810837477 JEALFXIBKRGRIQ-DENIHFKCSA-N 460.299 0.798 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1 1813070981 OXFQTSHKLUOCCH-HXOBKFHXSA-N 485.545 0.786 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CNC(=O)OC(C)(C)C)[C@H]1c1cccnc1 1813074353 PSYXZFUUXIJTML-UWJYYQICSA-N 476.578 0.985 50 20 JCGD O=C(CCc1cnccn1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813442099 CXDGLGYXDKWZOE-CVDCTZTESA-N 459.315 0.504 50 20 JCGD CN1CCN(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)CC1 1814586659 YKCGUZNAJXOJHW-OAHLLOKOSA-N 465.624 0.066 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc3ncccn3n1)CC2)c1ccc(B(O)O)cc1 1815344369 VWOABFMDDTXISZ-CQSZACIVSA-N 462.300 0.405 50 20 JCGD COc1nccnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1816157359 LZIQQWUALVXXNM-MRXNPFEDSA-N 450.264 0.508 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccc(O)nn2)[nH]n1)c1cccc(B(O)O)c1 1817477210 PLJQCSYQRISBJI-GOSISDBHSA-N 464.291 0.524 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)n[nH]1 1821220297 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CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1832003843 GLHSPTALYNJQDC-IGMJJTELSA-N 481.949 0.905 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)cn3)C2)C1 1832549696 XZEGDOPOMYVCAD-HTAPYJJXSA-N 498.964 0.989 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(O)c3)C2)C1 1832551135 DBRPXMUCSLSRIS-JTSKRJEESA-N 498.964 0.989 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833025324 CEZYQRZGZSRACM-IVZQSRNASA-N 494.621 0.301 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833083571 BKDOFZRMVRTTCH-LJQANCHMSA-N 493.417 0.557 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C(F)(F)C(F)F)CC2)CC1 1833647288 SGVNYQHIJNHDNF-UHFFFAOYSA-N 474.459 0.771 50 20 JCGD Cn1ccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1834391962 ZHYZNWBHTYJVNP-YCRPNKLZSA-N 485.969 0.622 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cncc(F)c3)CC2)CC1)c1ccc(B(O)O)cc1 1834797413 JHRJJKJKBOJJRZ-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)nc3O)CC2)CC1 1835071306 NTGJNNIRKYIVCC-LLVKDONJSA-N 456.341 0.856 50 20 JCGD O=C(CCc1ccc2c(c1)OCO2)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1835177521 AZPTXHLEOSUFBJ-IIBYNOLFSA-N 454.907 0.404 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cnccc1Cl 1835859847 QXIKMCVZUFCCTL-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(Cc1ccc2ncccc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926967 AIELCCRSCVGGIP-SANMLTNESA-N 489.337 0.227 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)c3cccs3)CCO2)C1 1836520925 XVIZSKIXFUTAGY-YHCZKZFASA-N 478.571 0.316 50 20 JCGD C=CCC(CC=C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456354 KZGDBXKOWWEESS-QHCPKHFHSA-N 457.531 0.524 50 20 JCGD Cc1cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccn1 1837456419 MPDSZOPJIHVXAJ-XMMPIXPASA-N 482.541 0.091 50 20 JCGD Cc1ccc(OCCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837457028 VWCSLHGDTQRCMT-VWLOTQADSA-N 497.552 0.533 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1cnccn1)CCO2 1837485221 DTLYVZKMSCAXHY-IYOUNJFTSA-N 456.341 0.517 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921286 UXYHERDAWYECNP-UHFFFAOYSA-N 491.357 0.264 50 20 JCGD Cc1cn(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)c(=O)nc1O 1838649355 HSVOIYBJYWXNMM-INIZCTEOSA-N 489.342 0.946 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)c1cccc(Br)c1)CCO2 1839054709 JQMRFSIDRYJKBN-MDZRGWNJSA-N 491.766 0.539 50 20 JCGD COCCn1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1 1839153391 YEDABGFKCLMUEL-OALUTQOASA-N 463.362 0.836 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccc(O)cc1 1839169800 JYILTUFQIPQEJT-VOIUYBSRSA-N 483.525 0.264 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1 1839414916 HPTMQSKZTVWIBU-LPHOPBHVSA-N 457.867 0.624 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc4ccccc34)C2)C1 1840184581 VZMIJBRQNXUNLD-DEOSSOPVSA-N 485.541 0.383 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CC(=O)C1)CCO2 1840833426 FFJAPXLYKCAWLZ-JOCHJYFZSA-N 475.454 0.569 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014648 KLTCHJZTBIHKIX-UHFFFAOYSA-N 452.276 0.471 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1847626934 MHIXBRVJLHPQOY-FKBYEOEOSA-N 463.343 0.781 50 20 JCGD CN(C)N(C(=O)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12)[C@H]1CCS(=O)(=O)C1 728177891 LRNWNWPXXFDPDR-AWEZNQCLSA-N 498.583 0.067 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCn3cnc4sccc4c3=O)cc2)CC1 728214549 RMSIAVVUAIAAHM-UHFFFAOYSA-N 476.584 0.928 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=S)NCCS(C)(=O)=O)cc2)cc1 729157736 HSEXQVKEKULNCE-UHFFFAOYSA-N 498.652 0.969 50 20 JCGD CCc1cccc(NC(=O)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1 748463050 VWRALJGJGRKVHX-UHFFFAOYSA-N 475.575 0.845 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccnc(F)c1)N(S(C)(=O)=O)CC2 748833847 DKXAWUJXWPEKLG-HNNXBMFYSA-N 466.491 0.948 50 20 JCGD C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1)c1ccccc1 788024223 WGMIHPXMKWAOEC-RHSMWYFYSA-N 465.553 0.922 50 20 JCGD O=C(NNC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)c1ccc2c(c1)OCCO2 794411833 DZSMBISRIIVHGB-ZBFHGGJFSA-N 481.914 0.696 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 914829834 YTUNIHPIVWYAAT-YPMHNXCESA-N 474.333 0.011 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)c1 916144507 BYOBKVQCLIIHIG-UHFFFAOYSA-N 479.497 0.993 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(C(=O)N(C)C)cc2)cc1 916250620 OPQYGDFUFPQRMJ-UHFFFAOYSA-N 461.544 0.848 50 20 JCGD Cc1ccc(-c2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCNC(=O)C4)cc3)n[nH]2)cc1 917178661 PLSWVUOUVSIVME-UHFFFAOYSA-N 482.522 0.580 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028290 BMUCGRKVQMEEEG-RCDICMHDSA-N 476.534 0.042 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(Cl)c(O)cc3O)CCO2)C1 1779037079 MPZJDIISJQKZJF-OAQYLSRUSA-N 475.889 0.507 50 20 JCGD COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)ccn1 1779719515 UDFLIJLHSKSUKH-WZONZLPQSA-N 468.514 0.530 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1 1781859262 BYKWXJVBZLEQHB-ZJNRKIDTSA-N 464.357 0.833 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](COC(C)=O)OC(C)=O)CCO2 1783349984 XRUCEDYGQHYPBK-HDMKZQKVSA-N 463.325 0.485 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1 1783404667 QYNXSBAVEYHAOV-UQBPGWFLSA-N 463.538 0.934 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1783500506 ILHNQSGHWLLTFM-VLXUNWKESA-N 457.955 0.529 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc2c1OCCO2 1783935487 URZDTBQIJCBULE-HSZRJFAPSA-N 460.531 0.583 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1784081819 RJCFAKYVAQWVLR-QHCPKHFHSA-N 456.279 0.200 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C2)C1 1785223954 UDDHLHSSYCZKAQ-VGOFRKELSA-N 461.902 0.813 50 20 JCGD Cn1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc2ccccc21 1786983648 ZGPFBZKLPKVRAU-LEDOBFOHSA-N 461.327 0.765 50 20 JCGD O=C(CCN1CCOC1=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788141104 LPESSNUIFBUEKM-UHFFFAOYSA-N 451.288 0.956 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1 1789544667 BZTYADGOCVRQOO-LJQANCHMSA-N 476.530 0.988 50 20 JCGD O=C(CNC(=O)C(F)(F)F)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1791622235 BNMLSCCAIRTFMX-UHFFFAOYSA-N 463.221 0.793 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)ccc1[N+](=O)[O-] 1792047340 WZWMUNOUZMDGGD-MDKPJZGXSA-N 483.286 0.190 50 20 JCGD C[C@@H](Sc1cccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734456 PAGRRYXYLUOGSA-JNNRSPCRSA-N 460.386 0.812 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1noc2c1CCCC2 1796151238 JFBPHQIZPXUGEO-DHMDNZFNSA-N 468.514 0.891 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@H]1CC(=O)N(C2CCCC2)C1 1796189842 HLXXSHZJWAGCCD-YRLHULLVSA-N 453.348 0.409 50 20 JCGD CCOC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)CC1 1796190488 CVCPNXKEKQIYFR-ACDBMABISA-N 457.336 0.487 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])cc3c1OCC3)C2 1797753204 XCJTUVBPOFXAPQ-HBCWATKFSA-N 496.480 0.045 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2ncnn2c1 1799081870 WEIZWHVFMBDCQJ-LJGDNWOOSA-N 450.337 0.892 50 20 JCGD C[C@@H](NC=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1799292875 LXPYVHNICKDFQO-FWEDZOCSSA-N 452.349 0.717 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN2CCCC2)[C@@H]1c1cccnc1 1802554982 CAIUETFDMQWBJR-UWJYYQICSA-N 451.531 0.496 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)C(C)(C)O 1804434621 GAMQRGOIIKMDJP-FCGDIQPGSA-N 489.378 0.282 50 20 JCGD C[C@H](Cn1cccn1)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804715260 IEWZPRKKLCHUIZ-NQSCKRDGSA-N 461.331 0.614 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(O)cn2)[C@@H]1c1cccnc1 1806106808 LOKZDAURSJBZEN-YWZLYKJASA-N 461.482 0.814 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1 1807359698 CHVNPEWBMGXDBP-PGRDOPGGSA-N 475.314 0.584 50 20 JCGD COc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807363312 OIZTUUBTQSBYTC-WIYYLYMNSA-N 460.299 0.798 50 20 JCGD O=C(Cn1cc(Cl)cn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807410650 RXZQFGPSKBPIEX-UWJYYQICSA-N 467.722 0.631 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C2CN(C)C2)[C@H]1c1cccnc1 1808416278 KCBJILVHKSZIHI-ZXRGJLGVSA-N 451.531 0.783 50 20 JCGD Cc1ncc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1810298594 KEXFJRHWJTUMMA-OXJNMPFZSA-N 460.498 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@H]1c1cccnc1 1810302210 IEXQVIVEYGDWHS-JXFKEZNVSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)/C=N/O[C@@H]2CCCCO2)[C@@H]1c1cccnc1 1810302542 KSOQYAJMMNOSTA-XBKSAFLNSA-N 495.540 0.929 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc2cccnn2n1 1811268205 VXASPFBAHMUUFJ-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1cc(=O)nc2cccnn12 1811334450 NHSJMYCSAUDQHM-GMBSWORKSA-N 456.890 0.404 50 20 JCGD Cc1cc(C)n(CCC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1813304839 FWYIDCFTYACLHE-ZJSXRUAMSA-N 475.358 0.985 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccnc3c1OCO3)CC2)c1ccc(B(O)O)cc1 1815343863 STFRJIXQVWGYAH-ZDUSSCGKSA-N 466.284 0.486 50 20 JCGD CCOC(CC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)OCC 1815361727 PRMOAXAMSQTWRD-HNNXBMFYSA-N 461.349 0.838 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)nn1)CC2 1817277065 GQUNEWGQFJEDQN-IVWJEFBKSA-N 468.499 0.999 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnc2ncccn12 1818695464 TXXQVXGCCWJBQT-QGZVFWFLSA-N 459.275 0.752 50 20 JCGD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)n1ccccc1=O 1819570684 PLFNUSHCAPQTFR-DNVCBOLYSA-N 463.303 0.818 50 20 JCGD COC(=O)CSCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819792992 GEDVREHPESYTIB-SNVBAGLBSA-N 478.556 0.274 50 20 JCGD CCOc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)nn1 1820371214 LBYUCLKIQSNLGJ-GOSISDBHSA-N 464.291 0.898 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)COc3ccc(O)nn3)sc2C1 1824561967 LRYYVWQSHWXGNT-NSHDSACASA-N 463.520 0.003 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3ncccc13)CC2 1826085198 JMEZMALJBLHKCO-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055153 UFYOQFSFYKFDFY-OAQYLSRUSA-N 454.380 0.882 50 20 JCGD O=C(CCN1CCOC1=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059679 SOKVLQZUNHICPM-FQEVSTJZSA-N 457.336 0.442 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830353671 JJNMKSNWOKPRFA-VFNWGFHPSA-N 477.986 0.593 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)C(C)C)CCO2 1830870577 XKKVDDWJNVLYNM-DENIHFKCSA-N 479.486 0.607 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549346 IPVLZRMHEVSKIY-ACTFIFLWSA-N 492.013 0.982 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CCO[C@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2c1 1832744804 ULLDIUYOBLIGQJ-VWLOTQADSA-N 485.585 0.848 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833309005 ISDXJQCCVGWGAF-QZTJIDSGSA-N 490.045 0.400 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1833421921 HWUUZVCDSXWVJQ-OAQYLSRUSA-N 475.527 0.139 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(F)(F)F)CCO2 1834111247 HSVPOLFYMDCFNL-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)c1cc(O)nc(O)n1 1835076595 SARHKIOZFARMOO-CQSZACIVSA-N 460.304 0.764 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2 1835732784 BWOLEDRKXQLMCJ-RBBKRZOGSA-N 481.981 0.169 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)o1 1835734963 BOXWKNVYGZWJAN-UHFFFAOYSA-N 497.556 0.736 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835736991 DZZSOEPRDPZHCO-QGZVFWFLSA-N 482.589 0.403 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c[nH]1 1835927210 MHUHRHBGGJCFFF-XMMPIXPASA-N 469.347 0.376 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CCOC[C@]4(C3)CN(C(=O)c3cccc(B(O)O)c3)CCO4)c2c1 1835935357 PDJXWLRVKHWELT-SANMLTNESA-N 491.353 0.469 50 20 JCGD O=C(Cn1cncn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1836139497 MNPPNKLXKUYYCG-RXVVDRJESA-N 492.374 0.741 50 20 JCGD Cc1ccc(O)c(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1836248720 KMAYAXVLIMCEHN-UHFFFAOYSA-N 465.359 0.879 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456369 LOWGBPQIZYGFKG-FQEVSTJZSA-N 453.927 0.020 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(F)(F)F)c[nH]3)C2)C1 1837457788 RKYYJJZKZRMYMY-FQEVSTJZSA-N 496.446 0.416 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccco4)no3)C2)C1 1837457957 YIVCRHILOBPABQ-QHCPKHFHSA-N 496.480 0.317 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)cco3)CC2)CC1 1837591791 HFXQXPGZZDHMAV-UHFFFAOYSA-N 469.498 0.564 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccnc4c3OCO4)CC2)CC1 1837919071 AYLLMXCTYQMBNR-UHFFFAOYSA-N 481.314 0.416 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ncc1[N+](=O)[O-] 1837919474 WAKPUSUTOAZIGI-UHFFFAOYSA-N 496.329 0.904 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cncnc3)C2)C1 1838527441 SUJACHZDEDGSEW-HSZRJFAPSA-N 499.480 0.623 50 20 JCGD Cc1c(Br)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)nn1C 1838768368 GVAMVZCUZKNVEB-PXAZEXFGSA-N 479.759 0.161 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2 1838998893 ZTINUNMLAAGRKB-JOCHJYFZSA-N 475.452 0.347 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1839153451 IHAVSDGUYIEVEZ-MSOLQXFVSA-N 461.302 0.481 50 20 JCGD Cc1nnc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1 1839199310 MWKZNEHITVQJLE-UKRRQHHQSA-N 451.318 0.536 50 20 JCGD O=C(c1cnn2ccncc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200035 AJTCKAPACQMAQT-RHSMWYFYSA-N 456.272 0.490 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)n1 1839200128 FZHNYALKTQYFDY-DNVCBOLYSA-N 489.342 0.434 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839428665 RQBMXZCDMJUFDO-DNVCBOLYSA-N 459.858 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3nn(C)cc3c1)CCO2 1839506244 IJJVACAUHPALOW-QHCPKHFHSA-N 472.546 0.016 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1840032653 GJVFTDGRQDVSTK-SIXWZSSISA-N 455.353 0.191 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)[C@H]3SC(=N)NC3=O)C2)C1 1840032824 LIMRZKHILUIFET-PXDYOCJYSA-N 477.381 0.029 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1 1840033712 NNJVZCRCTWHHOI-KHYOSLBOSA-N 456.337 0.649 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2)C1 1840149484 QVKYAAHZZNAXLC-AVYPCKFXSA-N 463.959 0.610 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1 1840153243 IJWXQBGELIGJAX-WMZHIEFXSA-N 479.961 0.743 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4cc(C)ccn34)C2)C1 1840155039 NSXVWBDACKAWDN-HRAATJIYSA-N 450.923 0.967 50 20 JCGD 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NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](O)Cc3ccccc3)sc2C1 1825435491 YEIREAMZPBTXDN-RDTXWAMCSA-N 480.550 0.971 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)C#CC(=O)O)sc2C1)NC(=O)NCc1ccccc1 1825669416 DXOUNKASDMHJRW-OAHLLOKOSA-N 484.538 0.489 50 20 JCGD O=C1C[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCN3C(=O)OCc3ccccc3)C2)CN1 1828551853 WKHLLJBILULZJG-IXFSTUDKSA-N 492.960 0.174 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1828872146 LERLKEYNEJFSLY-UZLBHIALSA-N 458.368 0.307 50 20 JCGD CC(=O)N1CC[C@@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCN2C(=O)OCc1ccccc1 1829356083 KIAFVOPSAOFOFX-HSZRJFAPSA-N 459.547 0.831 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1cnc3ccccc3c1)CCO2 1830442125 HQIPJSSMJIROPK-SANMLTNESA-N 497.596 0.997 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(O)c1OC 1830733050 CXOUPYHHHMWMEH-VLIAUNLRSA-N 458.895 0.079 50 20 JCGD CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737843 HTOGLRGGLMNXQX-JKSBSHDWSA-N 492.013 0.982 50 20 JCGD O=C(CSC1CCCC1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831360132 RQZXKRYUDBKRAU-QFIPXVFZSA-N 462.377 0.112 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)O1 1831575969 AKPFTHPIFUZZAM-LLGFUMIMSA-N 496.358 0.557 50 20 JCGD Cc1nn2cc(CC(=O)N3CCO[C@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)nc2s1 1832109721 BHVJUKUAHIAWRJ-QGZVFWFLSA-N 462.359 0.902 50 20 JCGD Cc1cccnc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1832778122 AYWPVMDFPHRDSC-XMMPIXPASA-N 482.541 0.091 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833397053 REVALRBFLCJDRM-PXNSSMCTSA-N 473.979 0.963 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C3=NN(C)C(=O)CC3)CC2)CC1 1833690194 NWUDJSZSOZFKIU-JVWAILMASA-N 498.588 0.300 50 20 JCGD O=C(CCc1cccnc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834885804 NCKBWDDUOOOYNH-UHFFFAOYSA-N 464.375 0.579 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)[C@H]3SC(=N)NC3=O)CC2)CC1 1835113827 KHFIQZAXVJNDKO-VBNZEHGJSA-N 474.027 0.614 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)N1C[C@H]2C[C@H]2C1 1838368491 KGJIBMZNYLQPAG-OKZBNKHCSA-N 484.601 0.638 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccno3)C2)C1 1838527114 IMMWPDUOSDETDM-OAQYLSRUSA-N 474.426 0.892 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])CCO2)C1 1838544773 RNKOXJLJHFNLTK-DYESRHJHSA-N 484.937 0.985 50 20 JCGD Cc1nn2cc(CC(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)nc2s1 1839198491 FRXSJMKEVOMGNM-YOEHRIQHSA-N 490.355 0.789 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839203089 ZFDGQMYAELXZLQ-ZBQZNYHESA-N 487.326 0.347 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c([N+](=O)[O-])c1 1839232519 MPENLMYDZKMESQ-FXAWDEMLSA-N 471.894 0.202 50 20 JCGD O=C1CC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)=NN1 1839802304 RMWNSZUOJVVQFS-IIBYNOLFSA-N 493.358 0.325 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1840034697 UMDLXZCXDGFDSI-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1840037443 AGGVGDOYUAVUDI-XCODNNPBSA-N 451.882 0.887 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C2)C1 1840152129 XYIJUDDOAXGLQX-VFNWGFHPSA-N 466.922 0.290 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1 1840153258 IVBDPZCZGAVSPD-HBEAFANVSA-N 463.918 0.732 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1 1840155480 DCVMYTSFYWAUML-PXNSSMCTSA-N 460.955 0.630 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)c3ccccc3)C2)C1 1840182398 ILISCJVHZVLYCP-RBBKRZOGSA-N 450.511 0.527 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1 1840184552 UYLVDLQXMHRWJQ-QFIPXVFZSA-N 492.964 0.659 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1F 1840187014 HWHYVTZHMIMUOQ-JOCHJYFZSA-N 466.510 0.277 50 20 JCGD CCc1nn(C)c(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)c1Br 1843148842 PJXBDDMTQFPIOL-UHFFFAOYSA-N 469.384 0.935 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846129126 DYHYWYIPKPWDMO-IQGLISFBSA-N 483.374 0.831 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1 1846385847 CJMCKJCWETYZHK-OAHLLOKOSA-N 483.566 0.019 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@]1(C)CN(C(=O)OC(C)(C)C)CC[C@@H]1O 1847239483 VUROIAONBLOOML-KOAQGZTJSA-N 495.621 0.569 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1)C(=O)NC1CC1 9889293 CEXFAQITPODWQI-UHFFFAOYSA-N 463.343 0.820 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 725739444 HCAOSYQBXZDNGJ-UHFFFAOYSA-N 457.559 0.005 50 20 JCGD O=C(NNC(=O)c1ccc(-n2ccnc2)nn1)c1cccc(S(=O)(=O)N2CCCCC2)c1 725878285 GTKATVQCKSOXDP-UHFFFAOYSA-N 455.500 0.912 50 20 JCGD O=C(COC(=O)c1nc(N2CCCC2)ncc1Cl)NNC(=O)[C@H]1COc2ccccc2O1 728329872 WYERPNHQRYDRHJ-OAHLLOKOSA-N 461.862 0.874 50 20 JCGD COc1cccc2c1OC[C@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C2 728398804 IFQLPHYCCMWJHY-MRXNPFEDSA-N 462.528 0.958 50 20 JCGD Cn1c(=O)nc(O)c2cc(S(=O)(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)cnc21 728507847 ZZKKLNIEYIDJMJ-UHFFFAOYSA-N 472.405 0.746 50 20 JCGD CC(=NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1 730576421 FNNUJTLNUVKWIR-NVXWUHKLSA-N 471.557 0.589 50 20 JCGD COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)N3CCOCC3)CC2)c1C 798120288 PFVJUNKJRRGRNG-ALDSOSFCSA-N 471.558 0.749 50 20 JCGD CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1c(C)nc(O)nc1O 839386942 DRQBCYGIPBPVPN-UHFFFAOYSA-N 463.516 0.690 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)c2)CCN1 906486525 LECCMMJPEKCTIE-UHFFFAOYSA-N 455.496 0.292 50 20 JCGD CCOc1ccc(/C=C(\C#N)C(=O)OCC(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)cc1 913263919 QRYAEQKSHGHSIA-BIRYMOPTSA-N 461.540 0.867 50 20 JCGD O=C(NNS(=O)(=O)c1c[nH]c(C(=O)N2CCCC2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1 914564654 YUZCHYLSRAJDAO-UHFFFAOYSA-N 495.583 0.659 50 20 JCGD Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2c(O)nn(C)c2n1 915188268 UQPVEIVWZMDTJD-UHFFFAOYSA-N 458.500 0.842 50 20 JCGD NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 915883798 LUNNRSUYXZUZFD-UHFFFAOYSA-N 495.583 0.305 50 20 JCGD CCC(=O)N[C@H](CCSC)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 917392056 NUQIGUYHWTVBSK-MRXNPFEDSA-N 456.590 0.880 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)n1 918217830 LXTNUQJHYINQCG-GOSISDBHSA-N 458.519 0.705 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 919835621 KROSAIFIFQGLQR-UHFFFAOYSA-N 463.512 0.915 50 20 JCGD COCCCNC(=O)NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 920862545 SHVHGNCBOKQZJY-UHFFFAOYSA-N 489.982 0.320 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ccccn3n2)C1 1777814792 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C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1781232751 XUPKTCWTFGDZOE-RBUKOAKNSA-N 475.398 0.958 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1781859251 BYKWXJVBZLEQHB-JCGVRSQUSA-N 464.357 0.833 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C34CC(NC(=O)OC(C)(C)C)(C3)C4)C2)C1 1783438353 ROHHJIPYGIVSGH-KXTRFFEISA-N 493.605 0.637 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783969212 IOWRYXHHTWTLLG-CVDCTZTESA-N 493.630 0.277 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@@H]1CCc2nc(O)nc(O)c2C1 1785330553 HYCVHZVHNVIZCG-XBQZJTFMSA-N 487.326 0.663 50 20 JCGD O=C(CNc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1786809410 AOWXLYGQNSRCKB-NDXORKPFSA-N 455.295 0.211 50 20 JCGD C[C@@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)n[nH]c21 1786983459 UFNBPFBHLDQWOR-UVDFWXMISA-N 452.320 0.046 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)cc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786983686 QFQJQENDTQSTAK-NYVOZVTQSA-N 454.307 0.732 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3noc(C(C)C)n3)C[C@@H]21 1787506854 QURDQBIJQOCRDM-HRZAHRDASA-N 485.545 0.849 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(N2CCCC2)ccn1 1787621900 JDKQBVLBCOHEON-HARLFGEKSA-N 478.358 0.269 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4cc(Cl)ccn34)C[C@@H]21 1788610153 GOFMFSCZNGZJLX-IXDGSTSKSA-N 497.943 0.893 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1 1788764176 CLYCHNUEIMPBJN-XLAORIBOSA-N 458.584 0.312 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1789693620 QRRYXILEXFCSMW-LQJIQPLVSA-N 491.564 0.297 50 20 JCGD Cc1cccn2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]43)c12 1790507745 KXQRBVKBXZXWSQ-WDSOQIARSA-N 456.547 0.609 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1791236801 ZMTFLEBGWJDKAA-MWGBTCRLSA-N 499.568 0.856 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(F)cc(F)c1F 1791992057 HMPBNBKVUAZUJA-IXDGSTSKSA-N 462.233 0.691 50 20 JCGD CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1792784809 WAWLRVYTJLHSRY-MIFYACCESA-N 454.980 0.746 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1793087386 CCZIPZURLZTYNH-RNJOBUHISA-N 454.351 0.655 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1OCCc2ccccc21 1793274021 TYZVECXFTHOYIC-XQYWTEMXSA-N 479.537 0.592 50 20 JCGD COc1nccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1794372880 VMBSHUIOLZAEQF-ZSBFGKGUSA-N 485.453 0.836 50 20 JCGD CC(C)(C)OC(=O)NCc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c1 1794427389 CEFNPJSROUAFTL-MVJTYMMSSA-N 482.965 0.909 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)C2)c1ccc(B(O)O)cc1 1795737041 WBHZZERNBUZOGY-CEQLMSFQSA-N 460.299 0.274 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnn(C)c1)NC(=O)NCc1ccccc1 1795769242 CKLLUMDCIVTDHE-RUMRUAAYSA-N 497.600 0.289 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1F)NC(=O)NCc1ccccc1 1795990296 KRQPJRYNJBRNTN-OPMZPASUSA-N 484.532 0.770 50 20 JCGD Cc1snc2sc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)cc12 1796120540 ADFIOMMZNPUTNS-ZSBFGKGUSA-N 471.369 0.863 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNC(=O)c1ccccc1)C2 1796446300 RLXLUXSABATDKW-IIMWNBLQSA-N 494.552 0.530 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2O1 1797228240 OCLUOIMJLKUNFG-UPGWYZPTSA-N 465.510 0.714 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)n(C)n1 1798522634 GLTBVSRCRIYHSJ-VTEUUUEMSA-N 487.469 0.779 50 20 JCGD COc1ccc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1799637535 UKMWQNGMEFQULV-YVWYUNDQSA-N 453.499 0.519 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2cccc(F)c12 1800122008 BYRBUJNIYGRCHY-UTRJNVLQSA-N 481.488 0.811 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1800759711 ZZEZZXBKAIPNEG-REBRKWNGSA-N 466.398 0.031 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])C2 1801008855 FKRPUXCVJMCKPJ-USGNIVHTSA-N 481.937 0.753 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C)C2 1802333914 DPQROEVCTGKGFF-DFGXFYAUSA-N 479.578 0.576 50 20 JCGD C[C@H](Cn1cccn1)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804715264 IEWZPRKKLCHUIZ-ZNLUXHQJSA-N 461.331 0.614 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN2CCCC2=O)[C@@H]1c1cccnc1 1806923657 LPVLLHCORWEVNO-KKSFZXQISA-N 465.514 0.022 50 20 JCGD COc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1 1807360275 JUWLLXDZWVJQQZ-DYESRHJHSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374705 HUKPXPZMLWNBEN-QAPCUYQASA-N 464.247 0.026 50 20 JCGD C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCCN1 1808083065 OQDRBQRKNATKEW-ZDWFVDTJSA-N 451.531 0.542 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1 1810303092 PDOJWZKIVDDJQA-QRWLVFNGSA-N 485.508 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1 1810308171 JWTJRUYWNOXBQN-KKSFZXQISA-N 476.497 0.269 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(=O)nc3cccnn23)[C@@H]1c1cccnc1 1811337257 KLCHFFHONOQYGX-SBUREZEXSA-N 492.540 0.177 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnc3c(c2)CCNCC3)[C@@H]1c1cccnc1 1812380462 GIHOIPOLMSXPAQ-NLFFAJNJSA-N 493.612 0.857 50 20 JCGD O=C(CN1C(=O)C=CC1=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1 1813177748 SPQNISPRLWHJBC-AFAVFJNCSA-N 453.268 0.703 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)CNC(N)=O)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1814229148 ATDFKZGXQCICBW-KNQAVFIVSA-N 496.572 0.102 50 20 JCGD C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(C)C(=O)C(=O)O)[nH]n1 1814783635 RANPNZNTOQSWKX-ZYHUDNBSSA-N 458.313 0.976 50 20 JCGD C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348608 RYCIFDDKYLPSPS-CABZTGNLSA-N 452.139 0.832 50 20 JCGD O=C(CCC(=O)N1CCCC1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350369 STYWOBZBHBHDOG-INIZCTEOSA-N 470.360 0.451 50 20 JCGD Cc1nnc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)s1 1815354648 OTUWQIAYHVAFEL-ZDUSSCGKSA-N 457.346 0.451 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1 1816077200 AIPYJUDEKHFWFF-INIZCTEOSA-N 477.485 0.522 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(CO)on2)[nH]n1 1819403338 FSZFFNDDRVUCMH-INIZCTEOSA-N 454.447 0.508 50 20 JCGD COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)nn1 1819403554 SUVBTGBDVRGBCT-INIZCTEOSA-N 465.474 0.827 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1821684454 HJFJJXLPMDEZQI-SUMWQHHRSA-N 458.280 0.957 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)[nH]n1 1822412110 ISIQXQPOBHQZLU-CVEARBPZSA-N 495.581 0.660 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnnn1C)CC2)NC(=O)NCc1ccccc1 1822518318 JHLMQBDXLAAUEI-HNNXBMFYSA-N 497.585 0.844 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CNC(=O)C3)sc2C1)NC(=O)NCc1ccccc1 1825203898 DGKHJANARXSVBO-HZPDHXFCSA-N 499.597 0.537 50 20 JCGD COCCn1nccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1827813019 VULAAEGYLWRZPL-OAQYLSRUSA-N 468.363 0.756 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cn3ncccc3n2)CC1 1828262066 ZNLUPWUAIJSEPO-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD Cc1nc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)no1 1828923568 MMDMVOBJEMTUKW-GOSISDBHSA-N 455.519 0.853 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829052612 PLNFVWXBVJHUFW-ZJBJCVSYSA-N 497.955 0.566 50 20 JCGD O=C1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCN3C(=O)OCc2ccccc2)=NN1 1829056855 QQDVZMLBPLLAHV-LAUBAEHRSA-N 479.896 0.849 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cc(F)ccc1Cl)CCO2 1832273283 QHODGJIDFMNAND-JOCHJYFZSA-N 484.956 0.851 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1=O 1832544151 UKPMTHGOVVQGSV-IMWIBFENSA-N 493.988 0.712 50 20 JCGD COc1ccccc1OCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833184747 DVDPLLRSRPCEJX-UHFFFAOYSA-N 495.385 0.639 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3C(N)=O)CCO2)C1 1833315655 XZPGSWMLHNZCJR-OALUTQOASA-N 459.330 0.487 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c(=O)[nH]c1C 1833389603 AUYNJOIQXDECML-OALUTQOASA-N 461.346 0.693 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1 1834801011 GHZTUGJVXQETRP-UHFFFAOYSA-N 482.394 0.212 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1F 1835926427 NBQZNUPHAMWNBO-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD Cc1ccc(OCCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835926634 VWFINYUIFHYWII-RUZDIDTESA-N 482.342 0.214 50 20 JCGD O=C(CCc1ccc(F)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932184 SDUUXCVUUUWZSN-DEOSSOPVSA-N 470.306 0.208 50 20 JCGD COc1nccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1F 1836237811 IRMZXECYWZRXPV-CXAGYDPISA-N 464.263 0.990 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1 1836412637 ORLLZMDHNFAVRT-UONOGXRCSA-N 450.353 0.695 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1ccccc1=O)CCO2 1837681397 ZAGCTVXTCWOCTF-GQIGUUNPSA-N 470.364 0.897 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CS(C)(=O)=O)nc3)C2)C1 1837711838 SLRUMCWBSXOSOS-OAQYLSRUSA-N 499.662 0.548 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccncc3Cl)CCO2)C1 1837887043 DLFLRWULKPKHNL-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838107094 RJWNXXDAURWEQX-HNNXBMFYSA-N 474.562 0.164 50 20 JCGD CCC(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528366 TVDFCJVLNQADBV-NRFANRHFSA-N 463.443 0.569 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CC3)C2)C1)NC(=O)NCc1ccccc1 1839054305 SIVQZOKXYSAZMF-XMMPIXPASA-N 473.574 0.589 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839524689 DHFKMBWHANBVER-FOIQADDNSA-N 454.886 0.452 50 20 JCGD CC(=O)NCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839886223 OMZRRERZHWDJMS-SIKLNZKXSA-N 496.402 0.975 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1839963073 ZCYUNHREOQKESL-JXFKEZNVSA-N 483.363 0.441 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c(F)c1 1840184733 COEPSHYVCRXCOH-GGXQVSFTSA-N 492.548 0.677 50 20 JCGD O=C1NC(=O)[C@@H](CC(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)N1 1841962027 QLKSIIWEHSRZCX-HUUCEWRRSA-N 463.332 0.794 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)C2 1843416038 RVFLYIKTZCDVNG-JVPJOIETSA-N 459.532 0.126 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnc(O)nc1O)C2 1844692636 SDCZDCRSTLGFMI-UHFFFAOYSA-N 457.399 0.852 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)C1 1845071805 MWYSLOAZKSNTER-ZDBASDEZSA-N 454.531 0.725 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)NNC(=O)C(=O)NC1CC1 9889204 SBBRITWQJLSWMS-CYBMUJFWSA-N 483.399 0.819 50 20 JCGD CCCC[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12 14044540 RXKWUQYYUCJXJQ-INIZCTEOSA-N 482.522 0.982 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H](C)Nc2nc3ccccc3s2)cn1C 725880763 LTLZUXNWWMIAQN-LLVKDONJSA-N 465.561 0.655 50 20 JCGD CN1CCN([C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)c2cccs2)CC1 726087243 VABLPYLDMPDAJP-AWEZNQCLSA-N 450.590 0.859 50 20 JCGD COc1ccc(CN2C[C@@H](C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)CC2=O)cc1 726523476 NWYRZXTVGKRXGN-SFHVURJKSA-N 488.566 0.820 50 20 JCGD COc1ccc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cc1OC 726710674 NBRBHVWBRLZGSA-UHFFFAOYSA-N 457.491 0.177 50 20 JCGD O=C(COC(=O)c1cc([N+](=O)[O-])cc2c1OCCO2)NNC(=O)[C@@H]1COc2ccccc2O1 728344539 WLJKXFRLUDKZEZ-INIZCTEOSA-N 459.367 0.510 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)OCC(=O)NNC(=O)c2cccs2)[C@@H](C)O)cc1C 777290626 LXKWVJZNXUBUHN-CXAGYDPISA-N 469.541 0.397 50 20 JCGD CN(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 789852152 CYNLKLKNHWSTNU-KRWDZBQOSA-N 463.468 0.081 50 20 JCGD Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 818024636 QPWNABADTKVBME-WOJGMQOQSA-N 473.490 0.830 50 20 JCGD CC(C)(C)N1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1=O 914710050 GWKHSTRCYPNLIV-HNNXBMFYSA-N 452.533 0.116 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(N2CCOC2=O)cc1 915275014 BPFWSPVIMBJTLV-UHFFFAOYSA-N 474.495 0.739 50 20 JCGD CNS(=O)(=O)Cc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1 916228633 LBXHMOFPKFAUHT-UHFFFAOYSA-N 470.577 0.644 50 20 JCGD Cn1c(C[C@H]2CCS(=O)(=O)C2)nnc1SCC(=O)NNC(=O)c1ccccc1Cl 1317708174 ASIODHRGWYGPPN-LLVKDONJSA-N 457.965 0.999 50 20 JCGD C=C(Oc1ccccc1O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1778082725 MXMCJKCLCCTFPT-RCZVLFRGSA-N 480.326 0.792 50 20 JCGD CC(=O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)n[nH]1 1778091608 YIHAHTNIYZAIRJ-OTHBRBSCSA-N 483.529 0.874 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnn1)C2 1778093000 ZADOCLFXLLRZIR-GULKHOJOSA-N 453.503 0.738 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccncn2)C1 1778156111 LDCLVEMVQPBUER-VWCSSDMBSA-N 453.503 0.738 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3ccc(F)cc13)CCO2 1779031921 HLVPISKBKLLRDM-JOCHJYFZSA-N 467.461 0.458 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779037064 MFTVLPBVAQZFFQ-NRFANRHFSA-N 475.889 0.507 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2 1779198925 YXPZGBAKSCDKCD-SCGCMHLBSA-N 464.357 0.596 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cncc(S(C)(=O)=O)c1)CCO2 1779295696 ANLUXXXQOLTPKC-IBGZPJMESA-N 455.609 0.780 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1 1780186002 DSZGWUGBKQNOJY-DEOSSOPVSA-N 466.542 0.960 50 20 JCGD COc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n1 1780970012 QHVIATGLLHZFMZ-RUZDIDTESA-N 496.568 0.880 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970096 RNYQISGKYXTURP-XMMPIXPASA-N 488.589 0.031 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1781232878 NNEIUWBGVNFEPD-HOTGVXAUSA-N 454.401 0.913 50 20 JCGD COc1ncccc1CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782209428 OSYNOLNMTBRWND-NTKDMRAZSA-N 475.590 0.910 50 20 JCGD CN(C)[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccc(Cl)cc1 1782821772 MZKWMNQPJOAECI-URXFXBBRSA-N 485.777 0.766 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1783234827 QRWLAFNLQVMLSN-ZJSXRUAMSA-N 499.304 0.784 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCn3c(=O)oc4ccccc43)CCO2)C1 1783933678 VMLAMGQFRJVQDI-HSZRJFAPSA-N 473.530 0.188 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc(C(F)(F)F)cn1)CCO2 1783933943 OLFWQUQZPWDGOY-GOSISDBHSA-N 458.441 0.312 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2n1 1783934821 HVIYBQUMMAQYCG-JOCHJYFZSA-N 458.519 0.388 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)c3)[C@H]2C1 1786041178 RUZNZLJCHMVBCJ-JQFCIGGWSA-N 458.906 0.641 50 20 JCGD Cc1nc2sccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1788441329 ISIIZTSWVWSGAU-JYJNAYRXSA-N 462.576 0.671 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4nccc4c3)C[C@@H]21 1788610946 BQUDAKUQFCEFFW-YSSFQJQWSA-N 463.498 0.240 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3COc4ccccc4O3)C[C@@H]21 1788611430 BFEFIASZMMWYDE-QMHYAUOFSA-N 481.509 0.118 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21 1788700348 DKRXGZNYRYUJMM-BWJWTDLKSA-N 482.379 0.606 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)nc3C(F)(F)F)[C@H]2C1 1788899516 FOXSUYQVTJNRMJ-YDHLFZDLSA-N 474.484 0.405 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)nn1C 1789724601 ADVWJADUBIFENU-ONTIZHBOSA-N 497.600 0.668 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1 1789926602 CWHOHUKVNWCTSP-HVQZGBDUSA-N 474.331 0.127 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2)[C@H](O)CCl 1792980978 BTXSJEMFBLKSLE-UJMXGEILSA-N 451.951 0.077 50 20 JCGD COc1cc(N2CCC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)CC2)ncn1 1793106361 FVUJRVSDGUOQGI-YYIAUSFCSA-N 451.955 0.940 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1793249596 ULTWPYHQCDFENE-DTNKQSLVSA-N 476.486 0.638 50 20 JCGD O=C1CN(c2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)n2)CCCN1 1794505516 CMPMYCHYDWOKJX-GGNLRSJOSA-N 453.902 0.146 50 20 JCGD CC(C)COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)ccn1 1795734678 ZTUYOXJGHCSIKO-HATOLVCRSA-N 467.331 0.313 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3[nH]1)C2 1796442005 MMZURQMMKYLWST-UMNWKFCPSA-N 463.498 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(Br)CC1)C2 1796443859 OPMURHWHGAZUIU-NECFCHHASA-N 466.336 0.638 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@](C)(Cl)CCl)C3)cn2[nH]cnc(=O)c12 1798467726 VWUFGJFBUGZFPG-NMRSOGARSA-N 456.330 0.771 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1799378236 CAXMUHIFUCOMKG-IHSNIMORSA-N 453.499 0.356 50 20 JCGD Cc1cccc(C)c1N1C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)CC1=O 1801010849 ZUBSTPZVYYUQNP-KTIHBUSBSA-N 499.612 0.619 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C 1801161241 ZIKGNYFQZPCPSE-LBKYZSNHSA-N 473.954 0.756 50 20 JCGD Cc1nc(O)c(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nc1C 1804871922 BKQJXZRQACOSET-UTKZUKDTSA-N 469.546 0.887 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(F)c1 1805082335 HFIVWMPZFRQLHZ-JTSKRJEESA-N 478.289 0.938 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C(=O)N(C)C)[C@@H]1c1cccnc1 1806941521 GAYHQRAFADTDKQ-SWUPIQEVSA-N 453.503 0.310 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1 1808416834 RUNSPHSUCGANST-RQHOZGTDSA-N 491.508 0.146 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1nc2c(=O)[nH]c3ccccc3n2n1 1809457260 JABHRRNHIFWERO-QGTPRVQTSA-N 495.927 0.885 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1 1810637845 DXULSNLAHLASIM-LIRRHRJNSA-N 458.479 0.406 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(=O)ccn2C)[C@H]1c1cccnc1 1811366716 PZFAOOFTLQSSHC-VGOFRKELSA-N 454.531 0.473 50 20 JCGD CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1 1811620336 CLGIOGMZXJBWPX-AVRDEDQJSA-N 475.314 0.584 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1)[C@@H](O)CCl 1814874939 JLDUQSQKOXOCBZ-OCCSQVGLSA-N 452.855 0.772 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3ncnn3c1)CC2)c1ccc(B(O)O)cc1 1815344064 FDSARAFGZWOBIY-HNNXBMFYSA-N 462.300 0.405 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356936 VRRVJQVTFWHYQI-MGJNZBDHSA-N 472.332 0.578 50 20 JCGD Cn1nc2c(c1C(=O)N[C@H]1CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C1)CCC2 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CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCN(C)CC3)CC2)CC1 1835483453 DDCIYYJXPKGTMD-LJQANCHMSA-N 472.472 0.979 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCSC(=N)N)CCO2)C1 1835643632 HKULEASSGIYJAU-BLLLJJGKSA-N 451.387 0.491 50 20 JCGD Cn1cc(F)cc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737863 JCLUVWZHKDPGNL-UHFFFAOYSA-N 471.537 0.662 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nc2ccccc12 1835937365 SGENAQNTODWQNF-AREMUKBSSA-N 489.337 0.607 50 20 JCGD O=C(Cn1cc(Cl)cn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1835974956 TWHJDIGRCSQPSU-UKRRQHHQSA-N 453.696 0.683 50 20 JCGD O=C(c1cnc2cc(Cl)ccn12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836368170 ZSBUTEYMVRVXTR-KXBFYZLASA-N 457.314 0.657 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1 1836392268 JGYSWYZLBZRXDC-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1837605659 FGCLIWVTQKVJLI-BTYIYWSLSA-N 467.954 0.316 50 20 JCGD 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COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc([N+](=O)[O-])c(OC)c1)C2 1800977745 WWFDJDGZIFRGCZ-YGTYGHESSA-N 455.895 0.989 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1 1801447079 HAHZTNPRSRCLBP-JSLGZRHDSA-N 487.420 0.588 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@@H](CNC(=O)CNC(=N)N)[C@@H]1c1cccnc1 1807051711 KLAWIQMHIPPUNJ-ZOBUZTSGSA-N 481.985 0.703 50 20 JCGD Cn1ncc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1Cl 1807362531 VVKTUSDZLXIOPO-LPHOPBHVSA-N 467.722 0.782 50 20 JCGD COc1ncc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1F 1807363505 PLQKUJBRDKPSCE-UTKZUKDTSA-N 478.289 0.938 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807366030 RKFFGBJIGFPCQE-HJNYFJLDSA-N 466.347 0.386 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807368603 VYEKVXBGYCDBLD-AKIFATBCSA-N 464.375 0.954 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccn(C(F)F)n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374943 LLIYLRHCMBWRDR-LPHOPBHVSA-N 469.257 0.986 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)NC=O)[C@H]1c1cccnc1 1808362293 WVDRWLMLHUQOCG-AYNQPBFESA-N 453.503 0.356 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC2)C1 1809969639 YPDOOYWEUVSYBX-UHFFFAOYSA-N 474.216 0.566 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1 1812142792 YSNFSTCWZAYULB-KKSFZXQISA-N 474.525 0.856 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)CCC(N)=O)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1812633141 MPAUUAFPSQLKBZ-HYBUGGRVSA-N 495.584 0.699 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)Cn3cnnn3)sc2C1)NC(=O)NCc1ccccc1 1815685601 IFTGCLJHCNBRGE-HNNXBMFYSA-N 498.573 0.088 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1cnc2snnc2c1 1821276927 VTLGNBMSJVGRFK-CYBMUJFWSA-N 480.340 0.762 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)[C@@H]1SC(=N)NC1=O 1822414250 ORBBGLTUDPYRCJ-BNLOLNQZSA-N 478.579 0.577 50 20 JCGD CCOC(=O)C1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1827053316 KNYYOWPENSKOTA-FQEVSTJZSA-N 456.348 0.943 50 20 JCGD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)nn1C 1827056241 BRDSRVYOYIRGNL-HXUWFJFHSA-N 454.336 0.656 50 20 JCGD CNC(=S)NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827058206 QVNPSARMWAKOFK-IBGZPJMESA-N 460.409 0.084 50 20 JCGD O=C(c1cnn2ncccc12)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059471 QZIPTEMQJDGFRY-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CNC(N)=O)CCN2C(=O)OCc2ccccc2)C1 1829476896 ZRVSAUZUIDUXSM-VGSWGCGISA-N 495.964 0.361 50 20 JCGD COc1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)nn1 1829524412 SQHBOHMPLGCNRI-FQEVSTJZSA-N 452.320 0.712 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)nc3sccn23)CC1 1829561564 OGWWWUHSAPXFQU-LJQANCHMSA-N 494.382 0.983 50 20 JCGD CCc1nn(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1Br 1830723445 NUKMRRCJXKGHBQ-FZKQIMNGSA-N 493.786 0.415 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1c(F)ccc(F)c1F)CCO2 1832076457 JSNYLAIUYOFWRT-QFIPXVFZSA-N 486.491 0.476 50 20 JCGD Cc1ncncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549703 YJRIATHKVZYGBW-JTSKRJEESA-N 497.980 0.987 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCc3ccco3)CC2)CC1)c1ccc(B(O)O)cc1 1834797551 XVNWRRDMESATAB-UHFFFAOYSA-N 453.348 0.777 50 20 JCGD COc1nccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1F 1834906273 YBFQPWZRQIPJOD-UHFFFAOYSA-N 484.337 0.408 50 20 JCGD Cn1c(=O)n(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c2ccccc21 1835454452 FBJFVQYQVGKKOH-FQEVSTJZSA-N 477.993 0.511 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4[nH]ccc4s3)C2)C1 1835937480 ZDTFZAZRXZQRSN-QFIPXVFZSA-N 469.328 0.293 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)nc4cccnn34)CC2)CC1 1836101173 PBZIDZJRXDHEFZ-KRWDZBQOSA-N 476.965 0.529 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1836666977 JUNIVVUFPDWCKE-DEOSSOPVSA-N 489.573 0.017 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922009 ARVAMZCRMSZEAG-QGZVFWFLSA-N 468.363 0.745 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN(CCO)CCO)CC2)CC1 1838638890 PGRPTIIGZHWWCG-HXUWFJFHSA-N 468.422 0.508 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C3CCCCC3)CCO2)C1 1839182205 QDXJEDGKQHCEMN-JXSPYEIYSA-N 471.558 0.892 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1 1839609548 ABXKMIZWLAKPCY-JTSKRJEESA-N 465.934 0.895 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839652088 MXJDWXFESNWBJL-DOTOQJQBSA-N 461.288 0.262 50 20 JCGD CC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1839861008 ZPDNMOLVFHYHLF-NQIIRXRSSA-N 482.375 0.585 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1 1839966429 DJZQOKYYEREVFP-CKFHNAJUSA-N 494.383 0.459 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1 1840033122 UYWOUPFVKWGJSX-KLHJMIIUSA-N 466.376 0.941 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)C1 1840150368 KEEUIIOEPRDOOL-OSLWLWRUSA-N 457.867 0.911 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1 1840153533 RZMVSOSDSWHUFQ-FOIQADDNSA-N 454.886 0.797 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1 1840184924 FPHFLSLNAUCZCH-QHCPKHFHSA-N 462.547 0.447 50 20 JCGD CCOc1c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cnc2c1cnn2C 1843214390 IOJPJZSLSSQIKL-UHFFFAOYSA-N 478.513 0.496 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCCN1C(=O)c3ccccc3C1=O)C2 1844263635 ZNNRVNFTFIDION-UHFFFAOYSA-N 490.520 0.579 50 20 JCGD C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C1 1847089276 PWUIPZPPHSAJGH-RYUDHWBXSA-N 461.357 0.742 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1847967176 HRDOLRUKNZVRSC-UFYCRDLUSA-N 471.363 0.971 50 20 JCGD CCCOc1ccc(C(=O)NNC(=O)Cn2cc(Br)c(=O)[nH]c2=O)cc1OC 24290236 KUZZSZOWJBKSHN-UHFFFAOYSA-N 455.265 0.558 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1 726294509 YWHWETGKIDUQDM-UHFFFAOYSA-N 473.305 0.693 50 20 JCGD C[C@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1C(=O)NC2(CCCC2)C1=O 726495736 HEIMTPKALYXODY-QGZVFWFLSA-N 456.547 0.599 50 20 JCGD Cc1cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc(S(=O)(=O)N2CCC(C)CC2)c1C 729276191 YTGSVPCDKWFRQK-HNNXBMFYSA-N 474.605 0.423 50 20 JCGD C#CCOc1ccc(Br)cc1C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O 730571730 SKQSPFKDASDBCZ-UHFFFAOYSA-N 466.317 0.496 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCN(Cc3ccccc3)C2=O)cc1 744877267 BOFXFXOPXATFFR-LJQANCHMSA-N 473.555 0.747 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)NC(C)C)CC2)c1 745146367 QCBBTHUHRJZXNP-UHFFFAOYSA-N 453.565 0.655 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c1 749123301 ZBZSKHACVQITLW-AWEZNQCLSA-N 457.555 0.766 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1sccc1S(=O)(=O)N1CCc2ccccc2C1 812205200 LDAVZJUSXURZCJ-HNNXBMFYSA-N 483.593 0.691 50 20 JCGD COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1 913471136 BSRJNYDTGJLRDO-UHFFFAOYSA-N 459.484 0.577 50 20 JCGD CS(=O)(=O)NC1(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CCCCC1 916253796 LQPUDIBXARWULR-UHFFFAOYSA-N 460.582 0.176 50 20 JCGD O=C(NCCc1cccs1)NNS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1 920833105 YYFJYUKFSKLDBH-GFCCVEGCSA-N 452.514 0.921 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)/C=N/N3CCCCC3)C2)C1)NC(=O)NCc1ccccc1 1779019611 SASHGLWYGACABE-YYYGAUAXSA-N 499.616 0.634 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3c[nH]c4ccccc34)CCO2)C1 1779032155 CSSHQTNAMVNYPV-XMMPIXPASA-N 462.510 0.853 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccn1 1779032298 ISAMMBXUVRPTID-HSZRJFAPSA-N 482.497 0.014 50 20 JCGD Cc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371501 VZGABYPJFZZTLT-XMSQKQJNSA-N 455.519 0.168 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)N2CCN(C)CC2)C1 1780642464 UTGBHIHKSIMJON-WOCWXWTJSA-N 459.429 0.920 50 20 JCGD N#Cc1cc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)ccc1F 1781298216 BMAQASIVFVNCQN-HSZRJFAPSA-N 451.263 0.063 50 20 JCGD CCc1[nH]nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c1F 1782209493 TZCCEIUYRKJPDJ-QVKFZJNVSA-N 452.531 0.612 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ccsc4[nH]3)C2)C1 1782286271 UWWLLDHKCMQILX-OAQYLSRUSA-N 454.512 0.985 50 20 JCGD COc1cc(F)ccc1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1783307409 YHAYQXMQYTVQJN-RCZVLFRGSA-N 484.333 0.884 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1783345116 XSUFQPUZSOZMJN-KPZWWZAWSA-N 454.325 0.244 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ncn(-c3ccccc3)n1)CCO2 1783935442 TYVHCITVTJQLSW-QFIPXVFZSA-N 455.519 0.084 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1 1783966276 CIKRCUYGRCTPTF-BXBUPLCLSA-N 477.352 0.492 50 20 JCGD CN1Cc2ccccc2C[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785022536 FCSKGMBIPDLKKF-BIHRQFPBSA-N 477.370 0.016 50 20 JCGD Cc1ncccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785124962 BGWXQJROLFZTEM-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cc(C)c(O)nc3=O)C2)C1 1785354692 QTERTXOBCWCYST-SCLBCKFNSA-N 457.325 0.261 50 20 JCGD Cc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)cn1 1785988540 MXFBCBQCNZQTNO-ONTIZHBOSA-N 495.584 0.725 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc2c[nH]nc12 1786985227 SXQWSAZOSUEYCS-NDXORKPFSA-N 462.315 0.458 50 20 JCGD Cc1noc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)n1 1787053357 QGJWWZSNSJRXST-UFYCRDLUSA-N 499.572 0.246 50 20 JCGD Cc1ccccc1NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610539 DSOMWAGLIMRSEJ-LRQRDZAKSA-N 466.542 0.699 50 20 JCGD CC(C)(C)OC(=O)N1C[C@]2(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)C[C@H]1CO2 1789775679 XBAZAUNAZHEJBO-PLNSCZHZSA-N 487.981 0.344 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)C[C@@H]21 1791249106 FHVWROMNDBUFJD-GYNGXATPSA-N 481.977 0.399 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2cccc(F)c2)CC1 1793782527 GELSEHPURWGJKQ-YVWYUNDQSA-N 467.501 0.759 50 20 JCGD Cc1ccc(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1795309217 FOPNXXOTZLIXAR-VPTLXERWSA-N 453.499 0.276 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3ccccc3)n1)C2)c1cccc(B(O)O)c1 1795738965 NDLUKISYFVPRKK-IRJINJETSA-N 471.322 0.945 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1nn(-c2ccccc2)c2c1COC2 1796095792 MCBDGDFRSOQHOM-GTYSZEQSSA-N 460.918 0.705 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1ccccc1C(=O)OCCO 1798565146 GCSUZLHFIOBTCI-VZAMPYOESA-N 473.295 0.729 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)NC(=O)OC(C)(C)C 1799684752 OLOMDRSVFCPVNW-KBRXKUPHSA-N 464.357 0.593 50 20 JCGD CC(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1O 1799846530 XEDLLCUMNWTOLG-NEANFDDLSA-N 496.524 0.688 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(C)(C)C 1803387081 ZOFWYCDUKYFTBR-DZFGPLHGSA-N 495.584 0.951 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(C)(C)C 1807359371 HYXBIEPGWBOYAU-BAGYTPMASA-N 480.374 0.632 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370504 GDYIASRFBYPFCI-UTKZUKDTSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371297 SAIBWVYQGQPLCU-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1807951205 YNQZZVVGXQWQBP-DVOMOZLQSA-N 489.334 0.701 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCCO2)[C@@H]1c1cccnc1 1810295423 SQEBRACLUSQZQH-FFZOFVMBSA-N 452.515 0.969 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1 1810295745 WZCKGKCNDPUVGJ-LIRRHRJNSA-N 462.470 0.209 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccn(C(F)F)n1 1810906811 IROAFPWGSADTBX-QFBILLFUSA-N 469.257 0.986 50 20 JCGD CC(=O)NC(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1815236393 SZKYJBIEZBXFFZ-INIZCTEOSA-N 456.507 0.629 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344308 SLZHYQOBCSTFMH-SWLSCSKDSA-N 458.349 0.354 50 20 JCGD CC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817282766 LRTROLOMFJATSP-IMNSPMKVSA-N 459.532 0.714 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CSc2ncccn2)[nH]n1)c1ccc(B(O)O)cc1 1817471485 PHUSIWWDDWGSFO-QGZVFWFLSA-N 466.332 0.978 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3ncccn3n2)CC1 1828552646 BWZMNZOQNBBVBL-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)N1C[C@@H]2C[C@H]2C1 1828810607 TYQGESGQBGGRRJ-SPAWWWTRSA-N 453.392 0.940 50 20 JCGD C[C@H](Br)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(O)O)C2)C1 1829330648 NFPJEMYJRRLNRI-XOBRGWDASA-N 484.347 0.533 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1830163927 SNANMPIYFHGRQZ-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCn2cncn2)CC1 1832118377 QEFDLYKQUDAVKQ-IBGZPJMESA-N 454.535 0.600 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3C(N)=O)CCO2)C1 1833315653 XZPGSWMLHNZCJR-MOPGFXCFSA-N 459.330 0.487 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@@H]1CCc2ccoc2C1 1833364922 MWAGSCSIEHQABY-LJQANCHMSA-N 479.386 0.950 50 20 JCGD COCC1(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1833461321 FZZJVAPVNNBHBZ-UHFFFAOYSA-N 458.563 0.297 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1833713803 DAXDIOPDSFFRID-HXUWFJFHSA-N 497.489 0.525 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CN3CCCCC3)CC2)CC1 1834613767 UUFWDHCLYUKBSO-UHFFFAOYSA-N 450.628 0.417 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)ncc1[N+](=O)[O-] 1835188165 QWJZWTIOZCXIQN-UHFFFAOYSA-N 489.577 0.856 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc12 1835930688 UKWWLTPAVMMPTF-RUZDIDTESA-N 477.326 0.540 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836621099 ZIODIDRTAFOSDD-HBGVWJBISA-N 496.004 0.764 50 20 JCGD N#CCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837460098 UNSJQBKGRZUXEF-XMMPIXPASA-N 478.509 0.135 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc(CO)c(F)c3)CC2)CC1 1837922228 ZMUFBVOVICMULL-UHFFFAOYSA-N 484.333 0.924 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])CCO2)C1 1838601775 UCVTUARHZHUBCE-JLTOFOAXSA-N 487.893 0.633 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839153858 TYVJEFCJIPUZJD-IPELMVKDSA-N 483.345 0.174 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCS3(=O)=O)C2)C1 1839155589 YDWACUAORKROKW-RRQGHBQHSA-N 457.376 0.256 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1839243982 XETCMKUWVDMDJP-OXJNMPFZSA-N 455.895 0.535 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1839964772 BXDNZQVJDHQXPP-XOBRGWDASA-N 498.378 0.260 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1 1840154868 IFBXHWOJOCCLCT-KNQAVFIVSA-N 465.934 0.820 50 20 JCGD Cc1cc2cccc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2[nH]1 1840184652 ZQIAYYWGLZUFMY-XMMPIXPASA-N 471.558 0.919 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3cccc3)CCO2)C1 1840460878 QZSAKESTYFBHFU-IKUOUCRASA-N 484.557 0.859 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@@]21C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014958 UKGMHCOZTGJHKN-XDHUDOTRSA-N 469.347 0.583 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)C2 1844265242 JVKAJYPIAOTPNS-XDHUDOTRSA-N 460.494 0.412 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cnn3c2OCCC3)C1)NC(=O)NCc1ccccc1 1845613477 XYQLCTJZAYQKEF-UHFFFAOYSA-N 481.557 0.829 50 20 JCGD C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1846179195 QYGZIVGTDKFPQL-FRRDWIJNSA-N 473.393 0.153 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1OC 726649448 FZGQAMMDQZADTO-LBPRGKRZSA-N 462.459 0.261 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CNc2cccc(OC)c2)o1 728206044 RGNNAPMBHKZSGB-INIZCTEOSA-N 494.526 0.878 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@@H](C)Oc1cccc(Br)c1 728512670 FGRRWSQVPKKYFF-IAQYHMDHSA-N 455.309 0.491 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c1 729274988 IUNVYSYLIZYIBE-JTQLQIEISA-N 454.958 0.069 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc(-n3cnnn3)c2)c1 743730519 QMPJIYTWHGVIOD-UHFFFAOYSA-N 479.544 0.316 50 20 JCGD CS(=O)(=O)N1CCN(CCNC(=O)NNC(=O)COc2ccccc2-c2ccccc2)CC1 749352841 KCYCONMAHQZAAP-UHFFFAOYSA-N 475.571 0.640 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1 769597849 STKLXVXXOMKQDS-UHFFFAOYSA-N 469.527 0.841 50 20 JCGD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)NNC(=O)c1ccc(COc2ccccc2)o1 807137992 KFBNADUTSNBNBX-HNNXBMFYSA-N 478.527 0.838 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccccc1 821979183 OENZFVDWSKXBNI-NZHZHZHDSA-N 465.553 0.841 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1 913446099 LJDRMBXBHIEMBA-INIZCTEOSA-N 463.512 0.993 50 20 JCGD CCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C(C)=O)cc2)c2ccccc2c1=O 913571528 HTDHQYMRQREKOW-UHFFFAOYSA-N 471.495 0.359 50 20 JCGD O=C(COC(=O)c1cccc(S(=O)(=O)NCC2CC2)c1)NNC(=O)[C@H]1COc2ccccc2O1 914594158 IBFZHSQFLIBXMA-LJQANCHMSA-N 489.506 0.519 50 20 JCGD O=C(NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)N[C@H]1CCS(=O)(=O)C1 915880364 JVQABTRCPLPREG-KRWDZBQOSA-N 455.500 0.520 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc4c(c3)OCCO4)nc2)CC1 915894129 DYZFWSJDTDHLBE-UHFFFAOYSA-N 462.532 0.615 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919883882 DUCSSZIZMQVUSA-JSGCOSHPSA-N 458.562 0.064 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1)N[C@H]1CCS(=O)(=O)C1 919886346 RHDPHHOAOUUKRC-OCCSQVGLSA-N 462.450 0.571 50 20 JCGD CCCCNC(=O)NNC(=O)CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21 920764914 UFUWZMAXUAFWDZ-UHFFFAOYSA-N 453.521 0.900 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc2c1OCC2 1778449821 VLSBMGHYTWIEMX-PXDATVDWSA-N 464.327 0.743 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)CBr)C2 1779553253 LXEFVPHBJAWXAX-GKDNMFGBSA-N 462.385 0.682 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CSC(=N)N)CCO2)C1 1780097176 RRGPYALZDLYFNT-LJQANCHMSA-N 465.488 0.590 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H](F)Br 1780771206 HGDNIVIYJXLLRJ-IIDMSEBBSA-N 457.105 0.184 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1781812463 DOJIWJSFZIGVGM-YGPNGPECSA-N 471.470 0.381 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]nnc3n1)C2 1781901165 ZCJIJMRKGQGRAU-AEDCBLDQSA-N 482.339 0.114 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2 1781998485 XOBKYECFCYJCIQ-WHWRDJHUSA-N 467.324 0.329 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)CCO2 1783869917 SISSERQFNMOCLB-VLMPBXDWSA-N 489.997 0.688 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1)CCO2 1783884033 NPFKSGKZUDVXAV-GCKMJXCFSA-N 475.970 0.706 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C[C@@H]21 1783972040 HWKXAISEMQFREF-SMSYFYOWSA-N 478.384 0.840 50 20 JCGD N=C1NCCN1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)Cc3ccccc3)C[C@@H]21 1786845198 VNGLLTAUSVAPLF-OKYOBFRVSA-N 492.418 0.812 50 20 JCGD Cc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)n1 1786983387 OPFBFDQGEDIFFM-NYVOZVTQSA-N 451.332 0.296 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21)c1cccc(B(O)O)c1 1786984473 JTFVLQLRQARVGR-XIRDDKMYSA-N 456.283 0.013 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4sc(C)cn4c3=O)[C@H]2C1 1788037540 LGWBMDSZVKHCNW-HNKHHVNMSA-N 468.963 0.912 50 20 JCGD O=C(NC1(c2ccc(NC(=O)c3n[nH]c4c3CS(=O)(=O)C4)cc2)CCC1)c1ccc(B(O)O)cc1 1788316264 VZBGRBOFTREBNO-UHFFFAOYSA-N 494.338 0.579 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4sccn4c3)C[C@@H]21 1788610104 DLQZENOIUHOYFC-KKXDTOCCSA-N 468.539 0.906 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)CC1 1792126197 MZVDSLUGQLEOBN-FJIDUMEYSA-N 489.013 0.119 50 20 JCGD CC(C)(C)OC(=O)N1Cc2[nH]nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)c2C1 1792976241 RWWXXSJTXAZMQE-VZAMPYOESA-N 483.953 0.463 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)N1CCCC1 1793801863 CFEQXZLCUCTWLW-OVZJUGGFSA-N 472.546 0.113 50 20 JCGD COc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1C 1794983929 MFMLIHBEBKSAGX-DECYYXMYSA-N 468.514 0.736 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)[nH]n1)C2)c1cccc(B(O)O)c1 1795740319 RWHYKEAHJOYNQW-OPMZPASUSA-N 460.299 0.274 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188493 NFKZMQAYYZYKDM-MSPZUWAUSA-N 467.306 0.576 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3cnccc13)C2 1797751875 XDELUZPVQILEQD-VPTLXERWSA-N 460.494 0.750 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(-c2ccccc2)n1 1798698727 YENLZCMEBCTOES-FAQVEIGNSA-N 454.531 0.449 50 20 JCGD 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COc1nccnc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807369655 RHVMSLTXQJUETR-PXNSSMCTSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CN2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374652 HAIOGMXXBGQPND-PZUNEJSGSA-N 484.365 0.796 50 20 JCGD O=C(CSc1ncccn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807571282 NESSLMNLRRLPAC-RXVVDRJESA-N 477.355 0.663 50 20 JCGD O=C(CC(F)(F)C(=O)O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808286585 GEFXBVMIZYCDAP-QAPCUYQASA-N 461.230 0.191 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813069687 AAHIYEOOAAAUSB-JUXOCIIHSA-N 455.563 0.993 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344229 OWVVEBTYAWMHKH-IUODEOHRSA-N 466.332 0.339 50 20 JCGD O=C(CCCn1ccnc1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347651 IYGHXWACVOVPLJ-MRXNPFEDSA-N 453.333 0.726 50 20 JCGD COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n(C)n1 1815355458 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CC(=O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831121661 LIMBIDGHUIUMCA-VCOZGABYSA-N 461.519 0.192 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1F)CCO2)NC(=O)NCc1ccccc1 1832126226 FVBVSVQKSIIDMH-MSYCTHLASA-N 477.537 0.147 50 20 JCGD O=C(CNC(=O)c1cccs1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833836586 UYEDFBQQJLHCKW-UHFFFAOYSA-N 498.414 0.043 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnnc3)CCO2)C1 1834030108 XYKDMIVQRLGDHD-QFIPXVFZSA-N 485.453 0.694 50 20 JCGD COc1ncccc1CCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834799894 LIOCGYUYQCFVNU-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccn(C(F)F)n3)CC2)CC1)c1cccc(B(O)O)c1 1834800971 DAPWGTGRJCBFAL-UHFFFAOYSA-N 475.305 0.457 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1 1835171822 COQVPHZCQOFZGO-KKSFZXQISA-N 454.907 0.668 50 20 JCGD CO[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1 1835284827 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CCCO3)CCO2)C1 1840012521 MPENIPGFEKXJLQ-QYWGDWMGSA-N 475.970 0.754 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])C2)C1 1840155038 NOOJSRUQADSQJA-UWJYYQICSA-N 485.921 0.856 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)C1 1840155074 PDFDJSVRQPRRQB-XOBRGWDASA-N 481.893 0.795 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1841751492 MTMLVFBJQPRGAW-QGZVFWFLSA-N 488.545 0.138 50 20 JCGD Cc1cccc(C)c1N1C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CC1=O 1843010633 MUZQSQABOIWOCI-FQEVSTJZSA-N 475.354 0.853 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)c1cnco1)C2 1843428917 YGKAILMAZXPZIH-SFHVURJKSA-N 498.345 0.307 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cnn3c1OCCC3)C2)NC(=O)NCc1ccccc1 1845039171 MNGDIZYSPBGTDD-UHFFFAOYSA-N 481.557 0.829 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)C(=O)C1 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CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CCc1ccco1 748266339 GACGHCGTGBVREV-INIZCTEOSA-N 491.975 0.795 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3c(c2)C(=O)N(C[C@H]2CCCO2)C3=O)n1 761139236 FHDCOAZTINUKNG-CQSZACIVSA-N 486.506 0.773 50 20 JCGD O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1sccc1S(=O)(=O)N1CCOCC1 789985791 FFNNSFQJWTYZOY-AWEZNQCLSA-N 453.498 0.370 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)c2ccccc2c1=O 914750518 JKMTYKUTLJKEBH-UHFFFAOYSA-N 459.484 0.869 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CNc2ccc(OC)cc2)o1 915064825 SWZWXMMUTVPGJI-INIZCTEOSA-N 494.526 0.878 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC[C@H]1CCCO1)N(S(C)(=O)=O)CC2 915879496 DEWDXWKDEXNSEJ-ZBFHGGJFSA-N 470.548 0.462 50 20 JCGD Cn1nc(C(=O)NNC(=O)CS(=O)(=O)c2cccc(Br)c2)c2ccccc2c1=O 916123133 JQUMGSWXTSCGFZ-UHFFFAOYSA-N 479.312 0.931 50 20 JCGD C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1cccc(S(N)(=O)=O)c1 916197477 UKMKTRMTKLWPDE-CQSZACIVSA-N 497.603 0.052 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccccc2CS(=O)(=O)N2CCOCC2)n1 916229576 QRLRPUUFJZJXDY-UHFFFAOYSA-N 464.548 0.193 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc1C 916391860 JTLPIYBZBIFBNI-UHFFFAOYSA-N 453.499 0.785 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1 920827552 UIYCBQCWVCKQRY-IBGZPJMESA-N 474.514 0.711 50 20 JCGD CNC(=O)Cn1cc(NC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)cn1 920855200 ZAWAQUNKVCIPEZ-CXUHLZMHSA-N 476.497 0.922 50 20 JCGD C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1nn(C)c(=O)c3ccccc13)C2=O 933556995 LGROENZRILOUPC-ZLOXQWCVSA-N 468.514 0.831 50 20 JCGD COCCn1nccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1778235114 AUHAJNBWXZIAQB-XMSQKQJNSA-N 464.567 0.030 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1779181042 DICJLCXGRZKIMI-NJSLBKSFSA-N 468.352 0.598 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnncc3C(=O)O)C2)C1 1779522237 FAQXSNDJECHRNO-YCRPNKLZSA-N 497.936 0.750 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781229677 HPJHJRAEMMTGQS-BMGDILEWSA-N 453.319 0.547 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1781234657 OWTUKOKYUXSFLY-UUWFMWQGSA-N 454.351 0.896 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2 1782214014 HRWBPDIEPSZQMP-ZDWFVDTJSA-N 460.579 0.402 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214035 JBAUBGWLQHWIIC-LYHRCORUSA-N 461.563 0.736 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCS(=O)(=O)CC1)C2)C(Cl)Cl 1782214645 LWHZKIFYPURTNG-CXAGYDPISA-N 456.392 0.034 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ccccc4o3)C2)C1 1782234892 LKNTYLOVUWUUTE-QFIPXVFZSA-N 450.455 0.584 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3cc(C)on3)CCO2)C1 1783349716 RTXYVMUFECVTRO-FZKQIMNGSA-N 457.325 0.716 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1783535637 BBXLYDFQWOELFV-KPZWWZAWSA-N 450.293 0.316 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1F 1783731915 OCMCLVMBOXHYAM-VHFSOBRXSA-N 471.489 0.740 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1 1784122363 SISNZYORVQQULK-JAQSECSASA-N 488.006 0.241 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc[n+]([O-])c3)[C@H]2C1)NC(=O)NCc1ccccc1 1785493433 TVIBULVVLDSEIV-FKBYEOEOSA-N 496.568 0.260 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(S(C)(=O)=O)cc3)[C@H]2C1 1786702618 VEJVLZXSYKOZKZ-WNHJNPCNSA-N 472.991 0.866 50 20 JCGD Cc1ccc(COCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1C 1786979932 QQQNGYQUBGBCAT-XWGVYQGASA-N 480.370 0.793 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1787507713 LTMSAGLADZTOHV-JMXHXPFRSA-N 472.315 0.791 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789946693 XFEMJPQNDVDCCC-QQOZLPODSA-N 452.316 0.427 50 20 JCGD COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1F 1791288858 YMVUWNUYDOOWTJ-QRTARXTBSA-N 451.499 0.196 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1COc2ccccc2O1 1793841810 YWXIYNVWVOMWTR-FVNYTLQLSA-N 481.509 0.550 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793880815 HNCAWDKTCGDIPN-AICCOOGYSA-N 475.974 0.155 50 20 JCGD Cc1ccn(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1 1794145315 HWWHGJRSDOFELG-DFGXFYAUSA-N 469.970 0.913 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)c12 1795736297 WWUALMKBENCKSR-MFKICJERSA-N 463.299 0.373 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1798210718 VULJBUWIWSTNDO-HBCWATKFSA-N 467.954 0.710 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799346878 HVTHAHSOXIVVOR-ZZVJUGKHSA-N 457.300 0.480 50 20 JCGD CCOC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1799788585 XCDHMXYQKAKWLR-CEQLMSFQSA-N 466.299 0.060 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@H](C)OCCN1C(=O)OC(C)(C)C)C2 1800970812 LACRIYUKDFUVNT-MCEUPANISA-N 489.997 0.854 50 20 JCGD COc1ccc([C@H](O)C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1 1802797105 HSVABNUJVFMVDB-HUVFLSCGSA-N 489.337 0.823 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2ncn(C)n2)[C@@H]1c1cccnc1 1805323210 TWHHDZASCXQGOH-RMEHUUNGSA-N 463.502 0.664 50 20 JCGD O=C(NCC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)c1cccs1 1807094840 RVUHIVOWACZDFL-UHFFFAOYSA-N 469.372 0.703 50 20 JCGD O=C(NCC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)c1cccs1 1807094890 UJKOREJKJHWUKI-UHFFFAOYSA-N 469.372 0.703 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364988 HTCLZHUMNPXCTC-XIRDDKMYSA-N 464.100 0.772 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375474 PIZLMYAAOKVBEA-GHTZIAJQSA-N 470.298 0.438 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)nc2N1 1807935703 AMEJNVFXDQVRTE-AUSIDOKSSA-N 499.336 0.675 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCc2cnc[nH]2)[C@H]1c1cccnc1 1810295107 QFENNLHFZIFOBY-IERDGZPVSA-N 462.514 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)Cc2cscn2)[C@@H]1c1cccnc1 1810301914 DVUPFWHJGYZBBY-RYGJVYDSSA-N 494.581 0.426 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@H]1c1cccnc1 1813069185 VSNRWHUVOJKRAX-UUOWRZLLSA-N 478.557 0.905 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)[nH]n1)c1cccc(B(O)O)c1 1817474748 YTWINHIXADDZPT-ZDUSSCGKSA-N 486.187 0.751 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cn3ncccc3n2)[nH]n1)c1cccc(B(O)O)c1 1817476025 AEZKUPFDQUEIDQ-GOSISDBHSA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1 1819403645 YIFORNSPZOMVDB-ZDUSSCGKSA-N 483.407 0.820 50 20 JCGD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)cn2[nH]cnc(=O)c12 1820121650 RUUXNWXIGSMRDH-INIZCTEOSA-N 483.533 0.733 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc2nn[nH]c2c1 1824411281 CFTCIPRHYMUBPJ-CQSZACIVSA-N 462.300 0.634 50 20 JCGD COC(=O)C12CC(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3cnccc3C(=O)NN)CC4)(C1)C2 1825556612 XGJYFZIEWSBUMD-DAJNEVHCSA-N 484.538 0.711 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1830540437 QANFYUXKPCVNBK-KSSFIOAISA-N 462.341 0.316 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1830543668 XRNNNOXNZFDBJT-ZUZCIYMTSA-N 484.273 0.925 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)N1C(=O)OC(C)(C)C 1830719688 HMMFADVURUKFQH-ACTFIFLWSA-N 489.997 0.831 50 20 JCGD CC#C[C@@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(O)cc1 1830738332 NPBWHBYCTXKLSZ-LEDOBFOHSA-N 464.946 0.945 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@H]1OCCc3ccccc31)CCO2 1831249168 FNTMKVGZIIIREL-BWKNWUBXSA-N 488.585 0.520 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnco3)CCO2)C1 1831932358 QLIPBAMPCUZULL-OAQYLSRUSA-N 474.426 0.892 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc3ncccc3c1)CCO2 1832039310 VGNATHPRRDFFRM-VWLOTQADSA-N 483.569 0.607 50 20 JCGD COc1cccnc1CCC(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1833798066 JGNQISBAVXSONP-UHFFFAOYSA-N 488.633 0.967 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CCc3cn[nH]c3)CC2)CC1 1833812982 ONCDKUUVSSOSCJ-UHFFFAOYSA-N 468.562 0.226 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CC[C@H](N)C(N)=O)CC2)CC1 1834736380 OKACMGCJKGOGBJ-HOTGVXAUSA-N 460.417 0.324 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ncc(Cl)cn3)CC2)CC1)c1ccc(B(O)O)cc1 1834797555 YCPXAURCJZYQFC-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccn(C(F)F)n3)CC2)CC1)c1ccc(B(O)O)cc1 1834798445 WUKHQOUJBOOOFP-UHFFFAOYSA-N 475.305 0.457 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)CC2)CC1 1835046769 IAXMQINRFRMQMK-ROUUACIJSA-N 491.029 0.697 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C3(C#N)CC3)CC2)CC1 1835118195 GXWMYZYYIVLXJZ-JVWAILMASA-N 453.547 0.996 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cc3nnc(C)o3)CC2)CC1 1835118376 VMXRXBJKKXKDCQ-CVKSISIWSA-N 484.561 0.626 50 20 JCGD COCCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](Cl)COC)CC3)CC2)n1 1835186949 SXOKAONUYWHZGF-SFHVURJKSA-N 455.987 0.969 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccn2nccc2c1 1835629392 IFARNAMFUFDKRV-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD Cc1c(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cnn1C 1835737154 PIDSMNCJCSYFFY-UHFFFAOYSA-N 468.562 0.226 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nn1C(F)F 1836162947 ZXZCELBEWWDJFQ-UHFFFAOYSA-N 489.332 0.765 50 20 JCGD CCOCC(=O)N1CCC(N2CCC(NC(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1836343454 BREBXEWTGDTHAF-UHFFFAOYSA-N 488.633 0.941 50 20 JCGD CC(=O)O[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)C(C)C 1837222363 QMQYCKHTWNGSMN-ZQIUZPCESA-N 453.305 0.721 50 20 JCGD Cc1cc2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)[nH]c2cc1C 1837342045 RKKLPOLDGWUSBF-DYESRHJHSA-N 450.923 0.849 50 20 JCGD CCc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1837725173 FMEJFGQUPCNPOO-HXUWFJFHSA-N 453.565 0.149 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(=O)C3)C2)C1 1838528186 KHNNVILJQCMZHR-JOCHJYFZSA-N 475.454 0.569 50 20 JCGD C#CCCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054250 OSSUHYCNPOYUOU-AREMUKBSSA-N 499.612 0.983 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201842 LANQESHSCTVEIS-DCGDGQDLSA-N 488.310 0.904 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)c(F)cc1F)CCO2 1839287511 ILDWBSZGOZPPBO-QFIPXVFZSA-N 478.232 0.168 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc(C)c1C(=O)O 1839480098 LPRFBVQFANLRKJ-VWLOTQADSA-N 496.325 0.065 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840017890 KLVIZHJXKLXVRX-HBLJDGLJSA-N 487.981 0.155 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nn(C)c4c3CCC4)C2)C1 1840032870 MMIXQZPHSYVEOE-YJYMSZOUSA-N 455.353 0.762 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1 1840033351 AZZNCSSVDSVIAJ-GKCIPKSASA-N 482.331 0.961 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1840154577 ZRSIDRDGWKQPIF-UTKZUKDTSA-N 499.904 0.844 50 20 JCGD Cc1scc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1C 1840183502 IBBQSUIGYABTLX-NRFANRHFSA-N 452.577 0.808 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccoc3C(F)(F)F)C2)C1 1840184310 ZFKAAPXJZWPIMR-LJQANCHMSA-N 476.452 0.741 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1C 1840185366 OUQQOFRBTXQCMD-QHCPKHFHSA-N 462.547 0.447 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)[C@H]2C1 1841353662 JJDHNVIDVKVCRF-FXUDXRNXSA-N 457.955 0.671 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccc(F)cc1 1843014421 IQYQAFJEZSZZOC-HXUWFJFHSA-N 453.279 0.200 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)C[C@H]2C1 1843014836 HIQGMMTUFITCDR-BVZFJXPGSA-N 483.374 0.831 50 20 JCGD C=CCC(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C1 1843428635 GVZLGLQZTFNMNS-IBGZPJMESA-N 471.363 0.582 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)[C@H](O)N2CCOCC2)C1 1844297651 ZYRIEEYMHWOFAD-HKUYNNGSSA-N 466.376 0.847 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1846922677 NECJIRYLSUOOCE-UHFFFAOYSA-N 476.747 0.554 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1)C(=O)NC1CC1 14311810 IQLBSZLTXZOSND-LLVKDONJSA-N 473.349 0.276 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 16785785 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MZAFOPPDOIAPLS-HNNXBMFYSA-N 496.929 0.485 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 913151439 JVSUNBYCOIVTMN-UHFFFAOYSA-N 498.558 0.740 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1 914462168 GJUZFJQEKDOYNZ-UHFFFAOYSA-N 450.542 0.653 50 20 JCGD Cn1c(=O)ccn(CC(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3Cl)c2)c1=O 915063775 LGGLWOWLKZYWSW-UHFFFAOYSA-N 491.913 0.462 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)COCC1CC1)N(S(C)(=O)=O)CC2 915639830 XFDHYTJSZAZXJW-MRXNPFEDSA-N 455.533 0.527 50 20 JCGD COC(=O)CCCNC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 915894028 AGLJJTIXCACLBL-OAHLLOKOSA-N 486.547 0.236 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CCCc1nc(C)no1)N(S(C)(=O)=O)CC2 916158954 AADJYLPZOPLOSB-MRXNPFEDSA-N 495.558 0.814 50 20 JCGD O=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)NNc1ccc(-n2cccn2)nn1 916229344 OARYJMHSXNGLAV-UHFFFAOYSA-N 472.531 0.651 50 20 JCGD COc1ccc(C(=O)NNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1OC 918005330 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COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2 1782173036 SMHCIYWSOJBDNB-GXYOHSSGSA-N 477.986 0.640 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CCC(O)CC2)C1 1782330602 QTCJPSNCQSPACL-LDAXRYETSA-N 459.547 0.364 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ccnn4c3)C2)C1 1782402898 TXEPEFFLVOEOIA-LRULAXNGSA-N 463.498 0.912 50 20 JCGD CCN(CC)[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1782813276 CAJLCOJBXZOYOI-BVAGGSTKSA-N 479.386 0.893 50 20 JCGD O=C(CN(CCO)CCO)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1783261369 IKVYAOPHAARYQP-KNQAVFIVSA-N 498.418 0.109 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)CCO2 1783875749 SVCVZMMJBDHVCZ-SXWKCWPCSA-N 465.978 0.971 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C(=O)C1 1783951474 BKYOWSVHAPLKKN-HXUWFJFHSA-N 493.388 0.699 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCOCC4)cn3)C[C@@H]21)[C@H](O)CCl 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DLXRDOLUWKGSCZ-XPGRIIKNSA-N 453.543 0.908 50 20 JCGD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1cnnn1 1803092522 UIIASHIGZMRVEP-OQIJWPOYSA-N 469.550 0.219 50 20 JCGD C[C@](O)(C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(F)(F)F 1803994006 KJHVRUYJNDWSOJ-PSGMQZRDSA-N 480.447 0.713 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)Cc2ccccc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372357 DSXZCWFQYRNXFC-OEMFJLHTSA-N 473.338 0.685 50 20 JCGD Cc1cc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n[nH]1 1810301735 BCWXRYZIDXJVHD-HRAATJIYSA-N 462.514 0.674 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302604 MABFFAOUSUTWMW-UWJYYQICSA-N 492.540 0.556 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCOC2)[C@@H]1c1cccnc1 1810308101 JBIUHQHFJZPLBX-ABSDTBQOSA-N 452.515 0.826 50 20 JCGD CC(=O)NC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1815236395 SZKYJBIEZBXFFZ-MRXNPFEDSA-N 456.507 0.629 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815341313 WKLDVAMMQXODRA-CYBMUJFWSA-N 497.298 0.674 50 20 JCGD COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nc1 1815356764 QRHIWUIVMPPNPQ-CQSZACIVSA-N 452.301 0.766 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)CC2)c1cccc(B(O)O)c1 1815361088 WMOJOMPFDNDHPA-UAGQMJEPSA-N 482.371 0.450 50 20 JCGD Cc1cc(C)n(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1 1815926640 YOMMIRAVSYBPOU-IBGZPJMESA-N 450.308 0.909 50 20 JCGD COCCn1nccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474185 AFEXQCWMVIJFOY-GOSISDBHSA-N 466.307 0.552 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1)c1cccc(B(O)O)c1 1817474302 CSMIAXBIYWKUOD-KRWDZBQOSA-N 475.274 0.458 50 20 JCGD CCCNC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474436 RGXRJFPEPPEISU-SFHVURJKSA-N 455.324 0.702 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)N1C[C@H]2C[C@H]2C1 1817476698 ZIDHPWKJRUDDQX-PYQAKABTSA-N 451.336 0.736 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](C)n2cnnn2)[nH]n1 1818113248 HNIDDXOBUKAYPA-VTYPVHGBSA-N 467.494 0.784 50 20 JCGD O=C(/C=C\C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)NC1CC1 1827052152 QHPRZXLVBRDMJM-KUFMOJEASA-N 453.348 0.435 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827058249 VQXGEDDYAVLQOF-FGZHOGPDSA-N 488.346 0.095 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)CC1 1830157424 WVBYWCHBFYRILQ-QFIPXVFZSA-N 475.358 0.885 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2CCOCC2)CC1 1831871564 ULTGQCGVRZIXTA-HXUWFJFHSA-N 451.612 0.701 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1 1832151484 ATTJHLRAYHGUDZ-INIZCTEOSA-N 451.597 0.890 50 20 JCGD O=C(CCN1C(=O)c2ccccc2C1=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1832535331 XZSVHHLCXVIKTJ-NRFANRHFSA-N 484.336 0.933 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1 1833338597 USXCISGWYPJZLT-CRAIPNDOSA-N 473.299 0.801 50 20 JCGD Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)nn1C 1833369726 HRBXBMROAXBNRS-UHFFFAOYSA-N 461.611 0.216 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833571815 KMBWGXPLXACPBP-UHFFFAOYSA-N 467.379 0.216 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1 1834423852 MREWOWTZRVYQTJ-GOSISDBHSA-N 490.395 0.838 50 20 JCGD CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1834972049 LJWTZNGRDYWCDD-UHFFFAOYSA-N 464.958 0.263 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1 1835645621 OXCFJNFTERNPMF-LRDDRELGSA-N 463.373 0.406 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3[nH]nc4ccncc34)CC2)CC1 1835736820 IYBSITLVLKUHFU-UHFFFAOYSA-N 491.556 0.455 50 20 JCGD Nc1nc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)ccc2s1 1835783361 FYNWLTZJXOAROQ-IFXJQAMLSA-N 454.936 0.548 50 20 JCGD CC(C)[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1 1835939941 PNNHGVYNMRXZLV-UMEGOILYSA-N 472.391 0.899 50 20 JCGD O=C(CCc1c[nH]c2ccccc12)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836105714 RPFGIVWHBFOAOU-AREMUKBSSA-N 491.353 0.551 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3nc[nH]c3[N+](=O)[O-])CC2)CC1 1838093648 RYODOAKCLJTIPX-UHFFFAOYSA-N 486.489 0.242 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1 1838474280 CGMNCMNOWAUAAD-DJJJIMSYSA-N 470.320 0.911 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1839148677 GFLROBRBMXNGPY-DBHNTLKXSA-N 489.997 0.831 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839152174 PUAISTNFLRXKDW-MJEARJAWSA-N 488.372 0.813 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1 1839924890 NBMLCKVGAGNGFX-LPMFNBOVSA-N 495.536 0.996 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1 1840033412 CMGVLVPKLALBHO-KZULUSFZSA-N 452.309 0.811 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1 1840185087 IKGGXWFGAUKVCA-NRFANRHFSA-N 454.474 0.408 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840437017 MBXZRADQRWXQMH-FUHWJXTLSA-N 461.332 0.726 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2 1840951154 HHMRGIDJWWQTES-SFTDATJTSA-N 458.506 0.561 50 20 JCGD O=C(c1ncn2c1CNS(=O)(=O)c1ccccc1-2)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841351930 MPORQKURFRDAKR-OAHLLOKOSA-N 479.946 0.081 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843010298 AMQHCFYVXDHFGV-PKOBYXMFSA-N 471.363 0.877 50 20 JCGD O=C(Cc1cc(Br)ccc1O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012045 YIMDHUJSEZAADY-UHFFFAOYSA-N 473.132 0.894 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1844158603 DFJDKZHDTLZPJJ-MRXNPFEDSA-N 464.431 0.402 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c3c2OCO3)C1 1844758280 RHZQDUFQUAFOMO-UHFFFAOYSA-N 468.426 0.453 50 20 JCGD C[C@@H](C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1)N1CCN(C)CC1 1845039238 VKAAZZQSPQEVKX-FQEVSTJZSA-N 485.633 0.172 50 20 JCGD C[C@H](C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1)N1CCN(C)CC1 1845039239 VKAAZZQSPQEVKX-HXUWFJFHSA-N 485.633 0.172 50 20 JCGD CCOC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847564788 ZENCEWKJPWFYPB-UHDSXZAQSA-N 487.981 0.834 50 20 JCGD CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 726090142 WXTHFYFGUXMFFA-UHFFFAOYSA-N 455.518 0.236 50 20 JCGD COc1ccc(S(=O)(=O)N2CCC(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)CC2)cc1 728179638 NKMKYJJFBKBMLT-MRXNPFEDSA-N 459.590 0.588 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)Cn2ccc3ccccc32)CC1 729511244 YIKPYNSEAJGULE-UHFFFAOYSA-N 460.516 0.993 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CCC(=O)N2CC(=O)Nc3ccccc32)n1 762199822 VSXXRIJEKAOAPE-UHFFFAOYSA-N 459.484 0.450 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)C[C@@H](C)O1 912919302 LNNCMWLYKGELAF-HCROLABASA-N 451.568 0.770 50 20 JCGD CCn1nc(C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)c2ccccc2c1=O 913081132 BMTSWIRYCRMVIF-KRWDZBQOSA-N 465.445 0.437 50 20 JCGD O=C(CCCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)NNC(=O)[C@@H]1COc2ccccc2O1 915806207 JCTBWTIGCDKDQR-KDURUIRLSA-N 484.465 0.132 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)c1 916237647 NGBFLJFUZKJFCC-UHFFFAOYSA-N 483.572 0.331 50 20 JCGD C[C@H]1CCCN([C@H](C)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1 916450426 NURBOJVUYIDMKS-DLBZAZTESA-N 453.613 0.764 50 20 JCGD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 917278486 HTIZSFPWLKKQGQ-RHSMWYFYSA-N 469.516 0.111 50 20 JCGD Cn1c(CCC(=O)NNC(=O)CC(F)(F)F)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 918364770 UKJWKWUKMBMINH-UHFFFAOYSA-N 477.465 0.627 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)c(-n3cnnn3)cc2OC)cc1OC 919380606 ATLIQWQTCIOKMC-UHFFFAOYSA-N 490.860 0.960 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NN=Cc1c(C)nn(CCO)c1C)N(S(C)(=O)=O)CC2 1317975642 PCQCRCWVNKCGKK-LJQANCHMSA-N 493.586 0.909 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ncccc23)C1 1777948181 VWOAPPFCMYQHCS-AUSIDOKSSA-N 478.513 0.169 50 20 JCGD CC(=O)Nc1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1778841780 SEQHZESCUFGTJU-ZEQKJWHPSA-N 493.369 0.695 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccnn3)C2)C1)NC(=O)NCc1ccccc1 1779463067 XWAIWALNFFCWLY-QHCPKHFHSA-N 467.530 0.266 50 20 JCGD COc1nc(C)ccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782212111 IHXMBIRKQYDLFM-WZONZLPQSA-N 461.563 0.899 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN3CCN(C(=O)OC(C)(C)C)CC3)CCO2)C1 1783884103 PRADSGRKOCQTEN-JTSKRJEESA-N 489.013 0.623 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCCNC(=O)OC(C)(C)C)CCO2)C1 1783940189 WDVPJVIFVYPHQF-JOCHJYFZSA-N 469.583 0.494 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1784186344 OXFWTZJNGBYYGE-ARGWCVDVSA-N 459.927 0.342 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4c(s3)CCC4)C[C@@H]21)c1ccc(B(O)O)cc1 1786979426 HUTVNUZSGDCTHB-WDSOQIARSA-N 454.357 0.824 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc2sccc2[nH]1 1788430116 JFCGRWYLIHRCOD-QOKNQOGYSA-N 453.329 0.816 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cn1 1788611714 UFZSGSRVILWYPL-YYWHXJBOSA-N 466.542 0.615 50 20 JCGD O=C(Cc1cc(F)ccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1792134427 OVSWFDCRWWIWCS-ZRCAFCQKSA-N 458.270 0.481 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1792341204 ANZRINZDLNJTEW-QUSNUVHPSA-N 475.970 0.202 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cn1 1793572296 DKTROWBUWZKMRP-WVNFENISSA-N 454.487 0.427 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1Cl 1793738300 AGPXLKNJCNYWTE-VTEUUUEMSA-N 475.908 0.924 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C(=O)C(=O)O 1794144045 GAPZGQOZMQWJRO-CRWXNKLISA-N 474.942 0.300 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nnc1C 1795978951 OUIUORPXXTVWIB-IVWMJMPLSA-N 458.431 0.464 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c2cc(O)ccc2n1 1797356150 FGBNLLRPAZRORV-RSQQPWMTSA-N 469.542 0.825 50 20 JCGD COc1nn(C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798522691 MVRDRYOCNLTFES-HBCWATKFSA-N 487.469 0.779 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1c(Cl)ccc(Cl)c1O 1799734759 BTYKBFFIXZSDBJ-IVWMJMPLSA-N 479.125 0.896 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCN(C)CC3)cc1)C2 1800973953 NRBWHYWVHKUIAL-KOUHRCEDSA-N 464.994 0.895 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2 1800977141 KBHGLCNSGLPRTK-LBKYZSNHSA-N 463.959 0.106 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1803008800 OUXOAOIUUKPNLM-IVMMDQJWSA-N 477.296 0.843 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2csnn2)[C@@H]1c1cccnc1 1803749604 DQKQWFCCCSCXJC-DYVFJYSZSA-N 452.500 0.565 50 20 JCGD C[C@](O)(C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(F)(F)F 1803994004 KJHVRUYJNDWSOJ-OWZDWXTDSA-N 480.447 0.713 50 20 JCGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1804343368 DBSQDEJKWPIPHZ-HEHGZKQESA-N 452.309 0.471 50 20 JCGD CC1CCN(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1807361333 WTZBKVSXIKNVRQ-URXFXBBRSA-N 464.375 0.813 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(Cl)nn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362573 VYZOKBYSCVZPAH-JXFKEZNVSA-N 465.706 0.838 50 20 JCGD O=C1CCc2ccc(C(=O)N3CC[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)nc2N1 1807370681 IKFRXICMUIMWOZ-WMZHIEFXSA-N 499.336 0.675 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1 1810381143 NUGKMONPJYPTIR-HTAPYJJXSA-N 485.545 0.187 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2=NN(C)C(=O)CC2)[C@H]1c1cccnc1 1813071562 URTYGJKPWIFVEQ-KKSFZXQISA-N 457.535 0.069 50 20 JCGD N[C@@H](CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1cccnc1 1815172439 LFNJCMBLRQMAJB-IRXDYDNUSA-N 465.344 0.534 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)C1 1815349966 AYOJLICQVTWKCF-SQWLQELKSA-N 471.344 0.638 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)n1ccnn1 1819404008 RYJNUDAQQGPONH-BLLLJJGKSA-N 452.479 0.567 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819452348 LBXVEVMVZZRQAT-CJLXMBDASA-N 469.307 0.924 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnncc1C(=O)O)CC2 1819797717 HKHZLBCSZJGYHZ-SECBINFHSA-N 482.482 0.169 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3cn[nH]c3cn1)CC2 1819797724 HVETUIXCDOQDBW-LLVKDONJSA-N 477.510 0.953 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccnc4c3OCO4)sc2C1 1821234486 UHQVIWLIZFUEBQ-SNVBAGLBSA-N 481.494 0.805 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](O)CCl)CC2)CC1 1824185843 HTQWZMAGDRHYNX-QZTJIDSGSA-N 464.028 0.877 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1824515298 JLFUPWDULOKQRY-LJQANCHMSA-N 462.377 0.506 50 20 JCGD Cn1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1=O 1827056150 UNTJOZSAVVCWCI-NRFANRHFSA-N 451.332 0.612 50 20 JCGD O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)CC1 1827269349 PKZNNNVSBXVSIG-CVEARBPZSA-N 458.968 0.671 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CNC(=N)N)CCN2C(=O)OCc2ccccc2)C1 1828972226 ANVSDGJTBPERLT-VGSWGCGISA-N 478.981 0.939 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(C)C(=O)CC3)C2)C1 1830535860 VIJOVPHHOUGBEX-UGSOOPFHSA-N 459.341 0.082 50 20 JCGD O=C(COc1ccc(Cl)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726933 XEVAVOQRUGRLJO-QFBILLFUSA-N 465.305 0.914 50 20 JCGD COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CC3)CC2)cn1 1834314793 JMHJIZSIQZBRLM-MUFRIFMGSA-N 496.572 0.804 50 20 JCGD Cc1noc(C)c1CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797277 BKRSCNBRYYQVBR-UHFFFAOYSA-N 468.363 0.399 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cn3cc(Cl)cn3)CC2)CC1)c1ccc(B(O)O)cc1 1834797927 MVTHSKVTKCJEKX-UHFFFAOYSA-N 473.770 0.102 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCCn3cccc3)CC2)CC1)c1cccc(B(O)O)c1 1834801504 QASIGTXHCKIRTQ-UHFFFAOYSA-N 466.391 0.834 50 20 JCGD Cc1nnc(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)s1 1834855024 LXIFXQCIZULYBU-UHFFFAOYSA-N 486.602 0.273 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4c(s3)CCC4)C2)C1 1835929121 ARKJKGYRMQFHQL-HSZRJFAPSA-N 470.356 0.300 50 20 JCGD CC[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1 1835932070 MGMIEFLZMMHSIG-KHCICDEESA-N 458.364 0.653 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc(OC)c1C 1835941778 PFDVKMSTRYVLTD-VWLOTQADSA-N 498.341 0.076 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836718047 PBSQACZUYJXAAF-MAUKXSAKSA-N 492.013 0.860 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836776829 PXAPDWLQXYPKGC-YCRPNKLZSA-N 467.954 0.494 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)Cn3ccccc3=O)CC2)CC1 1837933804 RTJWJSFJCMTDDD-OVVQPSECSA-N 496.568 0.981 50 20 JCGD COc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c1OC 1838840332 IGGRQMXKIMVLBO-IBGZPJMESA-N 472.336 0.954 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)n1 1839153822 SUPMWIXQTWMYOU-LEWJYISDSA-N 489.400 0.980 50 20 JCGD C[C@@H](NC=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839166032 CZMJQUZIZHUXTA-RWSPSULHSA-N 462.453 0.463 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839429284 CYDXROQRWAWUTP-JOCHJYFZSA-N 495.508 0.485 50 20 JCGD O=C(C1CCN(c2ccc(F)cn2)CC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839723528 BWIQOWAIHCDESW-PGRDOPGGSA-N 484.956 0.493 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840017891 KLVIZHJXKLXVRX-MRNZGAJFSA-N 487.981 0.155 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=C4c5ccccc5C(=O)N4CC3)C2)C1 1840154023 ICYZHBGQHYXNJI-NTKDMRAZSA-N 489.956 0.967 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3c1CCCC3)CCO2 1840720626 BSTBABAQUMDEJA-AREMUKBSSA-N 478.354 0.629 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1 1840855202 ABUHDQJSTWVOJQ-JTDSTZFVSA-N 462.385 0.921 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(Cl)c3nncn3c1)C2 1844264301 DOLAKBJTYXXREE-UHFFFAOYSA-N 454.878 0.512 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)C2)C1 1846136942 NXAPYQSGSLXVDS-UHFFFAOYSA-N 483.374 0.831 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846155379 NYERPPUJOTZGMY-PIIMJCKOSA-N 484.557 0.615 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)NCc2ccccc2)c1 10214579 LRJPURNIBMEKHU-MRXNPFEDSA-N 451.526 0.361 50 20 JCGD COC(=O)c1c(C)[nH]c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1C 28580951 CJGVZBNJRGWTGB-UHFFFAOYSA-N 492.554 0.833 50 20 JCGD CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 108056634 BHHHDEGWXAUGLG-UHFFFAOYSA-N 483.572 0.970 50 20 JCGD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)CNC(=O)c3cccs3)cc2)C1 725872224 BTFZZVOPYOUIJJ-OAHLLOKOSA-N 458.544 0.710 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)NNC(=O)[C@@H]1COc2ccccc2O1 728341597 XAIHMQGODDPGRU-BBRMVZONSA-N 495.535 0.432 50 20 JCGD CN1CCCN(S(=O)(=O)c2cccc(NC(=O)NNC(=O)COc3ccccc3O)c2)CC1 730900473 QWAOXIBNRJCFAW-UHFFFAOYSA-N 477.543 0.950 50 20 JCGD CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NN[C@]3(C)CCS(=O)(=O)C3)CC2)cc1 746971556 FHQRNSBVDIQTHQ-LJQANCHMSA-N 458.606 0.830 50 20 JCGD COC(=O)c1cc(Br)ccc1S(=O)(=O)NNC(=O)CNC(=O)c1ccco1 751283557 XOQMINKNNAIHGT-UHFFFAOYSA-N 460.262 0.568 50 20 JCGD Cc1sc2ncn(CC(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)c(=O)c2c1C 807639606 DVJRMAVZZXVBDQ-UHFFFAOYSA-N 459.440 0.987 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 912953125 PQIVLIBDYUZUFY-KFWWJZLASA-N 453.517 0.036 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 913154142 LTMOTDPCSMJYLH-KRWDZBQOSA-N 469.527 0.984 50 20 JCGD CCOc1ccc(/C=C(/C#N)C(=O)OCC(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)cc1 913263920 QRYAEQKSHGHSIA-CWDSQJGSSA-N 461.540 0.867 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(Cl)nc3)c2)CC1 917249211 ZVEQUXUKJBRYCN-UHFFFAOYSA-N 465.919 0.663 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CC(F)(F)F 918365548 CVXBGAKXIIMTOC-NSHDSACASA-N 479.886 0.521 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CN2CCCC2=O)cc1 920826112 OSCBQFBUCGVEFY-QGZVFWFLSA-N 450.517 0.202 50 20 JCGD CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnc[nH]2)C1)NC(=O)NCc1ccccc1 1777992915 YZVFCDZBXUYDHC-PXDATVDWSA-N 497.600 0.812 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCS1(=O)=O)C2 1778092902 VRHCYGTXNYKPSL-NTXWZOLCSA-N 493.586 0.212 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779033780 DTTHPYGLYAWRRC-QHCPKHFHSA-N 471.489 0.519 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1 1779631786 JCFRGTUOGYYFGN-JOCHJYFZSA-N 455.519 0.288 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nn1C 1780968705 PGHPTPOCHBZACH-DEOSSOPVSA-N 499.572 0.218 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2 1782212103 HTBGELDTBDBKKF-YBJWPOLQSA-N 477.606 0.274 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CS(=O)(=O)N1CCCC1)C2)C(Cl)Cl 1782217651 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LVMKVOPYWMQJNC-KYTRPZQZSA-N 474.562 0.405 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc2cccnc2n1 1788282793 XLSYSWPQMPMABF-CUWPLCDZSA-N 460.299 0.217 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncnc3C)[C@H]2C1 1788969702 DJPJNELZLGNEAC-YKNBRYRPSA-N 453.503 0.512 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1790684593 UNUIXMAVXOODRA-HHVGHTAVSA-N 464.872 0.723 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1792871321 UZJCTEJCNVZLQM-HNKHHVNMSA-N 480.425 0.279 50 20 JCGD Cc1cc(C)c(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(C)c1 1793239882 JTDPDQVZWUQQLY-JHDGKUDLSA-N 466.343 0.574 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(S(C)(=O)=O)cn1 1794429305 WWLNUTPDUGMTFG-FAXLKDOZSA-N 474.377 0.862 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)C2)c1ccc(B(O)O)cc1 1795734601 UKGRGKWSEKKKLW-USGNIVHTSA-N 469.253 0.643 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(F)c(OC)c1F 1795736232 PBDFAMQABMLSQG-VTEUUUEMSA-N 490.268 0.179 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3s1)C2)c1cccc(B(O)O)c1 1795739033 MNMGKSMXSAZIHI-HGKCTWBKSA-N 451.313 0.493 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1cccc1C=O)C2 1796440524 ONDKOPIRHHSKAV-OFVMJGGRSA-N 468.514 0.585 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1nc2c(=O)[nH]c3ccccc3n2n1 1797105020 RHQPOMMHZIPWNW-DDFAGTSDSA-N 465.297 0.578 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1797300564 QXHOVKKXSHWDQI-NYXISSTPSA-N 459.971 0.679 50 20 JCGD Cc1ccc(COCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1C 1797750585 KEXRDKZPQPZNFU-BBIADKPPSA-N 481.553 0.722 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754040 QBYJQMVOXQEHGT-VTEUUUEMSA-N 497.512 0.176 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(-c2ccccc2Cl)[nH]n1 1798682940 PSHCJMPYKJOMPM-MFKICJERSA-N 494.744 0.927 50 20 JCGD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)c(O)n1 1799097265 LPJMOINVVRXSAZ-HATOLVCRSA-N 496.568 0.645 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/N1CCCCC1)C2)NC(=O)NCc1ccccc1 1799097267 LXEGLMOUHWMTFO-FFXORAGPSA-N 499.616 0.394 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)C2 1800754963 YZMZGIBQUPAFAJ-QMHWVQJVSA-N 490.395 0.995 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(Cc3cccs3)C1)C2 1800973801 HFMSKSNOVLJXQB-LSIDRNEPSA-N 469.991 0.940 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2)CC1 1805662580 WJCDSSBJWCNSFO-SFHVURJKSA-N 497.637 0.866 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807368616 VYUMLFVGLDFGFE-QANKJYHBSA-N 460.137 0.864 50 20 JCGD Cn1cc(CCC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1807431227 YWYHPMXONDJHTB-GCJKJVERSA-N 476.541 0.766 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)Cn2cncn2)[C@H]1c1cccnc1 1808413527 BSDSSPZQBQAMOX-FIAMHUAMSA-N 463.502 0.513 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@H](F)Br 1808662139 WLGREJOQECTKLK-XIRDDKMYSA-N 464.100 0.772 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cn2ncccc2n1 1809355490 HUZVJOMHCCULRT-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(C)C 1810106973 RIEABMOVOSSZIY-WMQCIHAUSA-N 482.541 0.987 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810305191 JAUHVDRDKYRHRF-HTAPYJJXSA-N 476.541 0.982 50 20 JCGD COc1nn(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815355208 RTBFLGQLHBQYFS-CYBMUJFWSA-N 455.305 0.105 50 20 JCGD O=C(CCc1ccc(O)nn1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815359724 BDAIOBJWWFONBV-HNNXBMFYSA-N 467.316 0.177 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3ncnn3c1)CC2 1819797906 OGPGHGVSDWMJBR-LBPRGKRZSA-N 477.510 0.724 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cncnc2)CC1 1825286599 FJJHIZJQVYICEH-HXUWFJFHSA-N 451.531 0.951 50 20 JCGD N[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1 1827054444 AVSVPWJXXDPOHA-VXKWHMMOSA-N 450.348 0.695 50 20 JCGD O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)CC1 1827674375 VYIYWLBHXSXBDU-IRXDYDNUSA-N 450.001 0.631 50 20 JCGD Cc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)c(=O)[nH]c1C 1828923400 ITTLKRQHTKXUPD-LJQANCHMSA-N 481.557 0.932 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnn3c2OCCC3)CC1 1830879094 IKFFXQDHHZFNMS-NRFANRHFSA-N 466.347 0.893 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1)C(C)(C)C 1831094500 RJVKCUZYNRCEFF-ZXYWRSMDSA-N 462.385 0.777 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CS(=O)(=O)N2CCCC2)CC1 1831871025 KYEIMCMCIYFWJN-IBGZPJMESA-N 485.651 0.405 50 20 JCGD Cc1nn2cc(CC(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](C)Br)C4)C3)nc2s1 1832109731 BWZZRRIQAJKDPL-XIKOKIGWSA-N 486.392 0.882 50 20 JCGD O=C(CCN1C(=O)c2ccccc2C1=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1832535332 XZSVHHLCXVIKTJ-OAQYLSRUSA-N 484.336 0.933 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1 1833399894 IWIJWAYYAHFRBP-WMLDXEAASA-N 494.339 0.246 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nccc4nc[nH]c34)CC2)CC1)c1cccc(B(O)O)c1 1834799891 BIPWAHPHOUBBHF-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C2)C1 1835927084 DFSNPEGOVPRYNI-XVAXZDLZSA-N 482.264 0.169 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1835930537 LPPNPQZYQTZDCG-XMMPIXPASA-N 481.289 0.371 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4cccc(Cl)c43)C2)C1 1835932268 XEIMKGARNBEQEQ-CJFMBICVSA-N 498.772 0.820 50 20 JCGD Cc1nc2cccc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2s1 1835936890 IEEFHSLMSFNJKC-DEOSSOPVSA-N 495.366 0.668 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)C3(c4cccc(Cl)c4)CC3)C2)C1 1835937121 PKVDDEZIXRDKPZ-XMMPIXPASA-N 498.772 0.822 50 20 JCGD Cc1nc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3cccc(B(O)O)c3)CCO4)ccc2s1 1835937448 XHBDSQXBDDJWRT-XMMPIXPASA-N 495.366 0.668 50 20 JCGD Cc1cccc(C)c1SCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938497 WPQLCDTWGKYFOK-RUZDIDTESA-N 498.410 0.846 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1C 1837456531 NUSRLRSNZOCOTH-RUZDIDTESA-N 497.552 0.315 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1 1837658861 DCXXNKZTMISBOL-BEFAXECRSA-N 489.342 0.434 50 20 JCGD O=C(CN1CCCCC1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837797652 AOMHFKUTVIUBLW-UHFFFAOYSA-N 457.380 0.465 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(Br)c1)CCO2 1837812342 YLZXRMQLWGLBPO-FQEVSTJZSA-N 498.378 0.287 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccn(C(F)F)n3)CC2)CC1 1837921288 UZSKHKAUUPDDOK-UHFFFAOYSA-N 476.289 0.884 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCC3)C2)C1 1838527365 PRLONBFZLWXVQG-QHCPKHFHSA-N 490.513 0.686 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1 1838529297 VQOZYANPYFWGQU-AUUYWEPGSA-N 456.337 0.486 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)n1 1839200125 FZHNYALKTQYFDY-BEFAXECRSA-N 489.342 0.434 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2 1839737649 VDIKQTCNLHULKX-UCMVZMLTSA-N 480.871 0.199 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c[nH]nc34)C2)C1 1840184064 PRSZSXPBZRZIAQ-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD CCCOc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840185367 OXOGIHNSMBILLG-DEOSSOPVSA-N 476.574 0.918 50 20 JCGD O=C(NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)c1cccs1 1840186729 UANJUSCCONPJDR-KRWDZBQOSA-N 450.344 0.738 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1840314146 TXMDZPIARIEWOU-KNQAVFIVSA-N 453.967 0.741 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@H](NC(=O)OC(C)(C)C)C2)C1 1847041536 WXJDKPNUFLMJTR-WKILWMFISA-N 451.568 0.866 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(=O)n(C)c(S)nc2c1 12702824 LENNDRRZNPQQMG-UHFFFAOYSA-N 460.541 0.899 50 20 JCGD CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 15315192 UBWWDOWMQGNDRD-UHFFFAOYSA-N 459.572 0.910 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1 16177503 GPWYZDNWOLJMIF-UHFFFAOYSA-N 458.460 0.852 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)NCCS(C)(=O)=O)cc2)cc1 727942941 MOAKQLGKNHMPQP-UHFFFAOYSA-N 484.556 0.875 50 20 JCGD O=C(NC[C@H]1CN2CCC[C@@H]2CO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 729617540 CYXVOONSBRDOGN-UXHICEINSA-N 487.582 0.972 50 20 JCGD CCN(CC)Cc1ccc(C(=O)NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)o1 747715975 XUDQXAKJARSFPR-UHFFFAOYSA-N 465.488 0.138 50 20 JCGD O=C(CCNC(=O)c1cc(F)ccc1Br)NNC(=O)CNC(=O)c1ccco1 751202137 ARUCXPAGFKMZJZ-UHFFFAOYSA-N 455.240 0.879 50 20 JCGD CS(=O)(=O)N1CCc2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc21 804541071 MRAZQJBUZKHYCQ-GOSISDBHSA-N 475.479 0.153 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1 810552256 OEEZPCRWQIIMDL-UHFFFAOYSA-N 450.542 0.781 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)C[C@H](C)O1 912920241 ZTHAAQHMVJJBMC-KBPBESRZSA-N 491.408 0.764 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)cc1OC 913253758 GRZWLWMYUSZCJU-INIZCTEOSA-N 469.454 0.128 50 20 JCGD COCCCCNC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 916502098 LSLMEECELINHPL-INIZCTEOSA-N 472.564 0.710 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NCCCN(CC)S(C)(=O)=O)c2ccccc2c1=O 918119344 SUMVAFKNIBGQMV-UHFFFAOYSA-N 466.564 0.812 50 20 JCGD CCS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1 919687416 ZHHCQSXRZVPCEA-UHFFFAOYSA-N 455.514 0.692 50 20 JCGD O=C(CCCNC(=O)c1ccc(F)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 919807428 IYEIGMYMMCGLHB-UHFFFAOYSA-N 492.529 0.818 50 20 JCGD Cn1cc(Br)cc1C(=O)NNC(=O)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 920340590 SBBMUSLLIVATBS-UHFFFAOYSA-N 474.293 0.825 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1 1779029177 UHMZFXHEUPZUIT-QHCPKHFHSA-N 484.582 0.248 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c21 1779032443 JZYIHPZQVHAWTJ-QHCPKHFHSA-N 479.497 0.035 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1 1779232289 MPSUEHRTDZVXEC-FQEVSTJZSA-N 453.927 0.317 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1nnc(-c2ccccc2)o1 1779427292 WKXTXFBEYZWMNU-CJFMBICVSA-N 490.325 0.858 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1 1780387085 QCRWMNUPWYDANF-MRAZWZEMSA-N 490.524 0.845 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)N1C[C@@H]2C[C@H]2C1 1780967942 FHPQZEPTGBESNE-OJZVVMIASA-N 498.628 0.503 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1nccn1C)CCO2)NC(=O)NCc1ccccc1 1780969600 IJNBCSWZWYPIET-HSZRJFAPSA-N 469.546 0.210 50 20 JCGD O=C(CCCn1cccc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782579297 GCZGMOFQWJNMFA-ZJSXRUAMSA-N 453.348 0.776 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1784792350 QRUHOAIWIZLJDH-SIRPWMCASA-N 475.970 0.202 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1Cl 1785117429 NTQLBKVKSWXRSV-QFIPXVFZSA-N 458.707 0.786 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1[N+](=O)[O-] 1785181478 XGSKEQYXVZLSBQ-JOCHJYFZSA-N 484.469 0.359 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@H](F)CN3C(=O)OC(C)(C)C)C2)C1 1785688744 IBDSNEIYGNFGMS-QQMNAOGKSA-N 499.584 0.537 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1n[nH]c(C2CC2)c1F 1785764826 HVSUOKLJOMXCDY-XIRDDKMYSA-N 456.283 0.013 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccncc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786982004 WXFNKVOWZCOWCK-TZYHBYERSA-N 459.311 0.822 50 20 JCGD CCc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1Cl 1786984682 YBDRESHSRVIOQI-ZVZYQTTQSA-N 474.754 0.223 50 20 JCGD O=C(Cc1cc(F)cc(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1787076738 XZGJLNBHZODYRK-NDXORKPFSA-N 458.270 0.481 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCSCC3)C[C@@H]21 1787507034 FTPJFCAFJJPNAW-MPKALDKKSA-N 476.603 0.149 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccsc4n3)[C@H]2C1 1788391828 BVJYIPAOYGHUTL-NUTKFTJISA-N 469.527 0.301 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)c1ccc(O)cc1 1788610398 YXPQKDUHKRLSHX-CLUDHOEWSA-N 467.526 0.788 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cn1 1788611690 REBLTOBUJYLMAJ-VDGAXYAQSA-N 452.515 0.225 50 20 JCGD C[C@@H](S)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1791263633 IAFZKTZWMFNVTJ-BVBHFADKSA-N 463.604 0.631 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1 1791293931 PMRVLLWNFCGGTC-CUWPLCDZSA-N 483.573 0.542 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1792887004 MRBDXKATQQBXFA-MLGHIDQZSA-N 468.320 0.152 50 20 JCGD C=CCCc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(O)n1 1794490097 VVWBPAWTBCKDMI-UPHUGPLXSA-N 465.315 0.103 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1-c1ccccc1)C2)c1cccc(B(O)O)c1 1795738808 GUECTITUVPRLLX-OPMZPASUSA-N 460.299 0.069 50 20 JCGD CC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C(C)(C)C 1796439458 GGYLOHVWXFBONV-ACJYEVJMSA-N 474.562 0.261 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ncccc13)C2 1796440316 KTKHPZGJLOCDPD-RVQRMFQJSA-N 464.486 0.067 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(C)C)n1)C2 1796441717 VDQVIMAISJEJMC-ZPHZMXASSA-N 455.519 0.801 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)cc([N+](=O)[O-])c1)C2 1796443916 QDKULYRKEMTBSE-UYNJTKMTSA-N 484.469 0.638 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCCCC1)C2)NC(=O)NCc1ccccc1 1799095030 QYGSIBVETZSQCF-RUMRUAAYSA-N 486.617 0.408 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C3)CC2 1800416078 NMWWKPQJCLZGIA-FLFXDLLNSA-N 472.586 0.763 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800725223 OVFLBSCJFCRKBH-LBXREMGKSA-N 471.982 0.964 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCOCCNC(=O)OC(C)(C)C)C2 1802334930 UCERVOJGERKRPW-BCDXTJNWSA-N 483.610 0.929 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc3c(=O)[nH]c4ccccc4n3n2)[C@H]1c1cccnc1)[C@H](O)CCl 1803142730 HHHUZKYCOUVQHL-QGTPRVQTSA-N 495.927 0.885 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ncc(Cl)cn1 1805233031 VVUZIDANUVPLIN-LPHOPBHVSA-N 465.706 0.838 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CN2CCOCC2)[C@H]1c1cccnc1 1806907104 PVRFDNUPFMLVIE-ZFUWBFJQSA-N 481.557 0.554 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807155310 LQDSIRFFYKNTBW-WGGBDISSSA-N 473.342 0.977 50 20 JCGD CC(=O)c1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n[nH]1 1807360772 CYYZMAJDBJVVSR-DYESRHJHSA-N 461.287 0.321 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)n1cccc1C=O 1807366509 ZPOBEUDEVWOMEX-DHJUGAMNSA-N 474.326 0.956 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807369814 WSIYAASIKVELPS-FXAWDEMLSA-N 463.303 0.137 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375683 PGLNCHOQYZJMHT-GCJKJVERSA-N 460.299 0.094 50 20 JCGD COc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1OC 1807375828 QJVISJIINUXCOC-PGRDOPGGSA-N 490.325 0.807 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CNC(=O)c2ccco2)[C@@H]1c1cccnc1 1807591213 OBEBYEDFSBKCII-IERDGZPVSA-N 491.508 0.423 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1 1808295180 SOKGNZASGAFELP-KBXCAEBGSA-N 455.462 0.570 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(C)C 1810100335 ITINAGHLMQQLNF-FCEUIQTBSA-N 467.331 0.669 50 20 JCGD C#CCO[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810295667 VCDZCNUYKMRASA-MDYRTPRTSA-N 450.499 0.438 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813068476 NBEAEDOFBPZMRI-MDYRTPRTSA-N 467.592 0.141 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nn1 1813072346 GCJNHQPOVXHOQZ-HTAPYJJXSA-N 469.546 0.963 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)CC2)c1ccc(B(O)O)cc1 1815336053 ZADXGLOUBAAYSC-GFCCVEGCSA-N 456.245 0.864 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)C1 1815349963 AYOJLICQVTWKCF-FMKPAKJESA-N 471.344 0.638 50 20 JCGD CC(=O)N[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(C)(C)C 1815350161 HBHHQLOUZRBDFM-CRAIPNDOSA-N 472.376 0.600 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)n(C)c1=O 1817118149 UEAHZEGUWJORND-OQPBUACISA-N 483.913 0.037 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3c(n2)OCCO3)[nH]n1)c1ccc(B(O)O)cc1 1817471910 VZBDTVZIOKGWFK-GOSISDBHSA-N 477.286 0.875 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COc1cccnc1)CC2 1819792814 BMQNLYKUEWUJAY-GFCCVEGCSA-N 467.511 0.841 50 20 JCGD COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)nn1C 1821765625 DWBQGCJRHLFOOY-CYBMUJFWSA-N 455.305 0.105 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)COCCO)CC2)NC(=O)NCc1ccccc1 1822518530 PXDBNBGJKFUEMD-MRXNPFEDSA-N 490.586 0.410 50 20 JCGD CN1CC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCN3C(=O)OCc2ccccc2)C1 1828551888 XDPMIQPUKTXXPE-CVDCTZTESA-N 478.977 0.600 50 20 JCGD O=C(Cn1ccnc1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828737397 FQGSUPSMADFVNN-XXBNENTESA-N 489.960 0.935 50 20 JCGD O=C(c1ncon1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829164855 GKVWIYZYFCAOKA-IERDGZPVSA-N 477.905 0.735 50 20 JCGD Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1F 1830103620 GNRYJUVSOYTTNH-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1 1830535574 QMEJLFVYUJEOLI-MGPUTAFESA-N 480.363 0.919 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1830883220 CJLVXQZFHNNMNJ-BIENJYKASA-N 467.922 0.253 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1 1831280802 BIBMUVQEVZCQFN-WOJBJXKFSA-N 462.377 0.177 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1831644183 QKTQJPKKDMCZFH-OXQOHEQNSA-N 473.979 0.963 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1 1833263082 JIJUHNSXPRHVEZ-GUYCJALGSA-N 477.400 0.654 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)c3ccccn3)CC2)CC1 1834723439 HCTDVHQISJKDJD-ZUXQIOPWSA-N 494.600 0.787 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835107287 SMNIGVDDGFIWDZ-MRXNPFEDSA-N 485.419 0.509 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](N)Cc3cccnc3)CCO2)C1 1836506186 SDTZXMIXBJJVHL-ABSDTBQOSA-N 469.380 0.581 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1 1839200617 LCCJMNOQNVVUGP-YOEHRIQHSA-N 491.270 0.759 50 20 JCGD O=C(c1cn2ncccc2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201443 XVOPNTNGPTUWLD-RHSMWYFYSA-N 456.272 0.490 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn1 1840032764 JRQQNMWCNSCUCV-DJJJIMSYSA-N 470.320 0.722 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1 1840149746 ZFTALQNIIFJMBZ-UWJYYQICSA-N 450.923 0.587 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cc(Cl)ccn3)C2)C1 1840153688 XRYUULNHNXGNTE-KXBFYZLASA-N 462.330 0.824 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])C2)C1 1840154117 LWOAMWPAONKOJK-DYESRHJHSA-N 484.937 0.985 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1 1840155321 XQUVNQBOBKPMFM-UTKZUKDTSA-N 450.923 0.897 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccc4[nH]3)C2)C1 1840185112 IRGUNQRNWOULPD-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185249 NGRZTSJFKOOSMU-DEOSSOPVSA-N 460.575 0.675 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840186658 CJWGTZUBWQPRMN-KOSHJBKYSA-N 471.558 0.757 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841354373 VTEDXRTYGSMJFW-ZIAGYGMSSA-N 481.999 0.118 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cc(=O)ccn2C)C1)NC(=O)NCc1ccccc1 1844695265 JHABBAUBRTYLSO-UHFFFAOYSA-N 466.542 0.549 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CO[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]32)C1 1846161488 JZRMBZLITASZID-KZNAEPCWSA-N 493.605 0.445 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Cl)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847563923 NYHSTDWKNPPREJ-HRCADAONSA-N 464.371 0.810 50 20 JCGD O=C(Cn1cnc2scc(-c3cccs3)c2c1=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 9931020 ZIJBSOIUMSVBEE-SNVBAGLBSA-N 452.539 0.769 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cccc(NS(C)(=O)=O)c1 10356378 CBKHBUSGTODKBD-UHFFFAOYSA-N 468.561 0.804 50 20 JCGD COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)N2CCN(C(C)=O)CC2)cc1 726076130 NGRBRLPBFCSNID-UHFFFAOYSA-N 471.605 0.027 50 20 JCGD CN(C(=O)CN1CCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1)C1CCCCC1 728575637 FUADZTFXQABWNN-UHFFFAOYSA-N 460.535 0.765 50 20 JCGD COC(=O)c1sc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N(C)C)CC2)c(C(=O)OC)c1C 746008663 QXTYANCRDNBRLU-UHFFFAOYSA-N 490.560 0.333 50 20 JCGD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 746352282 DRLVNDQGXSBEJS-SFHVURJKSA-N 470.525 0.650 50 20 JCGD O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1 751283469 WMTZWNQZBNUYOG-UHFFFAOYSA-N 470.529 0.194 50 20 JCGD O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1)N1CC[C@H](B(O)O)C1 864233184 HUSOPEZPOWWQTB-INIZCTEOSA-N 451.354 0.387 50 20 JCGD CN1CCC(N(C)c2ccccc2C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)CC1 915958509 IIQLKMGDHPXAIP-UHFFFAOYSA-N 459.576 0.252 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C(C)C)C2=O 916746554 VLEQQICMTPCPAR-UHFFFAOYSA-N 493.567 0.916 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)C[C@@H](C)O1 917362901 RFRITAKKBHBPNX-SCTDSRPQSA-N 452.577 0.877 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)NCCN2CCN(S(C)(=O)=O)CC2)N(C)c2ccccc21 920250745 FSDJOOMSQWZPPL-UHFFFAOYSA-N 474.587 0.350 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C/c1nccs1)c(=O)n2Cc1ccccc1 1520838478 NUTOWRLUZYCBKO-CMDGGOBGSA-N 479.522 0.745 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cc[nH]n4)n4ccccc34)C2)C1 1778373731 MRNWHHUDTQHQON-SANMLTNESA-N 499.336 0.767 50 20 JCGD CC(C)n1nccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779749549 VZVYHFZVVWMLCC-AUSIDOKSSA-N 469.546 0.904 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(-n2cccn2)nc1 1779813238 SWXJCKYHLGQDEB-PXDATVDWSA-N 489.341 0.388 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1 1780711777 CZAJZOQIQSEWKT-JGTCGTHISA-N 454.351 0.801 50 20 JCGD NC(=O)c1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780773333 AHNQQVPOTGDDPL-ANTHHZPCSA-N 458.288 0.394 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969279 VODGZQMUMFKHGV-DVECYGJZSA-N 498.588 0.090 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Br)CC)C1 1781900798 FKMMQYIZWYKIIO-SCGCMHLBSA-N 464.357 0.738 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@@H]1O)CCO2 1783933244 TYTGDTOCQHMQSV-APTRMMRNSA-N 458.559 0.485 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1783963927 FVKUOTVHHSUEBQ-GVRJEKJASA-N 492.411 0.883 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)nc3C)C[C@@H]21 1787506893 TYEVXWQPRZRXCU-SKFHZHBLSA-N 455.519 0.456 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnc4[nH]3)[C@H]2C1 1788371322 UWUAKAJWZCZFQL-FNHZYXHNSA-N 463.498 0.469 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cc(F)c3)C[C@@H]21 1788610264 UKFAULRLRDUWGW-NXXSPTCGSA-N 459.453 0.870 50 20 JCGD Cn1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1C(F)(F)F 1788610431 RJEGOPLYGBVYER-CQDKDKBSSA-N 495.462 0.345 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnc(-c4ccccc4)o3)C[C@@H]21 1788611386 YDKGCRXWIYEDOZ-SNRMKQJTSA-N 491.508 0.642 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)[C@H]3CCC(=O)NC3)CCC2)cc1 1789519712 GFZVVWLXYGCHQU-AWEZNQCLSA-N 450.499 0.959 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])cc3F)[C@H]2C1 1790029809 XWIHNRPHNYKJGA-OWQGQXMQSA-N 465.482 0.700 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C(C)(C)CCl)n(C)c1=O 1792879634 LSCUTMNXVVFBGZ-BTTYYORXSA-N 464.954 0.337 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)cc1 1793010700 BRKILVKHIMTCTJ-QZLJAVCYSA-N 461.943 0.786 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cccc(N2CCOCC2)n1 1796617891 ABNKLXCVGDSHNT-DLTLXFJOSA-N 471.327 0.812 50 20 JCGD O=C1COc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)cc2N1 1797450478 DPJMBENQDPYOSV-OXUXUCFPSA-N 456.268 0.911 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798439471 BFLAPXNCNFYXIN-BASYENTBSA-N 490.561 0.213 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC[C@H]2CCC(=O)N2C1 1799146097 LOGRRHLQTOSFOY-WJDFIBMTSA-N 484.557 0.111 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cc[nH]n1)C2)NC(=O)NCc1ccccc1 1799869425 OCGOVIRQNGSOEC-ACDBMABISA-N 453.547 0.937 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800436817 OFOFIAUPRKQLQH-YHDCXSKOSA-N 496.402 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(c1)CCNCC2 1801311432 WYTPIEKNIYMLCP-BCDXTJNWSA-N 463.542 0.334 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(C)(C)C 1803383316 FRDOYTZIWSEYAT-ILWGZMRPSA-N 480.374 0.632 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1F 1805145930 UKIHDUGXDJZJET-DNVCBOLYSA-N 480.504 0.895 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365475 KEZRPEWJYFYWRU-UTKZUKDTSA-N 488.288 0.577 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369336 HAKKDVULAOPRAL-RDPSFJRHSA-N 478.358 0.484 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1 1807373620 CSDGNKOQEAMOQJ-AVRDEDQJSA-N 476.298 0.946 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)no1 1809977738 FLKPSNMVRFBZLY-UHFFFAOYSA-N 468.319 0.536 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1 1811205417 KWCPIFWZKQNNLQ-LAUBAEHRSA-N 461.287 0.193 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)Cc2cscn2)[C@@H]1c1cccnc1 1813070045 FWZXOVBXZSIRDJ-DJPFJPOOSA-N 473.603 0.487 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnn3ncccc23)[nH]n1)c1cccc(B(O)O)c1 1817475209 MSCIUUARRIOSGX-LJQANCHMSA-N 459.275 0.752 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476950 IQCFBWJKLYAKAT-SFHVURJKSA-N 454.292 0.905 50 20 JCGD COc1nccnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819402272 YPHIMGQOIPKPGS-OAHLLOKOSA-N 465.474 0.827 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc4cn[nH]c4cn3)sc2C1)c1cccc(B(O)O)c1 1819445511 ADZPYRIXWLPAJA-CQSZACIVSA-N 462.300 0.634 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3ccnc(Cl)n3)sc2C1)c1ccc(B(O)O)cc1 1820462308 JWEIKZAOFWAGKH-LBPRGKRZSA-N 457.708 0.806 50 20 JCGD COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)CC1 1825278318 VWLCQZOHNSTSJJ-JTQLQIEISA-N 458.500 0.321 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052119 AOFKVWIVUSZQPE-IBGZPJMESA-N 494.382 0.983 50 20 JCGD COC(=O)CSCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055798 JYYGRPVCWYHERM-IBGZPJMESA-N 462.377 0.506 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)CC1 1827676060 CXHUDZNHHHPZHY-OAQYLSRUSA-N 491.419 0.025 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1827680537 NYLDRJMCBRJNLB-YGYFLSRZSA-N 493.373 0.734 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2nc3ncccn3n2)CC1 1828176133 PCRNHFLNGNMXQB-IBGZPJMESA-N 462.319 0.351 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(OC)cc3)CCO2)C1 1830242870 VNRJLHOTSRTDRU-GHTZIAJQSA-N 456.923 0.784 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830357535 FQTFAFNBJCINOZ-YCRPNKLZSA-N 477.986 0.593 50 20 JCGD N#Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccc1Br 1830733333 IPXUQQYRPXOIKJ-VQIMIIECSA-N 486.750 0.990 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)NS(=O)(=O)CC)CCO2 1831317745 LDDXPDITHPDFGU-VKJFTORMSA-N 453.989 0.178 50 20 JCGD CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)CC1 1832111632 MJHTWOYFBXBKSO-MGPUTAFESA-N 493.960 0.739 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2 1832218452 JCEFRVQSOYBYDY-REWPJTCUSA-N 456.279 0.147 50 20 JCGD Cn1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549238 ITQVGDCKOUOPJX-BTYIYWSLSA-N 485.969 0.622 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1833421919 HWUUZVCDSXWVJQ-NRFANRHFSA-N 475.527 0.139 50 20 JCGD Cc1cccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834147684 FLKVBBGTDASXBV-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CC[C@H](N)C(N)=O)CC2)CC1 1834732159 GTJIAFGINIIGRN-BBRMVZONSA-N 460.417 0.182 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1C 1834799997 NEIRPVBVWPXSLW-UHFFFAOYSA-N 464.375 0.877 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1834821452 LGGHGUIKOQXLPT-GOSISDBHSA-N 452.309 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3nnsc3C3CC3)CC2)CC1 1835737121 ZDLBIFWCKOZJNZ-UHFFFAOYSA-N 498.613 0.913 50 20 JCGD N#Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(C(F)(F)F)n1 1836320461 DKFBUQOMWGHBQT-RDTXWAMCSA-N 476.839 0.642 50 20 JCGD O=C(c1nc2ccccn2n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836396799 CYPUBSIVFCLHFC-SUMWQHHRSA-N 456.272 0.490 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837164474 IGHBJZGICRNNKY-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457004 VRELZPSUILLLHP-JXFKEZNVSA-N 453.927 0.163 50 20 JCGD CCOc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459840 NNYWXMHAGQBPEX-DEOSSOPVSA-N 483.525 0.468 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnccn3)C2)C1 1838527152 JUJJWEJINIMGJK-HSZRJFAPSA-N 499.480 0.623 50 20 JCGD O=C(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)Nc1ccc(F)cc1 1839028646 NZOYNQHAVHBQNA-JXFKEZNVSA-N 457.886 0.210 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c[nH]c4ccccc34)CCO2)C1 1839070756 HQOYEULSJGTAKZ-VWLOTQADSA-N 492.536 0.479 50 20 JCGD 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CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1 727765345 WEZOZZYKJKGXDA-IBGZPJMESA-N 487.538 0.896 50 20 JCGD CN1CCN(C[C@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc2)CC1 727843632 QMRWFLCWFSJHPZ-SFHVURJKSA-N 473.603 0.912 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728983888 WHMGKTLGEKVQOD-UHFFFAOYSA-N 474.543 0.412 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1ccc(-n2cnnn2)cc1 730514639 BRXOZBARWXVCAR-GOSISDBHSA-N 469.527 0.665 50 20 JCGD O=C(NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)C1CCN(c2ncccn2)CC1 730546743 SNICIGQGAOQLNL-QGZVFWFLSA-N 466.498 0.665 50 20 JCGD Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)COc2ccccc2O)cn1 730778585 QVEOKXHSFUUUKX-UHFFFAOYSA-N 451.486 0.828 50 20 JCGD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 746352281 DRLVNDQGXSBEJS-GOSISDBHSA-N 470.525 0.650 50 20 JCGD COc1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1S(=O)(=O)NC(C)C 751209919 YKIUKFJNCALDPS-UHFFFAOYSA-N 454.530 0.634 50 20 JCGD O=C(NCc1ccco1)NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1 751272976 UFPNFDZTQUFKOP-UHFFFAOYSA-N 456.424 0.813 50 20 JCGD Cn1nc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c2ccccc2c1=O 914279805 DNZMMQSAEWYNPC-UHFFFAOYSA-N 469.523 0.768 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3cc(-c4ccccc4)on3)cc2)CCN1 914466584 TUMUJOFFDYQCNN-UHFFFAOYSA-N 469.479 0.537 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Cl)c2)ccc1Cl 915789096 JLZQZFHEXDRNDV-UHFFFAOYSA-N 495.366 0.770 50 20 JCGD C[C@@H](CN1CCOCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 916469558 AQLNMDQVQPSMGH-KRWDZBQOSA-N 475.571 0.830 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1 916648871 DKCOAHOXZFGCLP-UHFFFAOYSA-N 477.543 0.697 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)CC[C@@H]3O)C2)C1 1778087322 KTNSLIXUHUNQMC-DOWNOZBLSA-N 489.997 0.688 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778115826 BLIPOYZXZATNHH-CRAIPNDOSA-N 480.425 0.661 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc2ccccc2n1 1778429535 UQURWZNBXZIKJV-RCZVLFRGSA-N 474.326 0.751 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)C[C@H]3COc4ccccc4O3)CCO2)C1 1779028313 CTHDEHSPSRAKFK-FYSMJZIKSA-N 481.509 0.359 50 20 JCGD Cc1nc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)s1 1779029163 SYTZUHMCSMENSV-NRFANRHFSA-N 458.544 0.445 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779032229 HFZDXFIWBXDOFO-HSZRJFAPSA-N 487.488 0.599 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n[nH]1 1780968509 MDFPOPZHYLMKIH-HSZRJFAPSA-N 469.546 0.508 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(O)c1OC 1781828974 FLNWLEJBCQQIOK-JOCHJYFZSA-N 464.519 0.226 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@]34C[C@@H]3CCN4C(=O)OC(C)(C)C)C2)C1 1783688319 RXPWEAATLDSRNI-YRUKQIKQSA-N 493.605 0.589 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Cn3ccnc3)C2)C1 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CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1 1793155941 UMZXZKLIDVAHJP-KAUDDPROSA-N 495.621 0.642 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796189871 KTPITSUMPMVHSS-QSWMPLQWSA-N 489.378 0.546 50 20 JCGD CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796368608 ODZJHTOOXFKELI-RTDPWRILSA-N 463.934 0.871 50 20 JCGD COc1ccc2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)ccc2c1 1797001350 DOUHOTPNIXKCGB-FEJSZKPUSA-N 475.310 0.440 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)[C@@H](O)C1 1797309077 ZGSSPGLKWKZMTJ-KWCBCURJSA-N 489.997 0.184 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1800759281 PLHXRZDTLVTQTC-BCDXTJNWSA-N 466.303 0.906 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2 1800836686 VFAVEGQFKLHQHS-CUSZFKRNSA-N 465.385 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CS(=O)(=O)Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cn1 1809977641 ANNBBCORESGDJU-UHFFFAOYSA-N 499.398 0.465 50 20 JCGD Cc1c(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cnn1C 1810300435 YJNYDSXNPVIEGQ-JXFKEZNVSA-N 462.514 0.755 50 20 JCGD CCc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n(C)n1 1810926311 VHNNCQOIOBQTKW-GCJKJVERSA-N 461.331 0.691 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1nn[nH]c1C(F)(F)F 1811559165 ZNJCPSXQZOUUNB-RHSMWYFYSA-N 488.235 0.532 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)Cn2ccncc2=O)[C@H]1c1cccnc1 1812341157 AZDWISBQYOCRIW-IZQKNGFYSA-N 490.524 0.478 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1 1813072345 ASDGWTGOGNLNEA-CEXJFXJFSA-N 467.574 0.989 50 20 JCGD C=C(CC(=O)OCC)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815359794 GFZWNUAIVODFPU-HNNXBMFYSA-N 457.317 0.558 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3[nH]nc4ncccc34)sc2C1)c1ccc(B(O)O)cc1 1816870862 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CC(C)(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1829569975 RAFOQEBBGLNRIM-VWLOTQADSA-N 496.568 0.761 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)[C@@H](O)C1 1829690532 BUKORWHEOQIHOY-VCAMNPENSA-N 493.960 0.595 50 20 JCGD O=C(COc1cccc(Cl)c1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830278879 ZTSNWHOQMWENRQ-HSZRJFAPSA-N 488.733 0.169 50 20 JCGD COc1ccc2c(CC(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c[nH]c2c1 1830719817 LKFPLKLPRFNLOL-KNQAVFIVSA-N 465.934 0.775 50 20 JCGD CCOc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cnc2c1cnn2C 1830723584 QHFZOBVSTPXAFY-HRAATJIYSA-N 481.937 0.037 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726956 YBELDZUDKLGCLI-DNVCBOLYSA-N 450.841 0.703 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)n1 1834823428 URNSCPIFJZPSJH-HXUWFJFHSA-N 485.379 0.528 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1834824688 GUUYBGUIVFTNSM-GOSISDBHSA-N 470.299 0.723 50 20 JCGD Cn1ncc(Br)c1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1835263189 ABGWYGUFLQOEAY-HNNXBMFYSA-N 476.803 0.968 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)CC1 1835738196 XKUUPCXQYHITFN-HSZRJFAPSA-N 492.580 0.874 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc4ccccc34)C2)C1 1835930438 INXXNGPYRJPCDL-VWLOTQADSA-N 491.309 0.004 50 20 JCGD O=C(c1ccoc1I)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836262001 AYSOHBOQASMHPU-WBMJQRKESA-N 498.701 0.554 50 20 JCGD Cc1csc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837456974 RESLKHOXCXJDGM-QHCPKHFHSA-N 487.582 0.758 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837711420 HCFLQCOIEGPYNS-BQNPTPDXSA-N 479.610 0.428 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccn1 1837919134 IBJBKRWEVIKCAB-UHFFFAOYSA-N 451.332 0.996 50 20 JCGD C#CCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054147 IRXKODGILSVDRR-VWLOTQADSA-N 485.585 0.593 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1839079717 KBUJNIWBUPUEFH-LMVRJCEZSA-N 496.402 0.172 50 20 JCGD CC(=O)O[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)C(C)C 1839201113 WCBGQKFYVPXRNT-GRDNDAEWSA-N 453.305 0.721 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622481 HFZNQKDHMAXMTB-DYESRHJHSA-N 453.971 0.806 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622483 HFZNQKDHMAXMTB-UTKZUKDTSA-N 453.971 0.806 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(C)c(C)[nH]c3=O)C2)C1 1839962620 LRBWRHQIZBXPAV-LIRRHRJNSA-N 471.352 0.630 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3COc4ccccc4O3)C2)C1 1840150138 GIZFVXWXFCLZLW-PNLZDCPESA-N 468.934 0.927 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840189382 OHNBJFNKWBRRBA-YJYMSZOUSA-N 484.377 0.522 50 20 JCGD O=C(CCCCCCCCBr)N1CCO[C@@]2(COCCN(C(=O)C(O)O)C2)C1 1840937533 TUCHVVMRAIYFHY-IBGZPJMESA-N 465.385 0.879 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCSC(=N)N)C1)NC(=O)NCc1ccccc1 1842914347 AHDMVJXTPMHBTL-UHFFFAOYSA-N 461.592 0.553 50 20 JCGD O=C(c1csc(Br)n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011382 XTBZLDZJAZUIGV-UHFFFAOYSA-N 450.123 0.716 50 20 JCGD CC(C)(C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ncc(Br)cn1 1843013062 DRVYXOLSIJHWNA-UHFFFAOYSA-N 487.163 0.714 50 20 JCGD O=C(c1ccoc1I)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013313 GHXKWGREGPKTQY-UHFFFAOYSA-N 480.067 0.695 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)cc2)C(=O)C1 1844264752 DEEATNBRQUDKKJ-UHFFFAOYSA-N 475.509 0.929 50 20 JCGD C[C@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H]2CSCN2C(=O)[C@@H]2CCC(=O)N2)C1 1845874315 SUGBKYSDRZFTGE-RWMBFGLXSA-N 473.393 0.153 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)C1 1847684726 AJKUBICWRPAAIM-RNQOJCNYSA-N 471.363 0.875 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1848323307 BJXLHGPFXUUGQQ-OALUTQOASA-N 451.288 0.456 50 20 JCGD O=C(NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)[C@H]1CCS(=O)(=O)C1 18946194 WSVGWMZIWWEMJZ-NSHDSACASA-N 497.020 0.113 50 20 JCGD Cc1ccc([C@@H](CN2CCOCC2)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 28799765 VZOPBPHYOUJVKU-HXUWFJFHSA-N 450.503 0.988 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1 725871290 FEYFLCUFBBESSG-UHFFFAOYSA-N 469.520 0.364 50 20 JCGD CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)CNC(=O)c3cccs3)cc2)CC1 725874089 XCMFUZVZNPGOKG-UHFFFAOYSA-N 458.544 0.396 50 20 JCGD Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)c1 729275322 NFCBDZQPPFJFHI-CYBMUJFWSA-N 454.530 0.495 50 20 JCGD COc1cccc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1OC 746854223 KSJKGYGHPCFVDD-UHFFFAOYSA-N 471.470 0.831 50 20 JCGD CN(C)C(=O)CN1C(=O)C(=NNC(=O)[C@H]2CCS(=O)(=O)C2)c2cc(Br)ccc21 750931735 AYISDKAWXDZRLW-JTQLQIEISA-N 471.333 0.139 50 20 JCGD Cc1noc(C)c1S(=O)(=O)NCC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12 768946625 CUHXVBOVUFWPTN-UHFFFAOYSA-N 462.488 0.322 50 20 JCGD O=C(COC(=O)CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)[C@H]1COc2ccccc2O1 785403794 LCXYJVSQFMFCNV-QGZVFWFLSA-N 481.458 0.025 50 20 JCGD CCOc1ccc(C(=O)NCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OCC 913155921 DXCGVPFSBGORJR-UHFFFAOYSA-N 453.459 0.651 50 20 JCGD O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 913600986 XPQRFAUBKYQPFN-UHFFFAOYSA-N 484.531 0.350 50 20 JCGD CCn1c(NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)nc2ccccc2c1=O 914464895 OAPMQJLHJZRHRS-UHFFFAOYSA-N 470.511 0.294 50 20 JCGD C[C@@H](Cn1cccn1)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916463021 HAUTUWCJPHEVGP-INIZCTEOSA-N 464.548 0.256 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)CC(F)(F)F 918365218 WVRBPJPSCHOBOM-SZNGSJQDSA-N 471.479 0.480 50 20 JCGD COc1cc(C(=O)NNC(=O)C[C@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)ccn1 1317858034 DJLIDKFRIQWPCS-INIZCTEOSA-N 478.527 0.818 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2c1 1778509562 MIBAFLRVVDHRIQ-QHCPKHFHSA-N 457.531 0.993 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3n[nH]c4cc(Cl)ccc34)CCO2)C1 1779032628 PKGWYEHAFMWHMH-QHCPKHFHSA-N 497.943 0.901 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779303209 IVPQDKNVUAKIQA-ROSOWXQZSA-N 493.369 0.757 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1779321471 VCODFOFPRIBGAX-ZWPHDGAYSA-N 489.577 0.342 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3ncn(C)n3)CCO2)C1 1780095087 FQAUAQGJXWARQF-HXUWFJFHSA-N 458.431 0.406 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccnc1)CCO2)NC(=O)NCc1ccccc1 1780969999 QCUGIHXXQFTOTK-XMMPIXPASA-N 466.542 0.871 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1781188681 SWWKPDJBKXVWKW-VFCRVFHLSA-N 491.969 0.263 50 20 JCGD Cc1nccn1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1781557525 NPMZGGZPKVBHKH-XMSQKQJNSA-N 455.519 0.018 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1783939278 BTOMQCNXNGQMMW-HSZRJFAPSA-N 476.530 0.055 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1785342493 LRHOWLDUCVRUIO-HXOBKFHXSA-N 490.561 0.432 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1785691037 HYGPQWYVJDIQNB-VPCSNGCSSA-N 463.934 0.764 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981683 GGOPHROLSIZBMO-BUKVSMQUSA-N 496.329 0.248 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3ccnc3C)C[C@@H]21 1787508222 QTSREHUGQQUFKR-OLOXLEKQSA-N 469.546 0.866 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)ccc1C 1790200175 QNAZWGSLQNYRNW-RRPUWOKSSA-N 479.342 0.540 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)C[C@@H]21 1791055361 UQILCODEUDUULG-KLACQSGDSA-N 496.402 0.929 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C[C@@H]21 1791294026 ZZNHVMPWDDZPRQ-KKXDTOCCSA-N 463.491 0.267 50 20 JCGD CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1793451523 AHUWFQPJVUMSDT-IVSAIRAKSA-N 454.980 0.889 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1793873475 UHHVKLKWONBVBG-CEQLMSFQSA-N 499.373 0.137 50 20 JCGD COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1795129477 MCAHAYUAMIYZDB-FAQVEIGNSA-N 467.526 0.530 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(Cl)nc2n[nH]cc12 1796191259 QIYNYXIGWZJBEF-QDMKHBRRSA-N 453.695 0.857 50 20 JCGD Cc1ccc(COCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1C 1796471307 FSCLJARKOUDAMO-BBIADKPPSA-N 481.553 0.722 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797750981 ZBEPBKCOPWAFAD-GPVSGQMNSA-N 497.552 0.538 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc(C(F)(F)F)n1 1798514622 HUTFBGXNPJUNSV-HBCWATKFSA-N 487.479 0.685 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1800354617 MUMTUCNPKXGAGQ-USGNIVHTSA-N 487.944 0.793 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)[C@@H](C)O3)C2 1800979068 RKCJKFDLIZSYJG-BWOYXGKQSA-N 451.907 0.863 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc3nn[nH]c13)C2 1801011847 KKMBYJCDRFQOML-KSPBDQMDSA-N 463.926 0.188 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803143034 RHMHFPYUIPYELD-PAYONLEZSA-N 460.922 0.296 50 20 JCGD C=CCO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803566966 PTXIBDGIYKXTLB-OXFYSEKESA-N 452.515 0.991 50 20 JCGD CCCNC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807359944 NKYVZOKWJMGGOG-CVDCTZTESA-N 466.347 0.387 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1 1807928482 PODZLMVJFJSXQF-BTHPGYMESA-N 451.999 0.977 50 20 JCGD CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807943997 LHQZTUPTBCBCSP-KEYYUXOJSA-N 458.910 0.935 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@@H]1SC(=N)NC1=O 1808392737 IHYIQLIDQWFQLD-DJIJKHNZSA-N 453.952 0.490 50 20 JCGD O=C(c1ccc2nc(CO)[nH]c2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809978149 NXOPTMUWJAGTNC-UHFFFAOYSA-N 476.342 0.894 50 20 JCGD COCC1(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1810293578 GAETZZNMJCAAGX-APWZRJJASA-N 452.515 0.826 50 20 JCGD O=C(/C=C/c1cnccn1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813482935 FCMYWSYNCBRPKH-WQZLPFSVSA-N 457.299 0.584 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354753 CEDZYQSCEBVACO-XJKSGUPXSA-N 453.333 0.582 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1nccn1)CC2 1817281509 GIYPBKHBQAYDBB-BUGPSZFBSA-N 455.504 0.481 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1820110406 BRNJOECJFGDATR-NWDGAFQWSA-N 473.559 0.672 50 20 JCGD CCOC(=O)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1 1824860429 SMXZLQFLONZHMG-CQSZACIVSA-N 457.317 0.392 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCC(=O)NC2)CC1 1828922178 QNVPHERUDVQEGT-LPHOPBHVSA-N 456.547 0.445 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1828923901 YWOCLSMVELJTIZ-IBGZPJMESA-N 484.517 0.723 50 20 JCGD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)n1ccnn1 1828924651 WMQIYDNVUHZBMU-HNAYVOBHSA-N 454.535 0.771 50 20 JCGD O=C(Cn1cncn1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829010389 RRYSSDRATGFCRV-PGRDOPGGSA-N 490.948 0.330 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc[n+]([O-])cc2)CC1 1829516115 UIEIXMCHNDBXHW-FQEVSTJZSA-N 452.515 0.866 50 20 JCGD O=C(Cc1c(F)cccc1Cl)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830285879 IFFCHVSENRJSCA-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD CCOC(=O)C1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](C)CBr)CCO3)C2)CC1 1830544149 OPNLDYSXFMCMEX-KBXCAEBGSA-N 461.353 0.817 50 20 JCGD O=C(c1cnc2cc(Cl)ccn12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724527 XXMUZYCSNYRNQJ-HNAYVOBHSA-N 457.314 0.657 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830725634 LCVAJNMKNDZGPX-NJSLBKSFSA-N 484.377 0.175 50 20 JCGD CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737386 DWJZHWCPPDXBGY-DVSDUFGPSA-N 492.013 0.982 50 20 JCGD COC[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1831629519 JVGBECJISKXUHV-OYHNWAKOSA-N 479.486 0.873 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nc3ncccn3n2)CC1 1831873512 VYNPEAHGLRMHQW-KRWDZBQOSA-N 456.551 0.731 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccnc(OC)c3)CCO2)C1 1832600135 CWCUOSHWWIDRFZ-UWJYYQICSA-N 455.939 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccco3)CCO2)C1 1833075714 NQDARVAPGPRRPB-SIAOZKNOSA-N 455.471 0.062 50 20 JCGD Cc1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)s1 1833149719 FGLDOUZPJQNFFV-NRFANRHFSA-N 467.592 0.132 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1833262511 RIXYNRHESWNKQH-ZDUSSCGKSA-N 483.344 0.314 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccon3)CCO2)C1 1834487774 BNBATXGUYCGLAV-OAQYLSRUSA-N 474.426 0.892 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1scnc1C(F)(F)F)CCO2 1834571415 PORINMYQHXGHLT-IBGZPJMESA-N 499.276 0.226 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1834798088 RWIZHRFBBSPUHX-XMMPIXPASA-N 495.385 0.294 50 20 JCGD CCn1nc(C)cc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800163 VOPXGDMLCDVSKC-UHFFFAOYSA-N 467.379 0.390 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CC[C@H]3CCOC3)CC2)CC1)c1ccc(B(O)O)cc1 1834800695 ZMJFVWDZRSQTAW-SFHVURJKSA-N 457.380 0.368 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834823146 LEBZXHOQQBCBQT-RDTXWAMCSA-N 456.341 0.518 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ncc(Cl)cn3)CC2)CC1 1835737166 REZCYUVAWSUKEV-UHFFFAOYSA-N 486.964 0.628 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)o1 1835737952 OLWWWYQGXVAUPL-UHFFFAOYSA-N 497.556 0.736 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738289 SRAKFVAAAWAJSJ-GOSISDBHSA-N 487.649 0.848 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(Cl)c1 1835933873 HUKYTANNBLYFDA-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1836419775 ZAKASCFWMOVPFN-FZKQIMNGSA-N 458.309 0.736 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922070 IIGGUECICLXLND-SFHVURJKSA-N 481.358 0.841 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)C(C)(C)C)C2)C1 1838526740 BFIZYOVBKIAGLT-AUSIDOKSSA-N 493.513 0.997 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc[nH]3)C2)C1 1838527398 QYTYSUUVJPXAHA-OAQYLSRUSA-N 473.442 0.627 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C#N)cc1)CCO2 1838950765 CSRJHPQQWUVOCM-VNSNFZHPSA-N 478.509 0.762 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)C)C2)C1)NC(=O)NCc1ccccc1 1839054117 HTNYSDZSMCRLLX-XMMPIXPASA-N 475.590 0.835 50 20 JCGD CCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1840524316 WVWQBQBESQXUPR-DEOSSOPVSA-N 491.589 0.216 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1841777500 MFVBWMSWJYJHBB-LJQANCHMSA-N 471.363 0.973 50 20 JCGD CC[C@@H](CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)NC(=O)OC(C)(C)C 1843011967 OXETYZPBGLQJBX-SFHVURJKSA-N 459.352 0.877 50 20 JCGD O=C(C1CCN(c2ccc(F)cn2)CC1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014801 CTMQKKFRXYPOFO-UHFFFAOYSA-N 466.322 0.634 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CS(=O)(=O)N2CCCC2)C1 1843414485 VBLSNOKRCRKCFG-UHFFFAOYSA-N 494.526 0.763 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnc3c(c2)CCNCC3)C1 1845796950 AQFIWKZYDHWFKD-LQKURTRISA-N 463.542 0.721 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cc([N+](=O)[O-])cc(S(C)(=O)=O)c3)cc2)CC1 728215959 MVCLLKPBMAALSE-UHFFFAOYSA-N 497.555 0.691 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 728383013 AUFNFDRSBHRTRI-HUUCEWRRSA-N 457.574 0.754 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(CC(=O)N2CCCc3ccccc32)CC1 731365145 AFDVZBCDIBZFIL-UHFFFAOYSA-N 468.514 0.347 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H]1C[C@H]3CC[C@H]1C3)c(=O)n2Cc1ccccc1 789857492 VEZBWIKKAZHNRF-GBESFXJTSA-N 494.552 0.638 50 20 JCGD Cc1cccc2c(=O)n(CCC(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cnc12 792695329 CKOMYPVMQDIRHU-SFHVURJKSA-N 466.450 0.626 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)cc1 860424505 HWPNYGMNVZGMBB-LAQRGFTBSA-N 466.523 0.676 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)cc1 901412709 MKMKIRRKNLYGFO-UHFFFAOYSA-N 476.555 0.922 50 20 JCGD COc1ccc(C(=O)NNC(=O)Cn2nc(C)cc2C)cc1S(=O)(=O)NCc1ccccn1 913025787 QHZDISDPOLFBFG-UHFFFAOYSA-N 472.527 0.843 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNS(=O)(=O)c1ccc(Cl)cc1 913392079 VIRMTHNNQLNSPH-UHFFFAOYSA-N 479.990 0.978 50 20 JCGD O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 913416504 GIMSJTSJGMSSJE-KXBFYZLASA-N 461.496 0.745 50 20 JCGD C=CCNC(=S)NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1 913438071 JXHYGCUFEKTGIH-UHFFFAOYSA-N 467.617 0.598 50 20 JCGD CN(C)c1cccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 915921947 QKSDXICGMLOBCG-UHFFFAOYSA-N 461.544 0.918 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1 916649501 PMHIKNZAVXCVBI-UHFFFAOYSA-N 451.461 0.664 50 20 JCGD COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 917721196 SGEPIRGNSUGULB-UHFFFAOYSA-N 499.567 0.567 50 20 JCGD CC(=O)NCC(=O)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 921164903 ANJXLCOSPBQDBE-UHFFFAOYSA-N 481.918 0.154 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1779181208 YMXFLBPCRBDXLJ-BKTGTZMESA-N 458.346 0.661 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1 1779691769 DIABSJLMTDTSBH-QFIPXVFZSA-N 455.519 0.084 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1780287083 QKDFSRFZDHSPGV-XMMPIXPASA-N 460.299 0.514 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1[N+](=O)[O-] 1781304054 SBIOXDSOVCBIOE-HSZRJFAPSA-N 467.287 0.269 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2)C1 1781356171 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CN1CC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]3C2)C1 1785078887 DAMSEQSBIVFWSD-HJWJTTGWSA-N 458.987 0.660 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c5ccc[nH]5)[C@H]4C3)(C1)C2 1787508139 ICUYYSQHOJUDKB-IYMWFAKISA-N 485.541 0.443 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)cn3)C[C@@H]21 1787508702 INWIBFKSPDMRDC-VOSSUDFCSA-N 456.478 0.948 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc2cnccc12 1788381242 WHVRKHARQMDYFL-TZYHBYERSA-N 459.311 0.822 50 20 JCGD CCC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726750 SGPZGPCAFAWTPU-BJLQDIEVSA-N 459.547 0.291 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCN(C)C4)[C@H]2C1 1790524995 ZXKCZAGHGMBDRQ-RMRDIRSESA-N 453.971 0.566 50 20 JCGD COC(=O)[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)NC(=O)OC(C)(C)C 1791194785 DNMVPIASCCYZED-HAFSJTIUSA-N 479.933 0.957 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(S(C)(=O)=O)c3)C[C@@H]21 1791286347 BRZZPGKCBVCWLF-WDSOQIARSA-N 480.587 0.056 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1 1792696110 VHUXZTIRJQXCPU-AYRXBEOTSA-N 463.325 0.984 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C[C@H]1CCOC1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792978306 POLSCGMWXGGHMZ-OOOWVJFSSA-N 489.997 0.496 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1COc2ccccc2O1)c1ccc(B(O)O)cc1 1793477007 HXYLSGOLENOOTM-YRPNKDGESA-N 450.300 0.848 50 20 JCGD O=C(COc1cccc2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793817067 VQUGTSRDRCHXKE-NXKWYNOOSA-N 474.322 0.802 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796192036 DDHAKDNVOQVRGP-FCGDIQPGSA-N 485.346 0.544 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(F)cc1)C2 1796441255 OUTJSAFEJAYMJR-GYGSIYFNSA-N 471.489 0.928 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cc1 1796442180 VIVQTUJVNYLOMC-UQCYYEOYSA-N 494.552 0.911 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@H](c3ccccc3)C1)C2 1797750617 NEIBFXSBNAJUPE-GQSCTRQFSA-N 478.509 0.406 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](COC(C)=O)OC(C)=O 1797793546 QFNRYRNBVXCXQR-YIDVYQOGSA-N 463.325 0.244 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc3c(c1)OCO3)C2 1798439113 DNROSFYLIOENOD-MUJYYYPQSA-N 451.483 0.908 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 1799198318 UIHWWKVXOZSCHV-FQMQPWHVSA-N 459.971 0.821 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cccc([N+](=O)[O-])c1=O 1800284034 NTPYZPQMOPQNIR-ABXQLRGKSA-N 461.302 0.582 50 20 JCGD NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800437307 UVDYJJSLWCTIAV-YYAJDYIMSA-N 452.349 0.848 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC(O)CC1)NC(=O)NCc1ccccc1 1801134402 CMPJFFNWWLJRJC-XSVLDXLUSA-N 487.601 0.473 50 20 JCGD COc1nccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1F 1807366459 ZEFQHAPFBKRIOB-UTKZUKDTSA-N 478.289 0.938 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)(C1)C2 1807373357 CKHYYVNIDJKHTM-QYQPWLLASA-N 477.326 0.424 50 20 JCGD O=C1NC(=O)[C@H](CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)N1 1808650874 GRJWPIVPDPSYSH-ZMJPVWNMSA-N 456.272 0.376 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCN2CCOC2=O)[C@H]1c1cccnc1 1809530480 CRDBWPPYDMRPFV-OXJNMPFZSA-N 481.513 0.242 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccn4c(O)nnc34)CC2)C1 1809977664 BRFOVNBAMAEIPC-UHFFFAOYSA-N 463.303 0.273 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1 1810305588 MBNZPVRPSWONPW-JTSKRJEESA-N 479.541 0.412 50 20 JCGD CNC(=S)NCCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 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O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1(Br)CC1)CC2)c1ccc(B(O)O)cc1 1815343699 JQXIBZDMUIRCKE-LBPRGKRZSA-N 464.150 0.976 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CC(c3ccccc3)=NN1)CC2)c1ccc(B(O)O)cc1 1815348290 KKIDNVKGVRDJAT-PXNSSMCTSA-N 489.366 0.815 50 20 JCGD N[C@@H](CC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)c1cccnc1 1815355016 ZEENWXFCDPJECK-IRXDYDNUSA-N 465.344 0.534 50 20 JCGD Cn1ccc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)n1 1815549281 ZSVVLENKNIGBAP-NSHDSACASA-N 454.516 0.344 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1819433197 SCONYORVONYOPO-IAGOWNOFSA-N 480.522 0.270 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3ncccn3n1)CC2 1819797327 SMVYCXSEMKKNHA-LLVKDONJSA-N 477.510 0.724 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cnnn1)CC2 1821304827 SGKJQQPUMFNCDJ-NSHDSACASA-N 486.470 0.889 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CC1 1824108380 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1813020597 DZKJOIXJBGZJGP-KZKAQZJJSA-N 491.353 0.836 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1814992330 LYKWOPLVMGMVMD-CZUORRHYSA-N 465.344 0.944 50 20 JCGD O=C(COC(=O)C(F)(F)F)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343987 AGNFWLBQSVSIDW-NSHDSACASA-N 471.222 0.154 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CC(F)(F)C(=O)O)sc2C1 1817092842 SHGXMEIBVRYRIN-QMMMGPOBSA-N 468.442 0.477 50 20 JCGD COC(=O)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1 1818223227 BIOZSZMNTPDIBT-IBGZPJMESA-N 477.286 0.891 50 20 JCGD COCCn1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1 1818262053 QQQDVITYMMPMAS-KRWDZBQOSA-N 460.539 0.932 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCCCC2=O)[nH]n1 1819404135 AQLCINXKLGSKMC-QGZVFWFLSA-N 468.518 0.727 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1823744672 ZVWBFFHQJNFADL-XPTLAUCJSA-N 453.348 0.458 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CCc4nc[nH]c4C3)sc2C1)c1cccc(B(O)O)c1 1826616428 FZBHDGJNNQLOIR-DZGCQCFKSA-N 465.344 0.577 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826886749 PROCGVDWCSRPNM-CJNGLKHVSA-N 466.328 0.911 50 20 JCGD Cn1cccc1C(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826995519 GNZKYHJKXZTIMF-AWEZNQCLSA-N 452.301 0.270 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CC#N)CCN2C(=O)OCc2ccccc2)C1 1828811003 QQSOYUNGQNDJGM-DEOSSOPVSA-N 484.557 0.725 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)C1 1830428785 MFZYVJXDUXZZJY-GCJKJVERSA-N 483.924 0.758 50 20 JCGD CC[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830733939 XCCVCVJPMPJKLW-WHSLLNHNSA-N 477.986 0.736 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CCOC[C@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)[C@@H]2C1 1830735016 CBIGOXVHWYZLPK-HGRWERBWSA-N 487.981 0.155 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831871441 SHOVMNKZPKFJBW-FUHWJXTLSA-N 458.625 0.660 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)s1)CCO2 1834055737 ZXSRZDAXAFJZKS-FQEVSTJZSA-N 464.736 0.465 50 20 JCGD COc1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)cc1C 1834578957 LXJXVXTXWIUJNO-VNSNFZHPSA-N 498.540 0.603 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798475 ZTPCAVIACUUUNX-UHFFFAOYSA-N 471.363 0.061 50 20 JCGD O=C(Cn1cc(Cl)cn1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834814152 LEJKGKIKGOKVBM-UHFFFAOYSA-N 473.770 0.102 50 20 JCGD COc1ccc(F)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461601 ZGAVIOSIJLOBKI-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD O=C(Cc1ccncc1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920011 BMUJDVADSDFQFF-UHFFFAOYSA-N 451.332 0.616 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1838103244 SGFPKKYJBPDQFI-CXEIWHQESA-N 474.562 0.644 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1838357185 VGIVLWXNYMDDKD-ZIAGYGMSSA-N 468.320 0.740 50 20 JCGD O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1838627562 GBRHQUGHZKHUGG-QAPCUYQASA-N 459.814 0.928 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1839154052 ZTFIEJCZZHYQIB-HUUCEWRRSA-N 465.252 0.785 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200939 SRBIMCVINSABCB-CXAGYDPISA-N 459.272 0.167 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)CCO2)C1 1839203909 ADNXKKXFPYPDPD-CKJXQJPGSA-N 477.986 0.736 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2 1839962577 KVZYFJVMESIBIK-BEFAXECRSA-N 462.385 0.923 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ncccn3)C2)C1 1840031960 HUUQHSIJQWDEFZ-SUMWQHHRSA-N 459.366 0.809 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C2)C1 1840152241 BZKSVRGEAJEHDJ-IIBYNOLFSA-N 475.970 0.564 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ccncc3)C2)C1 1840182527 LRNYLSIMWMKAJA-OAQYLSRUSA-N 465.576 0.003 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840333528 BOROXOCFEAYHRS-OSPHWJPCSA-N 482.541 0.029 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1 1840484111 ZCSIGQWMKYTLEO-IFXJQAMLSA-N 456.337 0.838 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(F)(F)F)CC1)CCO2 1840821643 IFGGNSJYKRTYME-ZJBJCVSYSA-N 498.307 0.805 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@H]1F)C2 1843428584 CETDGQBCYWNHTG-FHWLQOOXSA-N 489.353 0.364 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)[C@@H](O)C1 1843981165 BMQLQRLUSKCTCY-AVYPCKFXSA-N 459.971 0.798 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccccc1F 14800916 UOAWYXNHXHBUDH-INIZCTEOSA-N 457.505 0.369 50 20 JCGD O=C(CN1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1)NCc1ccccc1 728958666 DTLFPKYYBAHFPF-UHFFFAOYSA-N 480.573 0.368 50 20 JCGD CCn1nc(C(=O)NNC(=O)C2CCC(NC(=O)COCCOC)CC2)c2ccccc2c1=O 748697855 XVZKADWHTAQIFH-UHFFFAOYSA-N 473.530 0.515 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C[C@H](C)O1 912919324 LXPVHAGONDISDR-STQMWFEESA-N 482.481 0.510 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1 914749882 NAMDMKGAZFETHX-UHFFFAOYSA-N 461.500 0.674 50 20 JCGD CN(CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)S(=O)(=O)c1cccnc1 915133188 NGWGZMDXWDQXNF-UHFFFAOYSA-N 460.560 0.062 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1c[nH]nc1-c1ccncc1 916092976 SHIBUTMSMMIXKW-UHFFFAOYSA-N 484.538 0.886 50 20 JCGD Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 916124773 LNDNLATXCKLUIH-QGZVFWFLSA-N 450.434 0.613 50 20 JCGD O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccc(Cl)cc1 916516347 LJZYLZLSUQLVFS-UHFFFAOYSA-N 466.951 0.831 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)CS(C)(=O)=O)ccc1Cl 919692963 SKNZHHVFSAVTPM-UHFFFAOYSA-N 475.932 0.955 50 20 JCGD O=C(CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21)NNC(=O)c1csc(N2CCOCC2)n1 921302529 XNTWRYIRRLOJND-ZLDLUXBVSA-N 454.578 0.467 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cncn3-c3ccccc3)CC2)cc1 1115866004 PIEYUHYUCLULFL-UHFFFAOYSA-N 482.566 0.948 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)nn1C)C2 1778091460 RBKYBUQBDQZBGJ-LVGVVDSRSA-N 469.546 0.990 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1 1778634803 RMWXRYIBDGXYSW-JOCHJYFZSA-N 467.461 0.458 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1779028836 PEDRTYKGFUAILZ-HSZRJFAPSA-N 452.515 0.465 50 20 JCGD COc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc(F)c1F 1779037138 PQVQZZWCPVAPDP-JOCHJYFZSA-N 475.452 0.729 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4cccn4)cc3)CCO2)C1 1779037370 YKUHELKEKIHHNO-DEOSSOPVSA-N 475.509 0.628 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3ccnc23)C1 1779055714 ODXFSBYSIIRMKR-NTKDMRAZSA-N 477.525 0.774 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C(=O)c1ccco1)CCO2)NC(=O)NCc1ccccc1 1780968177 BFXNKDJPOKTRAY-DEOSSOPVSA-N 483.525 0.638 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)N(C)C(=O)OC(C)(C)C 1781037584 GTTANIBYKLFBQZ-WAIKUNEKSA-N 475.351 0.065 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3c(O)nnc13)C2 1782173189 ZSTYNOHUGHIANL-BXTJHSDWSA-N 451.911 0.816 50 20 JCGD COc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1F 1783090835 NLPKXZZVSCDTHY-HYBUGGRVSA-N 470.306 0.955 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C#N)c1 1783934426 GXYJDXRMSXNCAT-HSZRJFAPSA-N 457.531 0.312 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)[C@H]3SC(=N)NC3=O)C[C@@H]21 1783965751 OQPUQXILFLRBRR-NKTODWNOSA-N 475.409 0.800 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1F 1784096535 ZUYJNEDTTYQSJD-SDADXPQNSA-N 462.927 0.422 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3ccnc3)C[C@@H]21 1787508058 BAFVTGPCMALVPO-GFTQFONFSA-N 469.546 0.633 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C[C@@H]21 1788607873 QWFYHZHUJULIPD-VHHKXPHXSA-N 492.536 0.472 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccnc3)C[C@@H]21 1788610161 GWVMPBHDSCQULK-VDGAXYAQSA-N 452.515 0.306 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccnc(Br)c1 1788821336 OOKLATSNICADSD-SZMVWBNQSA-N 488.147 0.431 50 20 JCGD COC(OC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1 1789220690 FAVLFOSRXITSMW-OWQGQXMQSA-N 465.459 0.732 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1 1789221812 GYGPMNZQRGNFOY-VQUGOPFGSA-N 488.497 0.804 50 20 JCGD 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CC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1823790104 VYGIOFGTRGCISB-UXHICEINSA-N 458.563 0.833 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4c3CCC4)sc2C1 1824049769 HCQSJNJXQVPDIK-NSHDSACASA-N 466.527 0.824 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)[C@H]1SC(=N)NC1=O 1826086543 XQWQUCMRGZMKEM-FEUHOPSXSA-N 481.604 0.231 50 20 JCGD O=C(C(O)O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1828525662 UOQYCIQVOYJWBV-IBGZPJMESA-N 460.314 0.553 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)N1CCN(C)CC1 1830238249 NAUFOPLDFQVHNM-WMZHIEFXSA-N 470.423 0.236 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc([N+](=O)[O-])c1OC 1830736428 SKMQLXOWTJTPIZ-MGPUTAFESA-N 487.893 0.282 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2)C1 1831638098 ASXLDXLRHNOKNK-CKJXQJPGSA-N 477.986 0.736 50 20 JCGD C[C@@H](CC(N)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 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JCGD COc1cc(OC)cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1836277322 YHROECSTDDUMCJ-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3Cc4ccccc4C3=O)CCO2)C1 1836593673 BXKOSNYANJIOIU-CVDCTZTESA-N 479.961 0.743 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)CCO2 1836797004 HIABRURTDNJJAB-DEOSSOPVSA-N 499.279 0.510 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)n1ccccc1=O 1837684372 QTOBLDHAYLXQRA-BEFAXECRSA-N 456.337 0.651 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)nn1 1837714477 IDIVCXUSBBFEAQ-FQEVSTJZSA-N 453.616 0.955 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837868409 WZZAZPUNKZOYLP-UHFFFAOYSA-N 470.379 0.260 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3nc4ncccn4n3)CC2)CC1 1838226994 FNTWYPWMVSSACO-UHFFFAOYSA-N 472.550 0.110 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1839153369 XRDYZCIQQHANDS-ZWKOTPCHSA-N 457.318 0.431 50 20 JCGD COc1cc(C)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839256550 JAEWCVKJJILUGY-QHCPKHFHSA-N 462.547 0.447 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2 1840139025 IFQXHVVAJNWGKS-HYBUGGRVSA-N 474.558 0.210 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1 1840153052 BJIYMKWIBBBKGY-KXBFYZLASA-N 472.329 0.707 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840182249 AKVGBSAOWXEFSL-BPYKYCOYSA-N 488.585 0.628 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cnccc4[nH]3)C2)C1 1840184289 GWDBDKKFFOLXKS-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3CNc4ccccc4O3)C2)C1 1840184423 LLSIDJYPATUZPP-HOYKHHGWSA-N 489.573 0.079 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1843417064 RUSZQYKBZXZIJJ-OEAKJJBVSA-N 469.458 0.094 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1F 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O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=S)NCCc1ccccn1 726122167 RBNILIQDZLIYTD-UHFFFAOYSA-N 477.612 0.773 50 20 JCGD Cc1ccn2c(=O)c(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)cnc2c1 728214636 CUGYNLWFUPJFNC-UHFFFAOYSA-N 456.528 0.696 50 20 JCGD O=C(COC(=O)COc1cccc(NC(=O)C2CC2)c1)NNC(=O)[C@@H]1COc2ccccc2O1 728323032 RMEPKEJRQFHAPM-IBGZPJMESA-N 469.450 0.945 50 20 JCGD O=C(COC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1)NNC(=O)[C@H]1COc2ccccc2O1 728341810 GMSFFXFIHMDUOP-OAHLLOKOSA-N 492.370 0.825 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)cc1 729276013 VIRCJIQKNKOLDH-CYBMUJFWSA-N 484.556 0.585 50 20 JCGD C[C@H]1CCC[C@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 731214694 WCCBWAMWOCFMRN-WMZOPIPTSA-N 460.535 0.668 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1 744446719 LGDHMNGHXRMQBK-OKILXGFUSA-N 454.549 0.647 50 20 JCGD CC(C)(C)OC(=O)NCCNC(=O)[C@H]1CCCN(CC(=O)NNC(=O)c2ccc(F)cc2)C1 747089578 FLNBUTLTZWVYNL-INIZCTEOSA-N 465.526 0.940 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1 747623105 IVRDRIBPZOTCDH-UHFFFAOYSA-N 479.559 0.754 50 20 JCGD CSCC[C@H](C(=O)NNC(=O)CNC(=O)c1cccs1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 751208620 GYLRYPDBRQEPLR-HZSPNIEDSA-N 466.585 0.922 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1 810557475 QXMNTPTXERPYFG-HNNXBMFYSA-N 483.593 0.691 50 20 JCGD C[C@@]12CCC(=O)N1[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)CS2 912642985 YLQWPXFSTQFERB-DNVCBOLYSA-N 452.558 0.686 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)c1 912924858 UUKWZMLLDUACLA-GJZGRUSLSA-N 454.549 0.204 50 20 JCGD Cc1c(/C=C(\C#N)C(=O)OCC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc(C#N)n1C 913286813 KAKMSUSDNNOGCN-RQZCQDPDSA-N 455.496 0.662 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cccc(O)c1O)c(=O)n2Cc1ccccc1 916333803 VSPCBEDSCMCUNU-UHFFFAOYSA-N 492.492 0.616 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 918001694 FYLAAJKBJGVTTR-UHFFFAOYSA-N 497.578 0.003 50 20 JCGD CCN(C1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1)S(C)(=O)=O 1318364790 PIUXUZWMYCKLCB-UHFFFAOYSA-N 453.569 0.180 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1778382988 YDPQDZPESILHFR-KZULUSFZSA-N 454.325 0.244 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028918 KQKWKTLGCGZKPM-VWLOTQADSA-N 495.536 0.548 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779032528 RMPHZOYEWMOESC-DEOSSOPVSA-N 480.525 0.330 50 20 JCGD C#CCCCC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969094 VAIBTZHUSONNQI-DEOSSOPVSA-N 455.559 0.966 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)CC1(O)CCC1)CCO2)NC(=O)NCc1ccccc1 1780970832 ZTTAZYWEGLIFCZ-XMMPIXPASA-N 473.574 0.468 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1781395660 OTTBHWAXBFUWOK-NTKDMRAZSA-N 488.589 0.963 50 20 JCGD O=C(C1CCN(c2ccc(F)cn2)CC1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1782797257 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NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnn3-c3ccccc3)[C@H]2C1 1787769609 ACIHJURIFKHUAI-BUKVSMQUSA-N 489.536 0.778 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1788225886 UMKKRQNIWVSGFL-DQKQSUEQSA-N 477.961 0.915 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21 1789933876 DODSYBDIGALQNB-SMSYFYOWSA-N 451.923 0.776 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccnc3C(N)=O)C[C@@H]21 1790961293 YOPCCCVQJWZRLW-RVMXOQNASA-N 454.325 0.342 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791291225 OXXPFWFECOCTJD-ULQDDVLXSA-N 457.535 0.004 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCOCC2)cn1 1794441968 DORMZVZRJXJLKZ-UPHUGPLXSA-N 462.623 0.973 50 20 JCGD CCn1nc(C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1796132804 ADAZBJHHCDYULZ-JHDGKUDLSA-N 497.600 0.761 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)C(=O)CC3)C2 1797753691 DIZBXASNRBSJLR-VPTLXERWSA-N 463.494 0.331 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1797894199 FONXVWQMOVIOSZ-KSWRQPAISA-N 484.985 0.636 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@@H]1CCCN(c2cc(NC3CC3)ncn2)C1 1799055617 RMUPIKXTFWYTCR-FYNPAFEHSA-N 493.008 0.457 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1S)C2)NC(=O)NCc1ccccc1 1799095406 REYUDKMXELIWRW-RMFSNUHRSA-N 498.609 0.920 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(-c2ccc(O)nn2)cc1 1799840321 VXEXRCVMZZVFQS-BBIADKPPSA-N 488.309 0.046 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2sccc2c1O 1800017756 DZZIXYUJNOECKS-YVWYUNDQSA-N 466.324 0.804 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1800639912 QOLORVSIBYJQFR-SVQFQIBWSA-N 468.352 0.884 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)C2 1801011588 UVSKKCAEPOCMIX-WOUAJJJCSA-N 497.637 0.888 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1801157398 JSRBHAWCIWDKNG-JTTNIQEDSA-N 459.927 0.102 50 20 JCGD COc1ccc(Cl)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1801663181 PDQAPPOTWCLZHB-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)CC1 1804083222 FQFFHTSTYMOSDP-YVSFHVDLSA-N 458.987 0.777 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1 1806042084 BKTZQDRTTMJRIV-OAHLLOKOSA-N 465.576 0.211 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ncn(-c2ccccc2)n1 1808548818 WNFFOSXQHYEDJY-REWPJTCUSA-N 496.336 0.976 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1 1810181234 CDOKLSLCJINDRR-CXAGYDPISA-N 494.430 0.505 50 20 JCGD O=C(COC(=O)C(F)(F)F)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810182986 PLUGKTDNGXFGQD-MAUKXSAKSA-N 479.220 0.187 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2)[C@H]1c1cccnc1 1810294737 MYVUNRBFJCBMBV-UWJYYQICSA-N 451.531 0.496 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1 1810303304 QBVUGJNJACJCKR-OXJNMPFZSA-N 481.513 0.242 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnc2c(c1)CCNCC2 1812378813 DYVOTOKIPCDASC-BWKNWUBXSA-N 499.380 0.478 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2ccc(O)cn2)[C@H]1c1cccnc1 1813499814 WDCCWEKJGQQUSQ-GAJHUEQPSA-N 454.531 0.804 50 20 JCGD O=C(CNC(=O)c1ccco1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815340834 PGGQSSIRULCOTB-CQSZACIVSA-N 468.300 0.072 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CNC2=O)n[nH]1 1815595122 NFVJOMNDMNPYGA-PWSUYJOCSA-N 455.313 0.985 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CC(=O)NC2=O)n[nH]1 1815665392 QXVSKFHOOWCQDO-FCUAXUHVSA-N 483.489 0.088 50 20 JCGD COc1nccnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1816156958 CPYPSRSKLIHHHN-INIZCTEOSA-N 450.264 0.508 50 20 JCGD N[C@@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)c1cccnc1 1817471109 DTEDMWBCGCGPJQ-ICSRJNTNSA-N 462.319 0.881 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccnc3c2OCO3)[nH]n1)c1cccc(B(O)O)c1 1817477030 WECJEFUFYMNYKN-QGZVFWFLSA-N 463.259 0.833 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(=O)c1ccco1)CC2 1819793796 SZJLQTKTPQPHGF-SNVBAGLBSA-N 454.468 0.843 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(-n2cccn2)nc1 1820735440 UEQCEXIHLATNGR-QGZVFWFLSA-N 488.338 0.943 50 20 JCGD C[C@H](NC=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)[nH]n1 1820882847 GSKMZUSMRGHKBV-QFBILLFUSA-N 484.561 0.883 50 20 JCGD O=C(NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccco1 1827184023 XVWGBJAUSFSAPD-HXUWFJFHSA-N 467.331 0.623 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN(CCO)CCO)CC1 1827679800 VTXPIBUWAWFNBG-AFDYPQSWSA-N 490.605 0.027 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1830538685 MPJQADFGRXRCOM-SCLBCKFNSA-N 467.324 0.225 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)C1 1830717865 MDKKDEDDDGVTBQ-ZTENYAIWSA-N 461.353 0.816 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830737913 KKOKBEHHBZADHG-XFQAVAEZSA-N 475.970 0.442 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831650359 GSUNHBHEPRCHFE-OXQOHEQNSA-N 453.927 0.163 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CS(C)(=O)=O)CC2)CC1 1833262475 QRLJBWRESRBBHA-CYBMUJFWSA-N 452.415 0.634 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccc(C)n3)CC2)CC1 1833854007 UJGOUVKAEJMHAN-OVVQPSECSA-N 482.589 0.897 50 20 JCGD Cc1cccc(CCC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834797311 CFXRSQRFCKALKE-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n(C)n1 1834801242 SGSFYNJWFRDSQZ-UHFFFAOYSA-N 467.379 0.161 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835440973 MHXWXXBEMKQWSB-APWZRJJASA-N 462.385 0.196 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCSC(=N)N)CCO2)C1 1835643640 HKULEASSGIYJAU-WBMJQRKESA-N 451.387 0.491 50 20 JCGD N[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1cccnc1 1835834397 MMBHKMQCODNZNG-QGPMSJSTSA-N 459.316 0.618 50 20 JCGD COc1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ccc(F)c1F 1835931982 JSHMIABNWUARCH-QHCPKHFHSA-N 490.268 0.037 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4nscc34)C2)C1 1835932129 PCTCOILIJADTDD-QHCPKHFHSA-N 481.339 0.360 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1 1835937137 QESPNXLXQWIBBJ-RUZDIDTESA-N 475.310 0.298 50 20 JCGD Cc1ccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)s1 1835939652 CSMATAPJUPZRCD-NDEDVSTASA-N 470.356 0.520 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2 1836623931 AYEFFKPBWOEMGJ-SFTDATJTSA-N 484.280 0.354 50 20 JCGD CCOc1cnc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1837274440 VSESVRQDQDZJRS-UHFFFAOYSA-N 482.346 0.481 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nnc(-c3ccccc3)o1)CCO2 1837539251 LEWRHUADYNNUSO-QHCPKHFHSA-N 486.529 0.180 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(-c3cccs3)on1)CCO2 1837984143 NXSNPKNYAVQSFF-QHCPKHFHSA-N 497.338 0.467 50 20 JCGD O=C(c1cc2cccnn2n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1838427124 WTJDONSSMNMZKQ-RHSMWYFYSA-N 456.272 0.490 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201170 YNHGJKDCPOPPHB-CAFIBCOWSA-N 466.304 0.662 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CCO2 1840119706 PCEVUBSTABCKJC-DFIYOIEZSA-N 479.537 0.559 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](NC(=O)OC)c3ccccc3)C2)C1 1840149243 JRLJHUCLGNRANY-HMFYCAOWSA-N 483.949 0.794 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840184273 GGRXONBJIRFVON-DEOSSOPVSA-N 489.573 0.017 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnn3)CCO2)C1 1840408172 LEVLRODMTZZOII-KSSFIOAISA-N 457.325 0.343 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263170 BECCYDPLCWINMN-AWEZNQCLSA-N 460.535 0.663 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)C2(N3CCN(C)CC3)CC2)C1 1845102095 MGIMWSVWMHNSMI-KOEQRZSOSA-N 455.563 0.104 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)C(C)(C)S 1846301588 ZYDUILUCXCGLSG-QGZVFWFLSA-N 491.419 0.785 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)c(F)c1)C2 1846386464 PNDAOJBEMHPZHE-UHFFFAOYSA-N 454.524 0.419 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1 1847556423 KMEQDDIDEFIWQM-NXOAAHMSSA-N 467.954 0.976 50 20 JCGD Cc1ccc(C)c(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)c1 17203331 GSDDLBSNXKPVHS-UHFFFAOYSA-N 450.517 0.503 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(F)cc1 25376372 XYRRJQOYRFGGQF-UHFFFAOYSA-N 471.536 0.557 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)n2C 27144227 JCCCKDJVXHAHCN-AWEZNQCLSA-N 499.615 0.119 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCC[C@H](C)OC)N(S(C)(=O)=O)CC2 726713603 JNHJWFFRRVUZHJ-XJKSGUPXSA-N 472.564 0.708 50 20 JCGD CC(=O)Nc1nc(C)c(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)s1 727351162 HAPBRBVRBWLPJC-UHFFFAOYSA-N 460.563 0.635 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)cc1 727799846 VCXZNFQGKMCZAK-CQSZACIVSA-N 480.465 0.926 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)C1CCN(c2ncccn2)CC1 728889892 SINGPPGZLASWEH-UHFFFAOYSA-N 472.571 0.914 50 20 JCGD Cc1c(NC(=O)[C@H](C)SCC(=O)NNC(=O)C(=O)NC(C)C)c(=O)n(-c2ccccc2)n1C 744447053 UHVDUAZFNRZMCY-AWEZNQCLSA-N 476.559 0.217 50 20 JCGD CON(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 746250142 LXSXFXIHEIKGSC-KRWDZBQOSA-N 479.467 0.013 50 20 JCGD CCc1ccccc1OCC(=O)NNC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O 871638113 WCACLXUVMBGXSA-UHFFFAOYSA-N 464.544 0.668 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CN1CCCCCC1=O)N(S(C)(=O)=O)CC2 913161639 RWOKKCALAYTQCQ-KRWDZBQOSA-N 496.586 0.503 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2 916148589 IQLQWDMXUKASMA-KRWDZBQOSA-N 491.522 0.949 50 20 JCGD CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2S1(=O)=O 916746330 LIWROYXCQKDDBQ-UHFFFAOYSA-N 479.540 0.607 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)NC1CCOCC1)c(=O)n2Cc1ccccc1 918233126 CSVOOUINTHHSIG-UHFFFAOYSA-N 497.556 0.573 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)c1 919809158 ATKUJBXMMJFEDI-UHFFFAOYSA-N 470.555 0.864 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2n1 1777779560 INGHPPVEOVTEGA-QFIPXVFZSA-N 457.535 0.163 50 20 JCGD O=C(c1nc2c(=O)[nH]c3ccccc3n2n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1778055586 LBAJOXSGKBEBBC-ORAYPTAESA-N 493.293 0.705 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn(C)nc2C(F)F)C1 1778360273 ISIIYHNCWXGJPD-QVKFZJNVSA-N 470.521 0.858 50 20 JCGD CC(C)Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n(C)n1 1779030477 QVACTNOEWMKHRL-HSZRJFAPSA-N 469.546 0.374 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c12 1779036589 BBKBJHKICGNJNC-XMMPIXPASA-N 478.509 0.932 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1 1779120703 RGJONRQRBNGLQA-SGTLLEGYSA-N 457.325 0.574 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3c2OCCC3)C1 1781259831 CAXXTOKFKPEQRI-KBDRGJQMSA-N 497.556 0.927 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1783348345 YXZHGZCZFCGCLA-PBHICJAKSA-N 466.398 0.415 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc2cc(F)ccc2[nH]1 1788269499 ZMIJFHAZDHRLPA-OHEPNIRZSA-N 465.290 0.894 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1 1789657677 BFQCPYIRXZDPNS-LJQANCHMSA-N 468.514 0.584 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(C)c1 1789673323 LJXPWDSGRWWRQZ-HSQYWUDLSA-N 452.316 0.591 50 20 JCGD COc1ccc(COCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1 1791384703 MWUWLAYNZZZTBC-JBACZVJFSA-N 476.574 0.565 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1S)NC(=O)NCc1ccccc1 1792502340 MMDUPTBCKHPSOW-RMFSNUHRSA-N 498.609 0.920 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1792780739 VMFVXWQLMVSXBS-ULYCIKHUSA-N 486.338 0.446 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCO)NC(=O)OC(C)(C)C 1793087438 FVNLBINQHWAIHA-QRJUGERDSA-N 463.959 0.106 50 20 JCGD O=C(CCc1cccc([N+](=O)[O-])c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793699784 CRQWEIBYYPWBBI-OPMZPASUSA-N 467.287 0.111 50 20 JCGD COc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)n1 1794013084 ULANBAQIMPLDSW-HNAUYISWSA-N 482.541 0.746 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ncc(OC(F)F)cc1Cl 1794401799 OFRWICHNOXXKSW-FVCICTRLSA-N 495.675 0.533 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)c(F)c1 1795296732 CHBPQCFTIFHHLU-VTEUUUEMSA-N 459.453 0.409 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc2cc(Cl)ccn12 1796058284 ZPNVPLQJNMJPNB-YVWYUNDQSA-N 468.706 0.185 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCCN1C)C2)NC(=O)NCc1ccccc1 1799095332 NZIDJVXEILKOOL-ADYITMSISA-N 486.617 0.407 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)C1CN(C(=O)OCc2ccccc2)C1 1800441764 YLKBFJBDXYTAER-FCGDIQPGSA-N 465.934 0.444 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC[C@H]1CCOC1)NC(=O)NCc1ccccc1 1801576870 HBIGQUOZVRVOCX-JCUDRXCFSA-N 487.601 0.739 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)CSC1=S 1802105167 XZDJBVYWUNQNKY-DYNIEEOBSA-N 464.407 0.467 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1CCN(C(=O)C(O)O)[C@H]1c1cccnc1 1804239199 HXXPFPNRSAYPTQ-KKUMJFAQSA-N 456.927 0.530 50 20 JCGD O=C(CC(F)(F)C(=O)O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1808288448 ZEBWRLGDVUTBMK-YJBOKZPZSA-N 461.230 0.191 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc3c(c2)CNC3=O)[C@@H]1c1cccnc1 1810301696 AGECJXZBANSXRE-HTAPYJJXSA-N 499.531 0.957 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1 1810303466 SHLLOWZWLMZYJL-MGPUTAFESA-N 482.932 0.950 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810305397 LDZDNIKMYXFZTH-MOXGXCLJSA-N 465.514 0.021 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccncc2O)[C@@H]1c1cccnc1 1810665038 SWXCDLMOSYZQHD-QRWLVFNGSA-N 461.482 0.814 50 20 JCGD CCOc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1 1811627559 NNSHXDRQPIEGDS-VGOFRKELSA-N 469.546 0.963 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3nccc4nc[nH]c34)sc2C1)c1cccc(B(O)O)c1 1816898984 ZLWYHEYQIRTAPW-ZDUSSCGKSA-N 462.300 0.634 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cn4ncccc4n3)sc2C1)c1cccc(B(O)O)c1 1818460336 WKPMCPDVEJOBNM-CQSZACIVSA-N 462.300 0.405 50 20 JCGD C[C@H](Cn1cncn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819538327 NGPNYUNRSPKSJI-KDOFPFPSSA-N 451.296 0.323 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)nn1)CC2 1819795359 LVSSOVWRQBXRGB-VIFPVBQESA-N 454.472 0.177 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cncc(O)c1)CC2 1819800375 OAKNWVLIBHSROJ-NSHDSACASA-N 453.484 0.782 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3ccnc4c3OCO4)sc2C1)c1cccc(B(O)O)c1 1821232787 ZOJMMQBMMXYHKO-ZDUSSCGKSA-N 466.284 0.486 50 20 JCGD CC(C)(C)n1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)nn1 1821632029 VIFAOTCIYBMOTC-CQSZACIVSA-N 468.348 0.709 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827055014 NVVKLVSKZFDLKP-FCHUYYIVSA-N 457.380 0.905 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1828127043 OAUTWXQZUFZJIP-MLGOLLRUSA-N 473.559 0.672 50 20 JCGD COC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828550805 BOBHJKHBOQYSDK-JTSKRJEESA-N 496.948 0.394 50 20 JCGD CN(C)CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828854589 SAVSGNDRWUGEFK-AVRDEDQJSA-N 466.966 0.600 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725766 RSEQSBXLNYIDSW-HRAATJIYSA-N 469.922 0.317 50 20 JCGD O=C(c1n[nH]c2c(Cl)cccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830735289 FTRUXVCWBHVXSH-KUHUBIRLSA-N 457.314 0.886 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1830885770 KMBUBVPLAYDWBH-ORAYPTAESA-N 484.377 0.522 50 20 JCGD O=C([C@@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)CCO2 1831522430 ALUFIVXIPSPZHJ-LAUBAEHRSA-N 465.934 0.461 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1831651477 PMJFPZWFSGAIMC-GCKMJXCFSA-N 467.954 0.459 50 20 JCGD CC(F)(F)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831683216 TVEOAUOWHOLXAH-OAQYLSRUSA-N 469.489 0.437 50 20 JCGD COCCOCCOCCOCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1 1831731395 JWBWSYFLQQBHAJ-VQTJNVASSA-N 479.014 0.902 50 20 JCGD O=C(c1cnc(OCF)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1833573245 ZHAVKLMKRQAZIY-BBRMVZONSA-N 465.251 0.543 50 20 JCGD CC(=O)c1cc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n[nH]1 1834068877 NERULNCALNLKHN-UHFFFAOYSA-N 461.567 0.171 50 20 JCGD Cc1nc2ccccn2c1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834799965 JBMDAWUZIRNTLK-UHFFFAOYSA-N 489.385 0.822 50 20 JCGD Cc1ncccc1CCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800104 WEGUDRRQKBLCRY-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCC3=O)CCO2)C1 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C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCC4)CCO2)C1 1837088220 BXKLIVBERHXGOV-AUUYWEPGSA-N 455.353 0.930 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4scnc4c3)C2)C1 1837459992 YCMBNNLGAYXGFF-HSZRJFAPSA-N 496.549 0.679 50 20 JCGD N[C@@H](CC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccnc1 1837896059 AIGFHVSLOLBXTJ-QHCPKHFHSA-N 480.374 0.464 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc4cccn4cn3)CC2)CC1 1837920412 VXTMEZLMAMKULX-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD O=C(c1csc(C(F)(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838185762 DKPHJAGJSKKLPQ-NHYWBVRUSA-N 457.858 0.832 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CC(N)=O)C2)C1 1838527476 VWKINFPFCKOOCY-RCDICMHDSA-N 492.485 0.102 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(C(F)(F)F)c1)CCO2 1838935722 JTFFHIHGVZRJID-QFIPXVFZSA-N 492.259 0.769 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COCCNC(=O)OC(C)(C)C)CCO2)C1 1839139339 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CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4[nH]ccc4n3)C2)C1 1840184589 WGANWRCQJCZJFD-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2 1840284833 KPWSZQQVOVXVFJ-UXHMZNKVSA-N 461.853 0.408 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)CCO2 1840747929 QJQLSDZQGNVGIY-DEOSSOPVSA-N 484.557 0.520 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CCCN2C(=O)c3ccccc3C2=O)C1 1841914535 CNTQZEZPSZWFRA-UHFFFAOYSA-N 469.542 0.639 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2 1843415518 VFJDIXUPSNKDMT-CIRUFVMISA-N 490.561 0.600 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846124733 DYPXOSNFYSBNJO-DEOSSOPVSA-N 489.353 0.923 50 20 JCGD C=CCN1C(=O)c2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2C1=O 9701500 KSLRAPLBFNJNOF-SFHVURJKSA-N 465.418 0.613 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1cc2c(s1)CCC2 14886721 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Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)cc1 920251288 IKMXVXQFANWTLX-KRWDZBQOSA-N 469.527 0.833 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779033681 BMIYBEYQMDYTOG-WAIKUNEKSA-N 453.499 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/N2CCCCC2)C1 1779363598 DWPVWHCISOLDPG-LUIQLVGOSA-N 450.584 0.345 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccccc1)C2 1779371264 YIIHRNAEIGUBGD-HYBUGGRVSA-N 467.526 0.892 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc3ncnn3c1)C2 1779374116 AVMPWLVZWQJNLA-NTKDMRAZSA-N 492.540 0.098 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc(Br)c3)C2)C1 1779401801 AGYVRDIPWGLPCQ-LJQANCHMSA-N 468.352 0.661 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COCCO)C2 1780055322 NLUOXMFOMDLICR-DENIHFKCSA-N 479.486 0.657 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(=O)NC1)CCO2 1780094741 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O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1785544853 BSLPWEGXFHGQAO-FZMZJTMJSA-N 454.343 0.367 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1786336081 RIOVOWPMWDJMAB-HNNXBMFYSA-N 473.360 0.442 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786986494 GYKYRKCWKVXBIJ-KNBMTAEXSA-N 472.734 0.936 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4O3)C[C@@H]21)c1cccc(B(O)O)c1 1786986665 WYUZKNOTNAUVNY-MHADKKCISA-N 464.327 0.354 50 20 JCGD CO[C@H](C)[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)N(C)C(=O)OC(C)(C)C 1789786590 LCEGSHJDFIKLIS-PXOUGSPUSA-N 492.013 0.836 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CN(C)C3)[C@H]2C1 1791795857 MITCHKCCPVWXBW-DCPHZVHLSA-N 460.487 0.675 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792982488 FHKWQTIJKMXFBO-ZHCJQAHYSA-N 459.971 0.869 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccnc1)NC(=O)NCc1ccccc1 1795242780 SVHDAQNSGMWARG-ACDBMABISA-N 453.547 0.868 50 20 JCGD N=C1NCCN1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1795581841 HWJIMBDEPNQFKW-SFNKJDCFSA-N 478.391 0.422 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](N)c1ccccn1 1795610260 OUTZPXKURQLQQF-YFUQURRKSA-N 481.981 0.803 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736243 QURJVWGMHCATNT-YVWYUNDQSA-N 471.250 0.239 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])cc2c1OCC2)c1cccc(B(O)O)c1 1799214572 IYTJSJPISNEMKZ-BCDXTJNWSA-N 465.271 0.775 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H](O)CNC(=O)OC(C)(C)C 1800182422 JVDYGABMLYHHSD-YVSFHVDLSA-N 469.583 0.273 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1CS(C)(=O)=O)C2 1800758478 ZWKFRZIWJSKGKG-NFFDBFGFSA-N 474.377 0.613 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1800759707 ZZEZZXBKAIPNEG-MHEUCROKSA-N 466.398 0.031 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1804219895 KQJMGOGMZOFQTE-VQQMMKBISA-N 496.543 0.823 50 20 JCGD CCc1[nH]nc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1805175427 NLIPZTVDRCZFNO-IERDGZPVSA-N 465.294 0.819 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365984 ZWJVMIFHCPNTKV-KNQAVFIVSA-N 484.325 0.746 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc2nc(CO)[nH]c2c1 1809113985 VCIILVPGEVJRIP-NTKDMRAZSA-N 499.336 0.763 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302164 HKIUKPZGRSACPE-LIVBEALHSA-N 467.530 0.267 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810476005 MWXOPXLYWJGNJR-OZOXKJRCSA-N 462.319 0.009 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1 1813069839 CRCFWSVFHUOBKM-FOIQADDNSA-N 469.502 0.262 50 20 JCGD Cn1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c1=O 1819793546 PQXNENGUMRUQSR-NSHDSACASA-N 467.511 0.380 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)CC1 1830248764 GWYULGWCIYPQOB-OAQYLSRUSA-N 476.666 0.759 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccc1C 1830733305 HZVFHUHNPPBHKE-WIYYLYMNSA-N 453.923 0.623 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1 1831281041 FMAUSTXEOFCPAI-PMACEKPBSA-N 462.377 0.177 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCC1(F)F)CCO2 1831716352 PKAWFVVUDUEOQS-GHTZIAJQSA-N 466.290 0.262 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833025327 CEZYQRZGZSRACM-QRQCRPRQSA-N 494.621 0.301 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cncc(F)c3)CC2)CC1 1834256371 VFNHZSXRAYKCNE-UHFFFAOYSA-N 469.521 0.718 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1834706717 DHUNWUXMEHPVJQ-MSOLQXFVSA-N 490.045 0.400 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834801515 RKSJZGIKEHWDPC-GOSISDBHSA-N 467.379 0.318 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1 1834819171 ITSQQJGJGMSQJA-QGZVFWFLSA-N 461.288 0.637 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3[nH]nc4ncccc34)CC2)CC1 1835022061 ZSMXDADCYABUBN-UHFFFAOYSA-N 491.556 0.455 50 20 JCGD O=C(CS[C@H]1CCCCO1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835757725 UMUIWGOXRGRRQV-QHCPKHFHSA-N 489.447 0.811 50 20 JCGD Cc1c(Cl)cccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934051 LLPKOPIJRRXEIR-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD COc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835935770 QIWQNDYWZDBINK-VWLOTQADSA-N 482.342 0.078 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1836357072 GOHLIVPHKYCBGH-UHFFFAOYSA-N 496.653 0.844 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836776823 PXAPDWLQXYPKGC-BTYIYWSLSA-N 467.954 0.494 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3[nH]ccc3n1)CCO2 1836908529 CCFHTQWEMLLBKZ-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)nc1Cl)CCO2 1837824365 PMURUSYBZBYSFW-OAQYLSRUSA-N 494.140 0.452 50 20 JCGD COc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1838293201 KVJZYXKDHREIHJ-VCOZGABYSA-N 489.554 0.961 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cn2[nH]cnc(=O)c12 1838472674 WONQIYIOLQRABJ-ORAYPTAESA-N 482.335 0.184 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2 1839072374 XQIVRWGFKZKYNT-ZOCZFRKYSA-N 475.970 0.706 50 20 JCGD O=C(c1cn2cccnc2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201060 QICDFEUPUDJUGN-GUYCJALGSA-N 456.272 0.490 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1c[nH]c3c(Cl)cccc13)CCO2 1839589035 GXAGOGSADUCRJD-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840085849 NXUNQQQWTQQISY-JIBKAZCMSA-N 492.548 0.677 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1 1840152661 PFPPYHSLPJVJMO-FOIQADDNSA-N 466.926 0.065 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1F 1840182562 GDWLTFVBQODINS-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1844284818 SMNSGPRDDWUSKT-HOTGVXAUSA-N 489.953 0.817 50 20 JCGD C[C@@H](C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1)n1cccn1 1845039514 WZDZHOAWIDWWKW-SFHVURJKSA-N 453.547 0.994 50 20 JCGD CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1csc(N3CCOCC3)n1)C2=O 12801807 SAJQFJYBLCKAFY-UHFFFAOYSA-N 464.548 0.632 50 20 JCGD C#Cc1cccc(NC(=S)NNC(=O)Cn2cc(S(=O)(=O)N(CC)CC)ccc2=O)c1 727500944 LZHVYBVOGGNFJE-UHFFFAOYSA-N 461.569 0.878 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)NNC(=O)[C@H]1COc2ccccc2O1 728341603 XAIHMQGODDPGRU-XJKSGUPXSA-N 495.535 0.432 50 20 JCGD O=C(CSc1nnc(-c2ccc(F)cc2)n1C[C@H]1CCCO1)NNC(=O)[C@H]1CCS(=O)(=O)C1 728378252 QPPGHMNGLLBIBL-GOEBONIOSA-N 497.574 0.937 50 20 JCGD NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728845156 DGEZTJVXWULAML-QKWWCAPFSA-N 491.552 0.644 50 20 JCGD Cn1c(CCC(=O)NNC(=O)Cc2cccnc2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 728852172 QCQRZKHSYLJXOR-UHFFFAOYSA-N 486.554 0.312 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)CC2(CC(=O)NNC(=O)Cn3nc(C)cc3C)CCCC2)n1 729838619 ZIFTUFUMKYRXNH-UHFFFAOYSA-N 486.577 0.649 50 20 JCGD Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 818373608 JVJVDVBEESHMIP-XLCPLWEUSA-N 482.428 0.649 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)OCC(=O)NNC(=O)c3ccccc3)c2)CC1 849202920 YHHFWTCETQMPJD-UHFFFAOYSA-N 488.522 0.157 50 20 JCGD CCCn1c(CCC(=O)N2CC[C@@H](B(O)O)C2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 864234334 QAVUKYUFVIFTKC-MRXNPFEDSA-N 478.380 0.475 50 20 JCGD O=C(COc1ccccc1Cc1ccccc1)NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 914830096 WNWRESWGVOZFDW-UXHICEINSA-N 485.562 0.839 50 20 JCGD O=C(Cn1cc(Br)ccc1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 914863887 JYURSXUSJXNKBC-UHFFFAOYSA-N 483.344 0.857 50 20 JCGD O=C(NCCCN1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 915880597 QQTUQDDJVOKHMR-UHFFFAOYSA-N 453.565 0.528 50 20 JCGD C=CCNC(=S)NNC(=O)[C@@H]1CC(=O)N(c2ccc(S(=O)(=O)N(CC)CC)cc2)C1 916559399 AVLYDUFFVIVNMC-CQSZACIVSA-N 453.590 0.751 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)n1 918093314 AAHZLHFJXRQYCZ-UHFFFAOYSA-N 457.535 0.691 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)NCCCOC)CC2)o1 920862339 ZCUTWZCNXGCRIX-UHFFFAOYSA-N 460.509 0.224 50 20 JCGD COc1ccc2nc(C(=O)N3CC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)ccc2c1 1777894849 RSYWQLXFDPALSI-RUZDIDTESA-N 490.520 0.999 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c2c1 1778504604 NOWBXIVJCXWUEP-DEOSSOPVSA-N 478.509 0.932 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3c2NC(=O)C3=O)C1 1779151696 MUIICUNFYMHETJ-MZNJEOGPSA-N 485.541 0.322 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(=O)n1O)CCO2 1780095712 UZVZPSSSDBGFDF-JOCHJYFZSA-N 486.437 0.676 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097724 GORZOAGVAFBTGE-FPTDNZKUSA-N 491.501 0.671 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCS1(=O)=O)C2)[C@H](F)Br 1780776864 LTMUBAGGLTUTOU-RSUWNVLCSA-N 455.346 0.768 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccn(C)n1)CCO2)NC(=O)NCc1ccccc1 1780968636 CRMZWMWZCNJSJR-QHCPKHFHSA-N 469.546 0.210 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(NC(=O)C4CC4)cc3)C2)C1 1781468019 YGZMBNXYQTZAHX-RUZDIDTESA-N 492.536 0.791 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CNC(=O)C2)C1 1781775515 XBBZBDWBJFCSQN-DUQZYUJVSA-N 486.997 0.769 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4ncccc34)C2)C1 1782338919 JZFPWSRVPFTMNQ-QHCPKHFHSA-N 461.482 0.386 50 20 JCGD Cc1ccn2c(C(=O)N3CC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)cnc2c1 1782488733 UPUAUBWEIYBFDG-HSZRJFAPSA-N 463.498 0.399 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1783355319 NWQZMXVXRMROQV-FZKQIMNGSA-N 471.308 0.760 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)C3=COCCC3)C2)C1)NC(=O)NCc1ccccc1 1784005095 AYYOZWQCJVTBPT-XMMPIXPASA-N 471.558 0.857 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(OC4CCOCC4)n3)C[C@@H]21)[C@H](O)CCl 1784091244 MAALGJQSTXANQH-WQCNXYOZSA-N 467.950 0.832 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc(OC)c1C 1785176625 ZHMAHJGZEOMVFM-DEOSSOPVSA-N 468.315 0.449 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c[nH]1 1786984470 JQYGPIRAFPJOQO-VDGAXYAQSA-N 453.348 0.899 50 20 JCGD CC(C)Oc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1C#N 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459.971 0.842 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(Cl)cccc13)C2 1797754066 SEVHFEBIZPUFCA-DPIQGUFMSA-N 483.916 0.732 50 20 JCGD CCOC(=O)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)ccn1 1799411413 UXBBRIJNOMLBPD-REPLKXPHSA-N 451.288 0.504 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNC(=O)c1ccc[nH]1)C2 1800640041 HLDMZFWXRMXHBC-LOUJCGABSA-N 455.353 0.898 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2 1800754543 RBMNHDGUAHNLSS-QNSTZXKLSA-N 464.357 0.245 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1 1802235340 IBBNVOZDVRNWCX-RBZJEDDUSA-N 490.395 0.995 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@]13C[C@@H](CO1)N(C(=O)OC(C)(C)C)C3)C2 1802338747 QNCRZPUFZUIGPD-IKJLZNBSSA-N 493.605 0.776 50 20 JCGD Cc1nc(O)c(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nc1C 1804874160 OUTSLEVEHDGKGT-OXQOHEQNSA-N 490.524 0.826 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807372975 LIIWIZBKLKRMHU-MOXGXCLJSA-N 469.303 0.643 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374161 DYUUNOWQVILIIV-DZFGPLHGSA-N 479.371 0.108 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)n1cccc1C=O 1807388011 NMINCLJCHRMWNA-MONBJTKQSA-N 474.326 0.956 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CCC(=O)N2C)[C@H]1c1cccnc1 1808416720 QOJMSRDMBMHJPE-LLIDZTPCSA-N 479.541 0.842 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808439161 IFHTXJWOFZSZBM-KNQAVFIVSA-N 465.315 0.590 50 20 JCGD CCc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n(C)n1 1810923019 BZFIGMALNQRUTK-GCJKJVERSA-N 461.331 0.691 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813073478 JAZZIQGQCHAXJE-XQBPLPMBSA-N 460.579 0.765 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813095889 PFLWKSKUJVCJJW-FUHIMQAGSA-N 451.593 0.574 50 20 JCGD CN(C)CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2 1813671369 KXRRQTSIXWCSIO-INIZCTEOSA-N 473.603 0.963 50 20 JCGD CCc1[nH]nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1F 1815337054 JSMFTNOOOZDHND-LBPRGKRZSA-N 457.296 0.787 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n[nH]1 1815822817 DSMFJPOHYBHHQP-OAHLLOKOSA-N 461.483 0.580 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)nc3sccn23)[nH]n1)c1ccc(B(O)O)cc1 1817472636 XNXBDUFHFFVORT-MRXNPFEDSA-N 492.326 0.779 50 20 JCGD Cn1nc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c2c1CCC2 1818471421 LTQIPUSFQBSTCV-AWEZNQCLSA-N 465.344 0.585 50 20 JCGD Cc1c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cn2[nH]cnc(=O)c12 1821222562 YWILRHRJRPWTQA-CQSZACIVSA-N 492.326 0.007 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1823125494 XCOHRHVZJRIHNH-HNNXBMFYSA-N 453.333 0.631 50 20 JCGD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)N1CCN(C)CC1 1828924583 SRINBKCPKGBVQH-AVRDEDQJSA-N 485.633 0.554 50 20 JCGD C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1829267292 SMRIPZPOOUDAHG-VWLOTQADSA-N 490.520 0.384 50 20 JCGD O=C(c1ccc(Br)cc1O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733540 OZQUKQUTPYUZMS-QAPCUYQASA-N 477.739 0.824 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C1(O)CCC1 1833068531 QFCWCTXCWLPHQT-MRXNPFEDSA-N 472.590 0.421 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Cn1cccn1)CCO2 1833197323 YMAWCMNBMJBFDH-HOHKMAOCSA-N 485.545 0.110 50 20 JCGD CCn1nc(C)cc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797966 QTQWCTQPAWRILX-UHFFFAOYSA-N 467.379 0.390 50 20 JCGD Cc1nc(F)ccc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798417 SKAKXUFACWLCSH-UHFFFAOYSA-N 468.338 0.708 50 20 JCGD Cn1nc2c(c1C(=O)N1CCOC[C@]3(CN(C(=O)CCBr)CCO3)C1)CCC2 1834824634 CSJBZLMFAXCARU-IBGZPJMESA-N 455.353 0.764 50 20 JCGD Cc1nccc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835219244 BBJOEIVGEXBKAZ-UHFFFAOYSA-N 466.546 0.283 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)nn1-c1ccccc1F 1836343578 SNXFWKGMJMVGTQ-GCJKJVERSA-N 496.923 0.690 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)CCO2 1836797005 HIABRURTDNJJAB-XMMPIXPASA-N 499.279 0.510 50 20 JCGD Cc1cnc2c(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](C)Br)C4)C3)cnn2c1 1836949904 HNVRNHOLOIDXCX-KUHUBIRLSA-N 466.336 0.891 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)CC1 1837079879 QZYYVVTVZNLWEQ-DEOSSOPVSA-N 494.353 0.819 50 20 JCGD CCc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457933 XDXRELSWJLRNLH-QHCPKHFHSA-N 468.514 0.026 50 20 JCGD O=C(COC(=O)C(F)(F)F)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919230 RXYXKXHNCVEVRC-UHFFFAOYSA-N 486.252 0.084 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n[nH]1 1837996190 LVGWOPGRHVBMQE-UHFFFAOYSA-N 469.546 0.897 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(Cl)s3)CCO2)C1 1838157956 DSTKRNQAQNAFJB-IBGZPJMESA-N 480.934 0.179 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838417996 SJCJIXWRYKQNQN-KPZWWZAWSA-N 485.360 0.609 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1839151919 IEEQFPMMRQSEIB-JKSUJKDBSA-N 450.279 0.624 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)CCO2)C1 1839450432 NNOFELUZTZVGBU-UWJYYQICSA-N 484.937 0.985 50 20 JCGD O=C1C[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)CN1 1839872375 WWGKZFFPBWIEKS-NPPFBWRTSA-N 494.386 0.585 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(NC(C)=O)c(O)c3)C2)C1 1840154852 HWIFMNXJWDPGIH-IERDGZPVSA-N 469.922 0.674 50 20 JCGD C=CCC(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1840174675 RLQYUTQZFJGMLB-HSZRJFAPSA-N 459.547 0.365 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnn3)CCO2)C1 1840409825 GMRUAYITBIEIAV-KDOFPFPSSA-N 457.325 0.485 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1 1840958200 VDJNFLRDXNANHK-PXNSSMCTSA-N 458.870 0.843 50 20 JCGD O=C(c1nn(-c2ccccc2)c2c1COC2)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011130 UNIJRTCUBFIWIE-UHFFFAOYSA-N 472.310 0.713 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843011883 GFLHJSBSEPNICU-SFHVURJKSA-N 471.363 0.831 50 20 JCGD O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014186 ITEMJFPDLPHRDX-UHFFFAOYSA-N 457.295 0.454 50 20 JCGD O=C(c1ccc(Br)c(O)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014757 YFPLOJMQFRFGGU-UHFFFAOYSA-N 459.105 0.965 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(CS(C)(=O)=O)nc2)C1 1843215570 IZPMBRKDWJUVIV-MFKUBSTISA-N 486.554 0.577 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)C2(F)CC2)C1 1845893141 QAJLZASRHLCBDW-SFHVURJKSA-N 489.353 0.508 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN(C)C1=NS(=O)(=O)c2ccccc21 20910784 BZGWPRKMMBBHQA-UHFFFAOYSA-N 478.556 0.130 50 20 JCGD Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1 728510451 ZCEPEYCKXOQFHQ-ZDUSSCGKSA-N 491.569 0.010 50 20 JCGD O=C(NNC(=O)c1cnn[nH]1)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1 729455835 BZRCRTUWOWMQPV-UHFFFAOYSA-N 458.456 0.842 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)c1ccc(-n2cnnn2)cc1 913155917 DSTNMJDHVFGHCL-KRWDZBQOSA-N 471.499 0.194 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)OC)cc2)c2ccccc2c1=O 917721720 FUQMXENLTAVYEB-UHFFFAOYSA-N 474.495 0.982 50 20 JCGD C[C@H](O)[C@@H](NC(=O)c1cc(Cl)ccc1F)C(=O)OCC(=O)NNC(=O)c1ccccc1 920263161 JMXAUEZEYMTAKO-APPDUMDISA-N 451.838 0.963 50 20 JCGD COc1cccc(CC(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1 921061335 GYYHZMCBQWRFST-UHFFFAOYSA-N 455.471 0.751 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)Cc1cccnc1 1318256060 DPSCBMHTVNFRNB-INIZCTEOSA-N 452.920 0.658 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3c(F)ccc(F)c3F)CCO2)C1 1779028693 IKYGIBYSSPTMFO-JOCHJYFZSA-N 477.443 0.789 50 20 JCGD COCc1c[nH]c(C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c1 1780078381 ROQNPJLLBSARDD-VWLOTQADSA-N 498.584 0.951 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1 1780342273 SVZXDDRHZNRIJM-DEOSSOPVSA-N 460.299 0.309 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)C3CCN(c4ccccn4)CC3)C2)C1 1780958997 XQAWQPLAWBGCFJ-VWLOTQADSA-N 478.358 0.122 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)ccc1O)CCO2)NC(=O)NCc1ccccc1 1780968426 KWNXPGUASMJSDF-RUZDIDTESA-N 497.552 0.888 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3ccnc3c1)C2 1782214270 JLUPNVVGWQFHCQ-WZONZLPQSA-N 456.547 0.835 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)n1 1783533684 FGVQGBWTHZNZKN-KUHUBIRLSA-N 455.353 0.900 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1 1783872808 HQKNBWOFTLKFLH-BEFAXECRSA-N 459.952 0.324 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)C1 1784014207 XNYXEYVIVWPSKX-ZNZDAUKMSA-N 494.358 0.879 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)C1 1784070336 TUZUAORYUIBKFY-VCTHZUDLSA-N 486.374 0.329 50 20 JCGD O=C(CCNC(=O)c1ccc[nH]1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1785246503 QBJHSGHNNJGXJO-DZKIICNBSA-N 455.353 0.899 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@@H]1CCc2nc(O)nc(O)c2C1 1785330548 HYCVHZVHNVIZCG-XBMQVOARSA-N 487.326 0.663 50 20 JCGD COC(=O)C12CCC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)(CC1)CC2 1786979642 GUPOZUYAJGEMSL-URDWGJOXSA-N 498.385 0.473 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3C(F)(F)F)C[C@@H]21)c1cccc(B(O)O)c1 1786983310 MUTCUCNYGCUHKR-FNHZYXHNSA-N 477.248 0.687 50 20 JCGD COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)c1 1788894831 PWAIMTCDCIAIHD-MDUUWBQSSA-N 468.514 0.818 50 20 JCGD CC(=O)N1CCN(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)CC1 1789215352 BEKQXTQVNJOKEV-UHFFFAOYSA-N 478.358 0.278 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCOC3=O)C[C@@H]21 1789221148 WUMPQPMITDRAKU-FNHZYXHNSA-N 490.469 0.566 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccnn3)C[C@@H]21 1789222393 YBEZENVMYOYFTJ-FNHZYXHNSA-N 472.458 0.405 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796192833 UDIBQVBVDPPGAL-KNJMJIDISA-N 489.353 0.966 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)ccc21 1796982809 FJDJGEYKKIPLRX-NOXHYTERSA-N 469.311 0.771 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1797955886 NWBJKZKUYATTTR-ALXJQNPVSA-N 461.657 0.099 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1nnc(C)o1)C2 1798522419 WRAQWPDGKGYSGC-VTEUUUEMSA-N 473.442 0.657 50 20 JCGD COCCOCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl 1799278683 VAFBHPQLBQHLDU-YNVMFWSZSA-N 485.405 0.509 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2c(c1)NC(=O)CS2 1800039465 WYUFMPYIBKLURA-OQMKEHIESA-N 454.936 0.583 50 20 JCGD CNC(=O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800433540 QYPMJPLLZDCOKC-YYAJDYIMSA-N 452.349 0.718 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCOC1)NC(=O)NCc1ccccc1 1802073641 KIHIVBITUCLIIQ-XWSHUIEDSA-N 473.574 0.349 50 20 JCGD Cn1c(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cccc1=O 1805309046 QRIGJEQHVZRXSE-PGRDOPGGSA-N 460.299 0.094 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC2(CCCN(C(=O)CNC(=N)N)C2)CC1 1809686820 RSKDCUALUUWEFA-AWEZNQCLSA-N 458.991 0.833 50 20 JCGD Cc1cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)nc2nccn12 1809973271 FINBSXTZYTZOKA-UHFFFAOYSA-N 461.331 0.876 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc2cccnn2n1 1811267336 OTZGRWDFUQBIIR-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)CC2)c1cccc(B(O)O)c1 1815361089 WMOJOMPFDNDHPA-USXIJHARSA-N 482.371 0.450 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1cccc(B(O)O)c1 1817478337 AARQRQRAUWGQJZ-HNNXBMFYSA-N 487.372 0.256 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2)n1ccccc1=O 1820128149 GVTHLAWDNLDLCX-STQMWFEESA-N 481.538 0.790 50 20 JCGD O=C(CNC(=O)C(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822441221 YTFZHQRKHSYVFC-AWEZNQCLSA-N 467.213 0.074 50 20 JCGD Cn1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1=O 1824714819 BBVCDQHFIINQHQ-OAQYLSRUSA-N 451.332 0.612 50 20 JCGD Cn1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)cn1 1828925005 CNNHRUPQHAXBQM-FQEVSTJZSA-N 453.547 0.895 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829041659 RCDLZKLALXKZNO-NRFANRHFSA-N 464.331 0.633 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830730831 DXWSTLDDFHSOOA-YLJYHZDGSA-N 470.910 0.331 50 20 JCGD O=C(c1cccc(C(F)(F)F)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731402 LGBNIGUMGNAIEE-SUMWQHHRSA-N 451.829 0.770 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1NC(C)=O 1830732998 ZISFJIMCTJWJJO-UTKZUKDTSA-N 469.922 0.323 50 20 JCGD COc1ccc2c(CC(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)c[nH]c2c1 1830814881 PIPOQZVZXLPDGC-UGKGYDQZSA-N 465.934 0.775 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1830836578 ZBGQVBLMWUBPPL-SIKLNZKXSA-N 481.908 0.592 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1 1831116886 SFGPNUHPGAKPCW-QGZVFWFLSA-N 462.551 0.554 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cncnc3)C2)C1 1832549634 VSJNVHSNIRWATO-JTSKRJEESA-N 497.980 0.608 50 20 JCGD O=C(c1ccc(N2CCOCC2)cn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1833615520 ZIFYCOCJLZVPKU-YLJYHZDGSA-N 456.902 0.523 50 20 JCGD COC1(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)CCC1 1835737273 DCZIDTJOFXYLEI-UHFFFAOYSA-N 472.590 0.830 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931005 CLLDESRJRXPSGP-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1 1835937905 ATTHSMMUALCFCN-NRFANRHFSA-N 493.247 0.164 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835939986 ROCLKIMRSGIBQO-DRUWVYPFSA-N 480.326 0.158 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CO4)CCO2)C1 1836994935 VNMRHQGQHRGMFY-QVKFZJNVSA-N 467.906 0.341 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)N1CSCSC1 1837569552 MARJGZVCUVQDCS-CPUCHLNUSA-N 454.014 0.086 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccn4nccc4c3)CC2)CC1 1837921298 WIFXDISKCNNGPI-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cn4ncccc4n3)CC2)CC1 1838243863 JUTSQRJJAMYYKO-UHFFFAOYSA-N 492.540 0.654 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CCN3CCOC3=O)CC2)CC1 1838274233 BTSJLWWLZAJGCA-UHFFFAOYSA-N 488.545 0.140 50 20 JCGD CCOc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838885520 XWMOJOUPVWRHTH-DEOSSOPVSA-N 483.525 0.468 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CCO2 1839082866 RZBOZUGCXGNAOL-FGSXEWAUSA-N 467.639 0.695 50 20 JCGD Cn1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c2c1CCC2 1839200441 HTCKHSBNPHGHDH-QAPCUYQASA-N 459.316 0.669 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201381 WAMBSDWDNQIZOA-RDTXWAMCSA-N 470.299 0.798 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840077570 BPSSRQFQGVDASF-FUHWJXTLSA-N 485.347 0.203 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](COC)NC(=O)OC(C)(C)C)C2)C1 1840152582 MRKDXRHYBXSWGR-QYWGDWMGSA-N 493.985 0.236 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccco4)no3)C2)C1 1840184068 PXKPCUCIIDADEX-JOCHJYFZSA-N 475.502 0.378 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc4c(c3)OCO4)C2)C1 1840184171 WKCKTWZRKFBFIB-XMMPIXPASA-N 490.557 0.177 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840895269 NHTDJLCEZBCMBZ-SJKOYZFVSA-N 494.433 0.334 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)c2cocn2)C1 1842545352 ORGBWHBIVGCPJH-SFHVURJKSA-N 498.345 0.307 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c1 1843015050 CEYFRSKMSZQHJK-UHFFFAOYSA-N 480.326 0.864 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846143758 WGZUVXHIGGGCTE-IHPCNDPISA-N 483.374 0.971 50 20 JCGD O=C(O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 13264921 YKLMJCPIYKGBKK-UHFFFAOYSA-N 469.497 0.029 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2c(C)nc3nc(N)nn3c2C)cc1 17406827 CTJFQNICWSTZII-UHFFFAOYSA-N 474.547 0.032 50 20 JCGD O=C(CN1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1)NCc1ccccc1 22422871 INBMSXKZSGPMOB-UHFFFAOYSA-N 487.586 0.268 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 725871569 DUFBBWIVEHNFDZ-UHFFFAOYSA-N 475.527 0.245 50 20 JCGD COCCCNC(=S)N(C)NC(=O)CNS(=O)(=O)c1cccc(Br)c1 726075233 APPRXCDIMURWRY-UHFFFAOYSA-N 453.384 0.601 50 20 JCGD C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)S(=O)(=O)c1ccc(F)cc1 728329573 CDRYMCLFEINUSC-PXAZEXFGSA-N 466.443 0.519 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1 728845088 GGCBSHBKLIHZMK-UHFFFAOYSA-N 497.581 0.702 50 20 JCGD Cc1ncsc1C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OCc1ccccc1 729453145 DHVDLXFLOKYYQE-CQSZACIVSA-N 454.530 0.942 50 20 JCGD Cc1cccnc1CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 729622197 PGHSGHLOUZPDRP-UHFFFAOYSA-N 461.544 0.874 50 20 JCGD Cc1nc([N+](=O)[O-])cn1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 747116319 MNVRMFZJPMMHRB-UHFFFAOYSA-N 450.477 0.736 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1 784679230 HKGMFGLFFTWRMM-UHFFFAOYSA-N 467.887 0.825 50 20 JCGD O=C(NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1ccc(-n2cnnn2)cc1 894395701 AXUMGZQVLWEEDA-IAGOWNOFSA-N 455.475 0.405 50 20 JCGD Cc1cc(N2C[C@@H](C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)CC2=O)ccc1Br 914445370 XHBRCHPVMTYDAU-RYUDHWBXSA-N 458.334 0.693 50 20 JCGD O=C(NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)NNc1ccc(-n2cccn2)nn1 916650061 ZHAHAHSFBKLEAL-INIZCTEOSA-N 472.531 0.946 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(Br)cc1Br)[C@H]1CCS(=O)(=O)C1 917734569 RFNFHXCDWPUAAR-ZETCQYMHSA-N 476.168 0.956 50 20 JCGD Cc1cccc(S(=O)(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 918062228 OYDMYJLQHMYAFT-UHFFFAOYSA-N 467.569 0.958 50 20 JCGD CCn1c(O)nc2cc(C(=O)OCC(=O)NNC(=O)c3ccc(OC)c(OC)c3)ccc2c1=O 919459028 GTGUBKYFQWEMKI-UHFFFAOYSA-N 470.438 0.757 50 20 JCGD CCN1C(=O)C(=CNNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)N(CC)C1=S 920978628 NGGXTBTXXWSAMU-UHFFFAOYSA-N 479.584 0.585 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4cccnc34)C2)C1 1778443899 ABPSGJLHRMKWSR-WGLQLPMYSA-N 464.486 0.307 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1 1778541610 SPDASWZCYDIFNX-JOCHJYFZSA-N 467.461 0.229 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)nc2ccccn12 1779029949 CHCAQKZLWKXPCC-HSZRJFAPSA-N 463.498 0.399 50 20 JCGD CSc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032688 RSGZSCGDNVAGCX-NRFANRHFSA-N 456.528 0.559 50 20 JCGD O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1780200455 ACMPRAVEERULQK-LJQANCHMSA-N 480.319 0.907 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CS(C)(=O)=O)C2 1781997071 BIQPRHBWJSWIOO-UMPJEAMMSA-N 453.399 0.964 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1783345121 XSUFQPUZSOZMJN-SGTLLEGYSA-N 454.325 0.244 50 20 JCGD COc1ccc([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1783905569 RLGJHITXHGZEQK-BWPZPKMVSA-N 466.343 0.772 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1(CNC(=O)OC(C)(C)C)CC1)CCO2 1783932749 CYMSTHYVSWGEPI-HSZRJFAPSA-N 481.594 0.494 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c1 1784449025 GHHUTEPTJMNULU-NBGIEHNGSA-N 497.600 0.929 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Cc3cccc(F)c3)NC(C)=O)C2)C1 1785457853 FEAINMWDGPPXDX-NNMXDRDESA-N 469.941 0.957 50 20 JCGD Cn1ncnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1785847990 WVLPGCXGQFXRHO-AJNGGQMLSA-N 470.958 0.541 50 20 JCGD N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc(Cl)c1 1786880388 BCZGKGNAFZTTFO-FIRPJDEBSA-N 471.750 0.313 50 20 JCGD Cc1ccccc1NCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1786942850 NAHLFJCPFVXVDD-VCOUNFBDSA-N 451.332 0.380 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609879 QLROJOXXBOTCOQ-LRGYGIHKSA-N 467.526 0.746 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)o1 1788611304 TVJOIFJEEGYAGK-OWQGQXMQSA-N 470.486 0.144 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(F)c3[N+](=O)[O-])[C@H]2C1 1790137005 UHSDAJLYFFRFHP-QRTARXTBSA-N 465.482 0.700 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21)n1cnnn1 1791681871 CPVORKPAJJTEGC-QXKUPLGCSA-N 485.973 0.346 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)CC1 1792126201 MZVDSLUGQLEOBN-XSLAGTTESA-N 489.013 0.119 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])o1 1792355306 PUXPJJRUDMVAHN-ZPLRYINRSA-N 458.431 0.525 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)nn1 1793880153 RRRVVGYLEXCLNF-YXPYIKCWSA-N 483.953 0.821 50 20 JCGD COc1c(C)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1C 1797754070 SGOPWRNQAZMEHE-XEMDLRDOSA-N 467.526 0.828 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798522736 SGTGNTRQTRWKCG-CWPLJXCYSA-N 490.513 0.886 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C3)CC2 1800414220 HNDAZXGMONWQGO-PRHHBONVSA-N 493.564 0.702 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1 1808410080 QNXFVBYPFLWGPH-NRBGNURTSA-N 467.486 0.330 50 20 JCGD O=C(COC(=O)C(F)(F)F)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810182995 PLUGKTDNGXFGQD-YJBOKZPZSA-N 479.220 0.187 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1F 1810300110 XCODELBETGWOBI-DNVCBOLYSA-N 480.504 0.895 50 20 JCGD Cc1nccn1[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813491273 XKZYXPRNROTFMI-BUVFEPMLSA-N 461.331 0.847 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CC2(O)CCC2)[C@@H]1c1cccnc1 1813636144 XSSGRWKTJLEFHW-UZLBHIALSA-N 452.515 0.705 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1815167834 JWXZYXLQZCIWOD-UKRRQHHQSA-N 471.584 0.103 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362017 YSRQTHUTSAFLOF-CZUORRHYSA-N 466.328 0.911 50 20 JCGD Cc1nnc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)s1 1817471128 FDRUTKADNYSTPO-MRXNPFEDSA-N 454.321 0.798 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cn4ncccc4n3)sc2C1)c1cccc(B(O)O)c1 1818460335 WKPMCPDVEJOBNM-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)COc2ccc(O)nn2)n[nH]1 1821666926 RQKHVXMDNUAFIZ-OAHLLOKOSA-N 481.473 0.289 50 20 JCGD Cc1nc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)no1 1825179616 GKIJAQAIKNKBPY-SFHVURJKSA-N 455.519 0.853 50 20 JCGD C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825642636 TZWWVKHRURATDE-SKDRFNHKSA-N 452.139 0.832 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(S(C)(=O)=O)cn1)CC2 1826080336 BSJGUPRXUMQAKF-GFCCVEGCSA-N 494.599 0.540 50 20 JCGD COc1nccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050307 MEBJSRGJYNXQRM-LJQANCHMSA-N 452.320 0.712 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)/C=C\C(=O)NC2CC2)CC1 1828791351 KVCXWLKQIYHQMI-PXDRNWIDSA-N 468.558 0.753 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1830357507 CXWAFGUCWSZDNJ-LJQANCHMSA-N 466.000 0.133 50 20 JCGD O=C(CN1CCc2sccc2C1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726338 QBPZECQIYLIWEV-OXQOHEQNSA-N 457.980 0.162 50 20 JCGD O=C1CCCc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc21 1830728019 NDRBOABOVLJOKW-KNQAVFIVSA-N 450.919 0.875 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1831446176 CCPGGEJEXGCRAY-ZFWWWQNUSA-N 457.318 0.040 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1831656697 HRSLYDRPICEMKW-YWZLYKJASA-N 470.910 0.620 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1 1832209184 OFBYRXUIIYFUMV-MGPUTAFESA-N 451.911 0.142 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)n1 1833330645 MDTWWOOSASZLIZ-LJQANCHMSA-N 469.336 0.895 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1scnc1C(F)(F)F)CCO2 1834574965 SURUSKOYZREWEU-GOSISDBHSA-N 493.508 0.605 50 20 JCGD Cc1[nH]nc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1F 1834797436 KVSSAXPERGKAFD-UHFFFAOYSA-N 457.315 0.036 50 20 JCGD Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)ccc1F 1834799790 AZEONUVTGOIGPS-UHFFFAOYSA-N 468.338 0.708 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C3=CCCS3)CC2)CC1 1835736916 AFMDEJSMVULCSU-UHFFFAOYSA-N 458.588 0.891 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835736989 DZZSOEPRDPZHCO-KRWDZBQOSA-N 482.589 0.403 50 20 JCGD CC(C)COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)ccn1 1835928426 OTJWVOJTXUPVLE-VWLOTQADSA-N 497.357 0.180 50 20 JCGD O=C(/C=C/c1ccc(F)cc1F)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933862 FEMNFPNGXWDMGY-SXBBHYFQSA-N 486.280 0.428 50 20 JCGD CCOc1ccccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939387 PBOOKGRGKOLRPJ-XMMPIXPASA-N 468.315 0.149 50 20 JCGD O=C(c1cnc2c(Cl)cccn12)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836370328 OKBFGTFXNICVPT-BEFAXECRSA-N 457.314 0.657 50 20 JCGD CCOc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cnc2c1cnn2C 1836376689 GJEQGUPNRLVSLI-OXJNMPFZSA-N 469.901 0.971 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CCCCC1)CCO2 1836617222 IQPFHDWUBALYKQ-NRFANRHFSA-N 463.510 0.428 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836761726 UJTKIOGVVTZSFO-DOWNOZBLSA-N 489.997 0.546 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCCc3ccncc3)C2)C1 1837456838 OGFPQIFANBUIPW-DEOSSOPVSA-N 482.541 0.173 50 20 JCGD NC[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccc1 1837895581 CPIQTKGUIVZAKN-XMMPIXPASA-N 479.386 0.721 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1838568725 KTBCGTBTDXDANS-FQEVSTJZSA-N 475.325 0.709 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1NC(C)=O 1838606958 FUBMOGCJTUKQBC-LAUBAEHRSA-N 469.922 0.323 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1839692487 ZTUQTMHVPQMUKB-OPAMFIHVSA-N 495.418 0.871 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)[C@@H]3SC(=N)NC3=O)C2)C1 1840032825 LIMRZKHILUIFET-QLQJRFMMSA-N 477.381 0.029 50 20 JCGD CCc1nn(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)c1Cl 1840150404 KDCBGSSRLAIIMU-DJJJIMSYSA-N 463.362 0.960 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)C1 1840151944 SAYNRKQUCKDDBB-IERDGZPVSA-N 454.907 0.668 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1 1840494591 JCZSCJKJFRCUGF-AUUYWEPGSA-N 456.337 0.817 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CCC1)CCO2)NC(=O)NCc1ccccc1 1840621329 NCIBBAWTJMQIFA-QHCPKHFHSA-N 491.564 0.681 50 20 JCGD O=C(CCCCCCCCBr)N1CCO[C@]2(COCCN(C(=O)C(O)O)C2)C1 1840937534 TUCHVVMRAIYFHY-LJQANCHMSA-N 465.385 0.879 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1842348934 ZACRCPMVHBUTFT-UHFFFAOYSA-N 469.546 0.592 50 20 JCGD Cc1nccn1CC(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039519 XTPUDVLDJKNAPH-UHFFFAOYSA-N 453.547 0.741 50 20 JCGD O=C(COC(=O)CCc1nc2ccccc2c(=O)[nH]1)NNC(=O)[C@H]1COc2ccccc2O1 8953402 ITPJESBIMRLZJL-QGZVFWFLSA-N 452.423 0.386 50 20 JCGD NC(=O)c1ccc(NC(=S)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 726436216 VIEWLJPTUATRSR-UHFFFAOYSA-N 491.595 0.757 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c(C(=O)OC)s1 726519863 PSJGIBQKPAFJGK-UHFFFAOYSA-N 458.470 0.962 50 20 JCGD COCc1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 727350361 WHDLSJVVJXBTLJ-UHFFFAOYSA-N 469.541 0.477 50 20 JCGD COc1cccc2c1OC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C2 728398803 IFQLPHYCCMWJHY-INIZCTEOSA-N 462.528 0.958 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)COc2ccccc2O)c1OC 730782525 PAUVSVMPONIBOK-UHFFFAOYSA-N 495.510 0.270 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl 747756464 GEUUPXBUTYLQDH-UHFFFAOYSA-N 463.969 0.203 50 20 JCGD CON(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 750458826 RMABNIDRGJZJCB-KRWDZBQOSA-N 479.467 0.013 50 20 JCGD Cn1cc(/C=C\C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c(=O)n(C)c1=O 810449949 UQKULKXIRPQXRF-QXMHVHEDSA-N 497.533 0.037 50 20 JCGD CC(=O)NNC(=O)Cn1cc(I)c(=O)c(I)c1 913173350 PVYWCAPWHQREGX-UHFFFAOYSA-N 460.997 0.225 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 913430545 UJGVAWIBXKVCOQ-UHFFFAOYSA-N 476.555 0.908 50 20 JCGD COc1cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)NCC(=O)O)cc2)ccc1OC(C)C 916105779 GIZOFHXNGGNBBN-UHFFFAOYSA-N 465.484 0.920 50 20 JCGD CCNC(=O)COc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1OC 916388813 JJFKJQKHOWDFFO-UHFFFAOYSA-N 492.558 0.647 50 20 JCGD CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)CC1 916390321 JTQOVFZRBKRJAH-UHFFFAOYSA-N 473.555 0.622 50 20 JCGD C[C@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 918399462 PHIZRSPVQRQRMW-LBPRGKRZSA-N 465.561 0.734 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC(=O)Nc3ccc(Cl)cc3)nc2)CC1 919783089 MFDJKLUJTWIOOD-UHFFFAOYSA-N 481.966 0.936 50 20 JCGD CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)CC2)cc1 919886341 VSNCGCUFXARHBN-OAHLLOKOSA-N 488.588 0.004 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)Cc2ccccc2OC)cc1 919906563 CSQBNTYSMRYFJA-UHFFFAOYSA-N 450.517 0.693 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1778978097 CQKAGOKPTBJFRG-NBGIEHNGSA-N 487.601 0.736 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029200 NTTQWPAWCAVZCJ-XIKOKIGWSA-N 454.325 0.160 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3csc(-c4cccnc4)n3)CCO2)C1 1779030674 TTYDIMKEOZZING-HSZRJFAPSA-N 493.549 0.961 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032130 BMUUMCRJJNKPCT-QFIPXVFZSA-N 488.932 0.890 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCCC1)C2 1779373103 AFKSDTUGVHBUFJ-AUSIDOKSSA-N 458.563 0.299 50 20 JCGD O=C(CS[C@@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779409431 YQNXNMALVWRQJF-KJXAQDMKSA-N 476.404 0.754 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ncccc3C(F)(F)F)C2)C1 1779717214 IIXYUYNVYCUPGG-LJQANCHMSA-N 457.453 0.917 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1780034031 PHDTYEODLLAMAG-HOYKHHGWSA-N 499.572 0.941 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CNC(=O)C1)C2 1780055348 QFOSVIPGHWVMOQ-FCORRRHLSA-N 488.497 0.784 50 20 JCGD Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(-n2nccn2)c1 1780245641 RUHBUHZZNNXAOM-HSZRJFAPSA-N 469.546 0.392 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)C(C)(C)C)CCO2)NC(=O)NCc1ccccc1 1780968643 IOFULNDNBZGMRP-GBXCKJPGSA-N 475.590 0.570 50 20 JCGD CC(C)O[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969061 UQNTUEAIAILUSY-NTKDMRAZSA-N 475.590 0.976 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1 1781765093 AMLVSDUFPGBLAW-OAQYLSRUSA-N 472.433 0.490 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(F)cc1F)C2 1782209081 JZOOJZSQFPWERY-IIBYNOLFSA-N 453.490 0.860 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@H](N)c1cccnc1)C2 1782210832 QICLNAYHFFOJRQ-DNVFCKCGSA-N 460.579 0.358 50 20 JCGD CCN1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)CC1 1782213983 JDUNMPWBDQOETM-AUSIDOKSSA-N 451.612 0.605 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](CC(=O)OC)NC(=O)OC(C)(C)C)C2)C1 1783603823 WJZPSSJSFXHEBO-PDSXEYIOSA-N 491.969 0.527 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1 1789544517 MAENFZIGBAMURS-FQEVSTJZSA-N 497.508 0.928 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789843680 MZWUHMOYORGQQQ-XZOYJPPVSA-N 491.328 0.890 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CSCN3C(=O)[C@@H]3CCC(=O)N3)C[C@@H]21 1789865071 JAVQEDOIJOJDDY-JNNCMOEMSA-N 487.022 0.164 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791293026 FVCDLQBWPZJCPX-JKEDJMADSA-N 464.563 0.095 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnn3)[C@H]2C1 1791603735 CAIPKDGGNSDBMM-QSFXBCCZSA-N 499.480 0.982 50 20 JCGD 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COc1cc(CCC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)ccn1 1833741557 QKMFZEORJQPKSY-UHFFFAOYSA-N 488.633 0.967 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cnc1C 1834797383 HOWZXCMKKMRVDP-UHFFFAOYSA-N 464.375 0.877 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nc4ccc(F)cn4n3)CC2)CC1)c1ccc(B(O)O)cc1 1834798835 DFKOEHCGYFAEGB-UHFFFAOYSA-N 494.336 0.047 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3cc(Cl)ccc13)CCO2 1837085216 IHTXCKHLMGSTCN-QHCPKHFHSA-N 498.732 0.280 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1837117716 QFXSVEFOMNDJJS-GJZGRUSLSA-N 473.368 0.757 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1F 1837459571 KPYYPNJUBHNKFV-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CC[C@H](N)C(N)=O)CC2)CC1 1837882032 DZCDUPYUTAZZKX-HNAYVOBHSA-N 451.395 0.814 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)c2n1 1838485847 BEDZWZADQHSTJP-FOIQADDNSA-N 452.895 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50 20 JCGD C[C@@H](O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)OCC(=O)NNC(=O)c1ccccc1 776971716 HCHRLFKVISUVHB-VFNWGFHPSA-N 485.518 0.872 50 20 JCGD CCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 834756244 ZLVXDCQWFNHADY-QGZVFWFLSA-N 463.468 0.129 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2C(=O)[C@@H]3[C@@H](C2=O)[C@H]2C=C[C@H]3C2)c1 912643065 OALMPDLAXHHYRK-LSOMNZGLSA-N 474.539 0.285 50 20 JCGD COc1ccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1S(=O)(=O)N1CCCC1 912921392 PDRSKNBZGVMABP-HOTGVXAUSA-N 468.576 0.740 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1OC 914751896 RLHINQXFTNIUNI-UHFFFAOYSA-N 453.473 0.783 50 20 JCGD CCc1c(C(=O)NNC(=O)C[C@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)cnn1C 916159632 VZWHIOGCXNOHIL-KRWDZBQOSA-N 479.559 0.710 50 20 JCGD O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1c[nH]c2ccccc12 916515979 BKYPHOHUIFNYBM-UHFFFAOYSA-N 471.543 0.659 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc(OC)c1OC 916561629 ASVHEVJYXJEBMH-UHFFFAOYSA-N 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O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Br)nc3)C[C@@H]21)[C@H](O)CCl 1784092299 GQXJBJBCWMSIIG-XQLPTFJDSA-N 460.756 0.966 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@@H]3F)[C@H]2C1)NC(=O)NCc1ccccc1 1784859565 QCNHNMLFMQSHRF-WPVAHCMFSA-N 461.538 0.670 50 20 JCGD N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc(Cl)c1 1786880438 DKGWUVXDSDKGCE-FIRPJDEBSA-N 471.750 0.313 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978638 GSJRYQZTZGRUBD-MHADKKCISA-N 477.326 0.153 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3Br)C[C@@H]21)c1ccc(B(O)O)cc1 1786981085 QCJQARBOLJUTQD-ZVZYQTTQSA-N 488.147 0.431 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccco3)C[C@@H]21 1787506683 LAIQDKVEARAZDY-ARQYOALSSA-N 455.471 0.576 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[n+]([O-])cc3)C[C@@H]21 1787508372 HFYFWHFEBGGABE-QECDCCOMSA-N 454.487 0.047 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3cccc3C=O)C[C@@H]21 1787509107 SFJCWDQHIHDFNL-HNTLRFHGSA-N 482.541 0.975 50 20 JCGD N#Cc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788609760 HHLWLUVIPPOQSL-DCPHZVHLSA-N 466.473 0.603 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611246 QSNICLQPJQALRY-YSSFQJQWSA-N 494.552 0.308 50 20 JCGD CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21 1789858830 REEVQSUWVWMCBZ-RPVAFNKOSA-N 452.939 0.990 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1 1789867546 FSPVCAHOLSDIGU-RVFOSREFSA-N 458.408 0.530 50 20 JCGD COc1ccc(Cl)cc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790758950 AQWAPFZNMQBNJC-BUKVSMQUSA-N 486.761 0.864 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1791254165 OXNULHLUEFXTDE-QEOTZNIISA-N 477.986 0.496 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1 1791601143 ORVCRXJPBPXBJB-UHFFFAOYSA-N 467.530 0.806 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc(N2CCOCC2)c1 1796189534 ZMFNRGBGVCCFGB-UADZTWIMSA-N 463.343 0.769 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc[nH]c3C1)C2 1796445536 CTJLEAZRKNRTST-SJGOPNFYSA-N 467.530 0.238 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnn(C)c1)C2 1798522915 DOYKCOSXCLMIDQ-VPTLXERWSA-N 471.470 0.700 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl 1799276126 GVANQVPVDVNJQS-WUILDGTKSA-N 454.351 0.655 50 20 JCGD N#Cc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)ccc1F 1799327509 GPLDSHYISQXSKQ-VPTLXERWSA-N 466.473 0.142 50 20 JCGD CC(=O)N(C)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799865644 GBADFBHKGLNZFO-WKCHPHFGSA-N 472.590 0.839 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCNC3=O)C2 1800641202 RAUBFSOKUSMJKA-OQMKEHIESA-N 468.352 0.393 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2 1800759969 UTDIVCPSRNGNRM-RMEBNNNOSA-N 478.384 0.635 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1803141711 TVANDBMRTKAAGP-XDNAFOTISA-N 484.981 0.963 50 20 JCGD O=C(CCc1cncnc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807499644 HWYZIXYVAWTAPL-OFNKIYASSA-N 459.315 0.504 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnn2ccncc12 1809384701 BOSHANVBDIYRGT-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1 1810292449 UPHDTLUCZFAUJV-IYXSTTPGSA-N 478.557 0.871 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810294364 JQYVLIRRBUEBPO-WMQCIHAUSA-N 465.558 0.884 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)COc2cccnc2)[C@H]1c1cccnc1 1810294777 NIAHUUIREABWGY-JTSKRJEESA-N 475.509 0.874 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1 1810546129 OQEFFBYUISTADY-IHPCNDPISA-N 450.612 0.590 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810571044 CYAKGWYZJCUZIA-WGGBDISSSA-N 473.342 0.977 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)[C@H](C)NC(=O)c2cnccn2)[C@H]1c1cccnc1 1813030969 IDGVKPUBJQQSMD-RUENVJTFSA-N 474.949 0.950 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)[C@H]1c1cccnc1 1813034025 ZEIVCMOLEHXBBG-FFGOWVMKSA-N 476.965 0.812 50 20 JCGD Cc1cc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)no1 1813331565 HHNNCXWFGTVDNH-IERDGZPVSA-N 463.498 0.939 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)n1cccc1C=O 1815382450 ZEPVDTVMCOYJOL-XJKSGUPXSA-N 466.328 0.924 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)C(Cl)Cl)[nH]n2)n(C)c1=O 1815800061 XIRZEMJPVAXKTC-NSHDSACASA-N 497.343 0.653 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476432 RIVBTXUKDSDZHG-KSSFIOAISA-N 451.296 0.323 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc2c(n1)OCCO2 1817961221 FOKDQTMZWUARCD-SFHVURJKSA-N 477.286 0.875 50 20 JCGD CCOc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)nn1 1819797849 MLBPQPDURWHYJE-LLVKDONJSA-N 482.526 0.870 50 20 JCGD C=C(CC(=O)OCC)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1820894985 ZIWUDMPQQINQJV-SFHVURJKSA-N 454.292 0.905 50 20 JCGD CN1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1828442745 BFLDTHPDEGZWFJ-OAQYLSRUSA-N 471.606 0.166 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@](C)(O)CC(=O)O)C2)C1 1830543757 CBDKMYXARDKROX-FSPWUOQZSA-N 465.341 0.090 50 20 JCGD O=C(c1cccc(OCC(F)(F)F)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830723943 ACXGMUIVZXOYSM-RDTXWAMCSA-N 481.855 0.692 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)Cc2cccnc2)CC1 1831870723 COALBJCYMWFWOL-LEWJYISDSA-N 458.607 0.944 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=NN(C)C(=O)CC3)CCO2)C1 1832371443 PUWVUOMEEFFEDZ-UGSOOPFHSA-N 459.341 0.082 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)n(C)n1 1833439173 NEABSEPWJLNFNI-UGSOOPFHSA-N 459.341 0.530 50 20 JCGD O=C(Cc1cccc(Cl)n1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833879360 FOEMSPINLWSAQI-UHFFFAOYSA-N 484.793 0.843 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CS(=O)(=O)N3CCCC3)CC2)CC1 1835116222 AVTMNWBEGPWYJJ-OAHLLOKOSA-N 493.468 0.767 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)n3ccnn3)CC2)CC1 1835117843 PXAOGFHICIMZRX-AKBIMGJMSA-N 483.577 0.545 50 20 JCGD Cc1ccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1835166469 JNEIYDDMUUDXII-HSZRJFAPSA-N 462.547 0.203 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ncccc3F)CC2)CC1 1835738075 SHYLSGAFDAJOAJ-UHFFFAOYSA-N 469.521 0.718 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1 1836711029 GQOPCEMCWGUQSN-OALUTQOASA-N 486.374 0.568 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)C1 1836715012 YDUSMCSMQVPVLQ-ROUUACIJSA-N 480.606 0.947 50 20 JCGD Cc1cnc2c(C(=O)N3CCO[C@]4(COCCN(C(=O)CO[Si](C)(C)C)C4)C3)cnn2c1 1836949344 JAWHZPQMVZPHTI-NRFANRHFSA-N 461.595 0.959 50 20 JCGD C=CCCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457192 ZKNVARWJMQNGGF-QHCPKHFHSA-N 459.547 0.748 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)ccn1)CCO2 1837862225 XMMIYBAQRVNGPE-QVGKIPNLSA-N 488.932 0.939 50 20 JCGD O=C(CCc1cncnc1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919280 BKSRAELXKFCAET-UHFFFAOYSA-N 466.347 0.401 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920047 HEBOOBZMNMZCJU-UHFFFAOYSA-N 468.363 0.561 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCOCCOCCOCCOC)C2)C1 1839147488 RYQUJMGDPYJUDT-SIKLNZKXSA-N 495.013 0.547 50 20 JCGD O=C(NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1ccco1 1839198931 GLXLPYQTRFCWSY-PBHICJAKSA-N 462.272 0.156 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1839220298 FVNOUXUOQXCVKB-UYAOXDASSA-N 484.949 0.064 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839388684 ZLPBRVULGGTSQM-YVEFUNNKSA-N 456.323 0.090 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433185 OLLMUAFBNXXKIU-OAQYLSRUSA-N 484.937 0.194 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839449674 XWEBKGOLNQAKKJ-YLJYHZDGSA-N 470.910 0.331 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1840030984 BSTSLQJMVLZUAQ-UGSOOPFHSA-N 490.376 0.339 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)C(=O)c3ccccc3)C2)C1 1840150337 IYLZJMXSSNSGLL-PGRDOPGGSA-N 467.950 0.469 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)cc3C(F)(F)F)C2)C1 1840184180 BPUHWSIJTMMSNU-FQEVSTJZSA-N 489.495 0.487 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1cccc(O)c1)CCO2 1840268252 NKZYIIWLDUPOSQ-QHCPKHFHSA-N 462.547 0.154 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)[C@H](F)C1 1841518130 XMDHYYXGLBFECP-RTBURBONSA-N 489.353 0.779 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cc[n+]([O-])cc1)C2)NC(=O)NCc1ccccc1 1845039120 GFERTHCLNCPTLS-UHFFFAOYSA-N 452.515 0.483 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CC3(CCCN3C(=O)[C@H](F)Br)C2)N1 1845219748 HWICQOUDPCMJBA-LOWVWBTDSA-N 477.356 0.060 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc3c(c2)OCO3)C1 16230142 TUVYZAOXOXHHHC-AWEZNQCLSA-N 450.473 0.882 50 20 JCGD CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)ccc21 21967447 ITVCCVRCPBZYQP-UHFFFAOYSA-N 465.557 0.767 50 20 JCGD COc1c(F)cc(Br)cc1S(=O)(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 730765660 DONZEXMEZFLLPG-QMMMGPOBSA-N 460.303 0.276 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1 744446502 BGQYXNUQUMFZPJ-UHFFFAOYSA-N 458.846 0.699 50 20 JCGD CN(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1Br 751208707 IGFQJNVPAZKVCE-UHFFFAOYSA-N 489.373 0.952 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2c(C)noc2C)c2ccccc2c1=O 769322635 OEINCYRGZZMIFX-UHFFFAOYSA-N 490.542 0.931 50 20 JCGD O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cc(I)ccc1-n1cnnn1 859435910 WLZVVXNCXIEHRG-HNNXBMFYSA-N 492.233 0.868 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c2ccccc2c1=O 891625020 KCNKKWKABBPRDA-DLBZAZTESA-N 469.498 0.677 50 20 JCGD CCN1CCN(CC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)C(=O)C1=O 916128050 IAMAFOCSDKTBMZ-UHFFFAOYSA-N 461.482 0.386 50 20 JCGD CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 917724487 ZGRNSBMXQNQXGQ-UHFFFAOYSA-N 467.573 0.590 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2ccc(Cl)cc2O)c1 918357883 DWSVXACTNOVQPF-UHFFFAOYSA-N 454.892 0.487 50 20 JCGD COc1cccc(CC(=O)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c1 921061621 KELGBCJKBMJNAJ-UHFFFAOYSA-N 455.471 0.751 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c2ccccc2c1=O 933601236 GRLIMZMPYPRKIF-SFHVURJKSA-N 469.523 0.938 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1777993562 QVWLEIPAIWORQT-MPWIWIEXSA-N 489.997 0.736 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028423 FEAXHELSVIGQLQ-CMJOXMDJSA-N 490.561 0.289 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1 1779509117 UTHBGJRBTOHAQN-FQEVSTJZSA-N 463.221 0.538 50 20 JCGD O=C1Nc2ccccc2Cn2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc21 1779985508 MHOBWLJVBYFBFP-AVRDEDQJSA-N 473.917 0.540 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(Br)nc3)C2)C1 1780874486 OVPAEQWJYKWKKO-FQEVSTJZSA-N 482.379 0.590 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)csc2n(C)c1=O 1780922300 GGXZCEKHICGHSN-IBGZPJMESA-N 489.381 0.475 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)C3CCN(c4ccccn4)CC3)C2)C1 1780958995 XQAWQPLAWBGCFJ-RUZDIDTESA-N 478.358 0.122 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1O 1781978238 ILMPPRKFFFFIHO-HSZRJFAPSA-N 454.288 0.228 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCO3)C2 1782215009 OSKWRAGFVQCJFA-VGOFRKELSA-N 462.551 0.166 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783023502 XFODTNLQJZRTOK-LZJOCLMNSA-N 498.374 0.887 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1 1783495096 QVPSXYBDAZNZPZ-XYHYBEPMSA-N 490.520 0.039 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)C1 1783865208 XEZCBAKUOUYRHN-LNPFQXMTSA-N 473.530 0.108 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)Cc3cccnc3)C[C@@H]21 1783965986 YFAGZOFJALHWAW-QSGXVVIFSA-N 453.381 0.962 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1784373491 OEAQMYFXMZPNBV-ATZDWAIDSA-N 460.362 0.523 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(O)nc(Cl)c1 1785693599 JUEWBGRQXGNUOE-JQFCIGGWSA-N 459.695 0.028 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1785863964 KWMHJQXKCPBVOS-ARQYOALSSA-N 471.518 0.156 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1786335807 KHZBDROSWKEAMV-HNNXBMFYSA-N 473.360 0.442 50 20 JCGD O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21 1786401166 RKMJBEOLZOFZNU-DSPQJCBJSA-N 483.363 0.757 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(=O)oc3)C[C@@H]21 1787509101 ZSXPNLJCFCKUSB-NGTHKXITSA-N 455.471 0.367 50 20 JCGD COc1cccc2c1C[C@H](C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]31)CC2 1790762566 NCGQYBSBEZCTRS-ILFTZTESSA-N 492.381 0.773 50 20 JCGD CS(=O)(=O)c1cc(C(F)(F)F)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792979729 CZEWCFWEBCHROF-VAECKANCSA-N 498.907 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(-c2ccccn2)nc1 1794259836 YPGATLAKAIWOID-CWPLJXCYSA-N 488.508 0.054 50 20 JCGD CC(=O)Nc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)ccc1C 1795739782 MAOXHMXJDWAQAD-HATOLVCRSA-N 465.315 0.150 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2 1796890710 GQTNYFBCFQVEEY-YSHSJQKQSA-N 495.540 0.765 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@H]1CN(Cc2ccccc2)CCO1 1797247038 PJTBPXVIPMJKIT-USYVTKNRSA-N 451.951 0.077 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cn1)C2 1797954508 RYFJBFZLQKREJU-UPHUGPLXSA-N 462.623 0.973 50 20 JCGD CNc1nsnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798521537 NGKUTVUBEKWJTR-DRXBFXEBSA-N 490.498 0.930 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1799179455 HUFUHTPFOGHFLP-BCDXTJNWSA-N 461.287 0.685 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC12CCCN1CCC2 1799211367 XBYCZYZIOPXVRJ-DVRBRGDMSA-N 470.574 0.729 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OCCCO)cc1)c1ccc(B(O)O)cc1 1799241349 ZJQNNMFXZZISSG-WKCHPHFGSA-N 452.316 0.693 50 20 JCGD CC#C[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(O)cc1 1801055841 NSCJGMARMNTVKI-MASGSYHESA-N 476.338 0.472 50 20 JCGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)n1cnnn1 1801438984 QHGZFDYUIQQRDR-MWTISTBLSA-N 477.363 0.830 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1801964824 SLDRLUVQMYIANY-RCJHGTSTSA-N 469.583 0.252 50 20 JCGD Cc1cc(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1C 1803287504 TZBPZQUNXPHOSX-XXBNENTESA-N 461.331 0.366 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCCC3(CCN(C(=O)C(C)(C)CCl)CC3)C2)n(C)c1=O 1806897659 AAOTZPTZHRCFGS-UHFFFAOYSA-N 493.008 0.930 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C1 1807359180 FZLHJINTTPLBRN-GXKRZCMTSA-N 479.342 0.670 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(C)(C)C 1807359374 HYXBIEPGWBOYAU-KSEOMHKRSA-N 480.374 0.632 50 20 JCGD COc1cccc(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807362983 NJFLNQJIAMTTDT-NTKDMRAZSA-N 474.326 0.727 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3nonc3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364262 SXQQUEDHXZZQOU-GCJKJVERSA-N 471.282 0.931 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807364420 QEQMVUZGMWNGTO-JQTWLFPRSA-N 451.288 0.200 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1 1807364764 KCKMSAVFDPFJNH-GXKRZCMTSA-N 479.342 0.670 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1 1807980888 PYURIRMEGHBRDI-UHFFFAOYSA-N 455.519 0.586 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1808302608 HXPVLCMZULIBAQ-ODYMNIRHSA-N 479.328 0.764 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1 1808372390 MQUMSUZDBCDMPS-CXAGYDPISA-N 479.457 0.345 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc1 1808895628 TWHPRJGZDMABLR-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc2nonc2c1 1809127141 PVJAPTJVUPTFPI-PGRDOPGGSA-N 471.282 0.931 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)N1CCN(C)CC1 1810306124 UPNHGMDDNQUBSC-ZWCUEREDSA-N 494.600 0.036 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cl)COC)[C@@H]1c1cccnc1 1813028694 UEHZCOROGXEZPZ-SIXLDLHFSA-N 460.984 0.669 50 20 JCGD C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1 1814779998 CXXBIISEVNTEDK-SKDRFNHKSA-N 478.311 0.873 50 20 JCGD O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1 1815328066 DBUSDBYAISXLCI-MRVPVSSYSA-N 466.321 0.885 50 20 JCGD Cc1nc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)no1 1815870727 YIFMXWLVVKOGHB-HNNXBMFYSA-N 453.463 0.648 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)[nH]n1 1818113001 ZBHTZCGEZZEVIG-OHVPOGFWSA-N 486.533 0.186 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCCO3)CC2 1819796731 BFTNMHPKDGHRQJ-NSHDSACASA-N 482.526 0.660 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSc1ncccn1)CC2 1819797440 VNVCVSNWMBWNLI-NSHDSACASA-N 484.567 0.950 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N1CCN(C)CC1 1822415597 LVMVHJJJHIGWGO-AEFFLSMTSA-N 462.599 0.411 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822416079 NESAFVBCTZHYJS-DLBZAZTESA-N 480.522 0.270 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824461335 UIVSTZTYHHMPIY-KXBFYZLASA-N 494.618 0.246 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1c3c(nn1C)CCC3)CC2 1826089935 SCTUQXMZSVVWLQ-LBPRGKRZSA-N 459.576 0.964 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827056526 MAJCIKCSOOQPCY-VQTJNVASSA-N 489.378 0.443 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)CC1 1827548230 SHXHAKCEWNPTAG-VQTJNVASSA-N 485.614 0.945 50 20 JCGD CN1CC(C(=O)N2CCN(C(=O)OCc3ccccc3)[C@@]3(CCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1829415932 NNHXIZNDFMEMMW-WMZHIEFXSA-N 478.977 0.600 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830651673 BZGBGPGYFAEBPA-RUZDIDTESA-N 495.316 0.230 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CCOC[C@@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)CC2=O)c1 1830719805 LEVHAGAZCMICQL-HFXUHXBXSA-N 495.960 0.104 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830735764 MNKBLXLOXKCBFB-UZLBHIALSA-N 461.342 0.947 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)F)CCO2 1832185551 WYMUVEATMWZSJW-SAMQYFKISA-N 477.415 0.477 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ncccn3)CCO2)C1 1833168033 MUVQEFUIVPEHLR-HSZRJFAPSA-N 499.480 0.623 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cnoc1C1CC1 1834345634 MRKQIVSUUGAKSY-UHFFFAOYSA-N 466.347 0.731 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1834706718 DHUNWUXMEHPVJQ-QZTJIDSGSA-N 490.045 0.400 50 20 JCGD COCCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835181843 UVWMXJBAGXFFBK-UHFFFAOYSA-N 498.588 0.027 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C#CC3(O)CCCCC3)CC2)CC1 1835737868 JSQNXHIFHSIJGU-UHFFFAOYSA-N 496.612 0.569 50 20 JCGD CC(C)c1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835932077 MSYPNVPHWUZDPP-AREMUKBSSA-N 480.370 0.803 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)s3)C2)C1 1835935207 HGQSKDRXNTYKAU-FQEVSTJZSA-N 464.736 0.465 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc(-n2c(O)nnc2O)cc1 1836131525 QOPCDISBKYCOBE-GOSISDBHSA-N 492.964 0.463 50 20 JCGD CC(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n[nH]1 1836157272 ITLBXXYSJIUBBF-UHFFFAOYSA-N 467.379 0.712 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1 1837457097 VTFLHMQWSCSKPE-JOCHJYFZSA-N 488.932 0.426 50 20 JCGD C[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)c1ccccc1 1837461343 USIUWHIHEFWFAI-IQGLISFBSA-N 481.553 0.949 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C)nc3C(F)(F)F)CCO2)C1 1837963178 QJOFWAJDJMNIJT-CXAGYDPISA-N 468.860 0.763 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cn2[nH]cnc(=O)c12 1838471532 VHOCWRLWIWIXHV-OAQYLSRUSA-N 477.594 0.253 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cc[nH]c3cc1F)CCO2 1838575720 MJOXULOYPQBNFB-QHCPKHFHSA-N 475.521 0.750 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1F 1838915482 PUXCWHGPFBSNLA-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)[C@@H]1SC(=N)NC1=O 1839152292 VDSKSDZVBCMFCU-BMEPFDOTSA-N 481.402 0.482 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839153859 TYVJEFCJIPUZJD-KFKAGJAMSA-N 483.345 0.174 50 20 JCGD O=C(c1cnc2ncccn12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201510 ZJNHGVKDBHFHLA-CXAGYDPISA-N 456.272 0.490 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1839967072 ZJQDEGZEXHCBKS-UGSOOPFHSA-N 473.324 0.191 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCCc3ccncc3)C2)C1 1840182532 NADAVGLHJKIDEE-HSZRJFAPSA-N 461.563 0.234 50 20 JCGD O=C1C[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CN1Cc1ccccc1 1841504624 QHSCXJLUXBKGSM-HXUWFJFHSA-N 461.327 0.232 50 20 JCGD Cn1c(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc2c[nH]c3nccc-3c21 1844664817 NKAGKQMJYWXKFM-UHFFFAOYSA-N 457.299 0.817 50 20 JCGD CN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847565369 MDUIXYGFFWBUFB-VGWMRTNUSA-N 474.986 0.550 50 20 JCGD CCS(=O)(=O)CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1847788998 KSEVGUOZMCLCBX-IHRRRGAJSA-N 451.973 0.755 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)nc(O)n1 1848100204 YMEXWTKLSAMLPG-AVGNSLFASA-N 455.899 0.835 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cn1ccc(C(F)(F)F)n1 17442487 HDXWBXQMPGWAKR-UHFFFAOYSA-N 489.476 0.703 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)c1 18227433 ZBKJPERRYICHPJ-UHFFFAOYSA-N 452.489 0.138 50 20 JCGD CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 24291848 KYEMATKMLCQIDZ-UHFFFAOYSA-N 453.546 0.146 50 20 JCGD Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)CNC(=O)c2cccs2)cn1 725740210 RTIIJNSRIHYXJS-UHFFFAOYSA-N 468.542 0.535 50 20 JCGD O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)C1CCN(c2ncccn2)CC1 729229474 CQKBDGFHEHDKMJ-UHFFFAOYSA-N 482.593 0.416 50 20 JCGD O=C(NC[C@H]1CN2CCC[C@H]2CO1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 729617539 CYXVOONSBRDOGN-PMACEKPBSA-N 487.582 0.972 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2CCN(C(C)=O)CC2)c1 729623838 LOGPXTJCJNNSPE-UHFFFAOYSA-N 453.565 0.920 50 20 JCGD O=C(NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1)C(=O)N1CCCC1 748241274 SEINAWXWYBSYOK-LJQANCHMSA-N 474.514 0.711 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)C(=O)N2CCCC2)c1 748247496 QHHJWAIMMOPNOV-UHFFFAOYSA-N 465.576 0.701 50 20 JCGD CCOC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 749151978 NKYLRBAREYNDQD-UHFFFAOYSA-N 455.514 0.737 50 20 JCGD CC(C)CC(=O)N1CCC(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1 749197393 JFOHHSQWZAZCQY-UHFFFAOYSA-N 481.623 0.681 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)cc1C 749221804 UNYWZOQFHYUTQU-UHFFFAOYSA-N 452.515 0.921 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)Cc1ccc(S(=O)(=O)N2CCCC2)s1 751211898 YITOQHOLSQQAJS-UHFFFAOYSA-N 456.571 0.714 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 763925099 XMUZLSVCYSSSSL-UHFFFAOYSA-N 461.496 0.634 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)ccc1OC(C)C 906496977 JDOGJGUVEWYISJ-UHFFFAOYSA-N 490.538 0.678 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)cc2)c1 913148971 IWAHYSIVWNSULZ-UHFFFAOYSA-N 482.584 0.765 50 20 JCGD O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)c1ccc(-n2cnnn2)cc1 913155901 BSQGOFHEBTUNBR-UHFFFAOYSA-N 469.405 0.421 50 20 JCGD Cc1cc(C)n(-c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cn2)n1 915062968 MDXMWPBDTIJKGE-UHFFFAOYSA-N 484.538 0.980 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 916830823 ZMFBRMMRPCUXFI-UHFFFAOYSA-N 476.511 0.611 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1csc(N2CCOCC2)n1 921020973 DSYSYQHOJAYDGE-UHFFFAOYSA-N 486.601 0.120 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3c(Cl)ccc4c3OCO4)C2)C1 1777802341 IOQLVBSQXMGCDV-QFIPXVFZSA-N 487.900 0.825 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1778253167 HJMFXMXUAIMIPA-DEOSSOPVSA-N 465.315 0.011 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1 1778388995 CKDBCLJIVMSUEH-CYUILNSLSA-N 478.509 0.759 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1 1779028674 HYPZDURHJKGORH-JOCHJYFZSA-N 468.470 0.280 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cn[nH]c3cn2)C1 1779194977 UQSLEPFWJIGONA-XMSQKQJNSA-N 457.535 0.458 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1C(=O)C=CC1=O)C2)[C@H](F)Br 1780770473 PADBOLOMJSYZPP-PZPSRYQVSA-N 460.300 0.506 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781229679 HPJHJRAEMMTGQS-QGTPRVQTSA-N 453.319 0.547 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2 1781380539 NTOPFJNZWQPGCB-MJGOQNOKSA-N 454.923 0.437 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCN(C)CC1)C2 1781901949 ZSQBOJDZEUTGSJ-MBOZVWFJSA-N 459.429 0.921 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1783256710 GBBCAXQZAQRKFZ-QCIUDXLNSA-N 493.369 0.312 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1cnccn1)CCO2 1783534061 PBSRIVGBGMQOCG-ZJNRKIDTSA-N 454.325 0.208 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnn(-c3cccnc3)c1)CCO2 1783936860 WBAMBTGHOUUGTH-JOCHJYFZSA-N 455.519 0.084 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCN3C(=O)OC(C)(C)C)[C@H]2C1 1784823641 NYWLZRQZDJPDBV-FJIDUMEYSA-N 481.594 0.349 50 20 JCGD Cc1noc(C)c1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785360197 RBXUKIVBLZLYDR-YYWHXJBOSA-N 455.320 0.197 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785576122 HEUWUPQPYUICDL-SBUREZEXSA-N 479.578 0.106 50 20 JCGD CC(C)(C)n1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cn1 1785620251 GWNWPPGUFDTZBL-JVPBZIDWSA-N 469.546 0.544 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)NC2(c3ccc(NC(=O)[C@@H](O)CCl)cc3)CCC2)N1 1786135420 CTOOZIUHPQRWPB-BBWFWOEESA-N 495.001 0.900 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1 1786340021 RAORBPXXSDKFRQ-OAHLLOKOSA-N 467.592 0.821 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4s3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979879 VDVIRVFSRATKBW-WDSOQIARSA-N 465.340 0.883 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508234 BGFCOJAKWYPVET-QPXIFHGUSA-N 474.562 0.405 50 20 JCGD Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c2cccnc21 1788463404 INPRXFKSWGRMON-LRQRDZAKSA-N 462.315 0.160 50 20 JCGD CCOC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1 1790261882 WHGKMOCTDSAMIY-UFYCRDLUSA-N 474.558 0.830 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nc3F)C[C@@H]21 1791288541 CBUFNXWPIOLIJH-QEJZJMRPSA-N 455.918 0.840 50 20 JCGD COC(=O)[C@H]1CCC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)C1 1791293230 PDDRTIDMJPYDQF-VMXHOPILSA-N 466.579 0.319 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1CCCN1C(=O)OC(C)(C)C 1793649729 KRRLDCJTGIJBPI-WYADAEROSA-N 495.621 0.739 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878293 PEZOZZHUATZVAG-JBXGNFEISA-N 474.986 0.623 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1cccnc1 1795603507 OCSQCEZNYZXGNQ-HGOBAHADSA-N 467.530 0.606 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)C2)c1ccc(B(O)O)cc1 1795732993 WSZLAWMCIZFVTP-MPMRWZLSSA-N 452.291 0.512 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)C1 1795737274 NSCDWDXLCMRXJJ-FJWRRNOESA-N 499.373 0.039 50 20 JCGD CC1(C)CCc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)c2O1 1796255371 BSPHDCGFWPCFEB-HATOLVCRSA-N 478.354 0.987 50 20 JCGD CCc1nn(C)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1Br 1796418429 DCMYIFBJCVEJDI-MUJYYYPQSA-N 489.179 0.990 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796444504 WNHFANWVTAWIQF-LLXJHRPKSA-N 460.535 0.015 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCO1)C2)NC(=O)NCc1ccccc1 1799094681 FAOVOBHIWHMKQO-RCLSDMTESA-N 459.547 0.101 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802344152 PDSNAHSHKDVKHS-YYAJDYIMSA-N 497.593 0.454 50 20 JCGD CC(C)(C)[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803074852 XFZBZGMYJRDNDA-ZYSHUDEJSA-N 454.531 0.807 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C2=NN(C)C(=O)CC2)[C@@H]1c1cccnc1 1804119493 IHSPDXFERZDCEC-RKRZQOSRSA-N 492.540 0.830 50 20 JCGD COc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1807371306 SDCFHGHWHIYDNX-LAUBAEHRSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373238 PSKGBYKXQKOZAJ-XMSQKQJNSA-N 459.315 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CSc2ncccn2)[C@@H]1c1cccnc1 1807572871 MNGXZZQAYXBWOW-JXFKEZNVSA-N 492.565 0.982 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1809227630 ZKVMQWZECRWKEA-WMZHIEFXSA-N 461.331 0.664 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cn2cccnc2n1 1809778377 RQMWODGCQKIRNY-RXVVDRJESA-N 470.298 0.438 50 20 JCGD O=C(/C=C/C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)NCc1ccco1 1809970761 AJCATWYYSXWUEV-CMDGGOBGSA-N 479.342 0.677 50 20 JCGD N#Cc1c[nH]c(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1 1811541215 UEMVJLCZZGCVGO-OXQOHEQNSA-N 458.482 0.913 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1814171215 IJMQKGAGLKWYKN-VQIMIIECSA-N 482.541 0.989 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(-n3ccnc3)ccn1)CC2)c1ccc(B(O)O)cc1 1815343847 RVPHPTMSDPKXDF-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(OCF)cn2)[nH]n1)c1cccc(B(O)O)c1 1817473134 HUEWUXUAHCBLGH-KRWDZBQOSA-N 468.254 0.805 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc2cccnn2n1 1820083923 VBHOWJRFEAPPNL-IBGZPJMESA-N 459.275 0.752 50 20 JCGD CC(=O)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(C)NC(=O)NCc2ccccc2)n[nH]1 1820711364 NTLADDZVAYXXHX-IBGZPJMESA-N 484.561 0.884 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3ccc(B(O)O)cc3)CC4)c21 1821178047 QYEIBWLEEBOKPB-CQSZACIVSA-N 491.338 0.955 50 20 JCGD C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(CCO)CCO)sc2C1 1825327583 MEPIVPGBHDNDQH-DIFFPNOSSA-N 453.392 0.578 50 20 JCGD CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CNC1=O)CC2 1825440917 HSFFXKTVAFPBFC-RKDXNWHRSA-N 458.338 0.780 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc(C)c(O)nc1=O)CC2 1826008451 BIUCPNGFIIQXHH-MNOVXSKESA-N 455.924 0.580 50 20 JCGD Cn1nncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548031 CKZGKJRCYYRYDT-XMSQKQJNSA-N 490.948 0.481 50 20 JCGD C[C@@H](Br)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](N)CN)C2)C1 1829330719 PEHLKTFZTONBLS-LDBYXDLTSA-N 496.406 0.508 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cc1 1830221995 WVMAZJIPKROAOI-GZRFBZBPSA-N 471.348 0.968 50 20 JCGD O=C([C@@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)C3(C(=O)Nc4ccccc4)CC3)C2)C1 1830724779 CDCGVHRARHNVOD-LAUBAEHRSA-N 465.934 0.461 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830731668 NKALJXQKRCCCBU-IPHXSNPTSA-N 493.960 0.392 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1830735806 NDCFSCXJUNVTOF-XXBNENTESA-N 497.976 0.148 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737770 GYZZDLOPGHUYMI-MRUHUIDDSA-N 477.986 0.736 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2)CC1 1830739201 ZZEMRJWAVJYLHM-URXFXBBRSA-N 495.020 0.498 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1831236456 ILDZPOACKBEDGU-IPJJNNNSSA-N 452.935 0.747 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc[nH]n3)CCO2)C1 1831763550 FNGXQKBHUCXPKC-OAQYLSRUSA-N 473.442 0.627 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C1CCC(C(F)(F)F)CC1)CCO2 1832143768 UWEFNMKSUUJYNI-QRFVXNFXSA-N 498.307 0.805 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2 1832231461 GXMVPHVFYYMHER-UNMCSNQZSA-N 450.511 0.527 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc[nH]n3)C2)C1 1832549510 STRLOTJGBXQBFX-DJJJIMSYSA-N 472.930 0.007 50 20 JCGD Cc1csc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1832985595 UCRILHGFHPXJAC-JOCHJYFZSA-N 466.604 0.819 50 20 JCGD COc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1833971072 CISSFGXRXFXIDQ-MUFRIFMGSA-N 496.572 0.804 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nn[nH]c3C(F)(F)F)CC2)CC1)c1ccc(B(O)O)cc1 1834798301 FJMKZHTYCAYSKF-UHFFFAOYSA-N 494.283 0.002 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc4c[nH]nc34)CC2)CC1)c1cccc(B(O)O)c1 1834800183 XHLAHVDJJFWZQQ-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c[nH]1 1835222266 SZWFKJZLVQYVCS-UHFFFAOYSA-N 453.547 0.821 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1835793774 RUEUHQJXJBDUKI-HNNXBMFYSA-N 495.422 0.952 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3occc3Br)C2)C1 1835928039 BRWAZIRQGRNNLL-HXUWFJFHSA-N 493.119 0.106 50 20 JCGD Cc1cccc(C)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931923 HBJYTCGXDRDLQX-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C2)C1 1835933966 IHGSPXDSHJZRNM-XVAXZDLZSA-N 482.264 0.169 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3csc4c3CCCO4)C2)C1 1835935476 GZBHQDVYSOFYTJ-QHCPKHFHSA-N 486.355 0.137 50 20 JCGD CN[C@H](CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1)C(=O)O 1836412332 FFASLZINBPFORA-UKRRQHHQSA-N 451.337 0.311 50 20 JCGD O=C(COC(=O)C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837318912 DNWWSPLXNSLPDA-ZWNOBZJWSA-N 465.194 0.239 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1C 1837455910 GPCJHSMADRLQEX-RUZDIDTESA-N 481.553 0.615 50 20 JCGD O=C(c1ccc(Cl)nn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837838308 ZHGMZIIOECFKMC-IUODEOHRSA-N 451.680 0.891 50 20 JCGD O=C(c1cncc(C(F)(F)F)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838179915 UMHZDZFXBRMTJT-RHSMWYFYSA-N 451.829 0.770 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)COc3ccc(O)nn3)CC2)CC1 1838723963 BCQAAMQQZRESFY-INIZCTEOSA-N 456.927 0.813 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnco3)C2)C1)NC(=O)NCc1ccccc1 1839053996 AWGDTTXGCBQJEQ-HSZRJFAPSA-N 486.529 0.091 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1839145575 MPVIBWFKZHXWEY-HAYFENEFSA-N 453.923 0.926 50 20 JCGD O=C(Cn1nccn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802480 XXKQKANIRPWHNM-RXVVDRJESA-N 492.374 0.741 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1839962413 DGLAKALUKUYODF-KPZWWZAWSA-N 471.308 0.418 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1840033331 ARMUCXPHSKUCNC-BTYIYWSLSA-N 495.374 0.580 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1 1840152263 CWLSQNJFHDHUQJ-CNNODRBYSA-N 451.951 0.411 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1840184798 BVYAPPJKCRMZIM-ZWKOTPCHSA-N 453.367 0.052 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4cccs4)on3)C2)C1 1840185554 OXKACAPHGSICDH-QFIPXVFZSA-N 491.570 0.846 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CC3Cc4ccccc4C3)C2)C1 1840186927 GNRSMVYTRMNFQE-RUZDIDTESA-N 472.586 0.621 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cnc2s1 1840188723 YWWNVKJYFCLWES-GOSISDBHSA-N 475.354 0.938 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010408 MOTZQEXQGQJEGT-SFHVURJKSA-N 457.336 0.653 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)CC2)CC1 1843952518 SYYPXAPVCMFFMP-UHFFFAOYSA-N 490.649 0.286 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1845571510 XARNXHOOXWHBAC-UHFFFAOYSA-N 460.498 0.705 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846129123 DYHYWYIPKPWDMO-AVRWGWEMSA-N 483.374 0.831 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1c(I)cnn1C)C2 1846384925 ZVIXKLNBSPCHJF-UHFFFAOYSA-N 488.330 0.215 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1n[nH]cc1I)C2 1846385290 MQGOFMWPGKKRRS-UHFFFAOYSA-N 474.303 0.204 50 20 JCGD CC(C)N(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1)C(=O)OC(C)(C)C 1847328068 ARSQDXAYRSGUSB-OALUTQOASA-N 459.352 0.827 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1 15857019 UCAKAJKAEBUNAE-UHFFFAOYSA-N 488.526 0.400 50 20 JCGD COc1ccc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 17202449 NYLAPFRVJKMXII-UHFFFAOYSA-N 477.539 0.875 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cn2cc(Br)c(=O)[nH]c2=O)cc1 23569267 JRNGEGRAJSLDDO-JTQLQIEISA-N 455.265 0.313 50 20 JCGD Cn1cnc2c1c(=O)n(CC(=O)OCC(=O)NN=C(c1ccccc1)c1ccccc1)c(=O)n2C 25102794 LCWNIHRDPSZNIA-UHFFFAOYSA-N 474.477 0.546 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)cc1OC 727098045 FXCLXCLATXUIGV-UHFFFAOYSA-N 479.291 0.761 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNC(=O)c2cc(-c3ccccc3)on2)n1 728732998 GSVRBTMUVFMSBM-UHFFFAOYSA-N 457.468 0.770 50 20 JCGD COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1 729275941 SPCKARQUHMZTGA-GFCCVEGCSA-N 470.529 0.195 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(-n2cnnn2)c1)c1cccc(S(=O)(=O)N2CCCC2)c1 743729424 FIBTYHIJGAEKIX-UHFFFAOYSA-N 477.528 0.070 50 20 JCGD COc1cc(I)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1OC 751360346 CQJGDIIJGWXFQO-MRVPVSSYSA-N 483.284 0.440 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc(Cl)cc1 763924366 SVOGOLUNRXRARB-UHFFFAOYSA-N 481.914 0.979 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)Cn1cc(S(=O)(=O)N(CC)CC)ccc1=O 769086827 IXOQERXCKUOIAB-UHFFFAOYSA-N 488.570 0.639 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCn2c(S)nc3ccccc3c2=O)ccc1Cl 789372680 XGXMCOFZXDFTGZ-UHFFFAOYSA-N 481.943 0.837 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)C[C@@H](C)O1 818030002 YLVAQPPBYDCVTO-GASCZTMLSA-N 488.010 0.782 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)ccc1Cl 874081668 FXLCLYQWVKCAIP-UHFFFAOYSA-N 490.929 0.596 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@H]2CS[C@@H](Cc3ccccc3F)C(=O)N2)c2ccccc2c1=O 891625034 KCNKKWKABBPRDA-SJORKVTESA-N 469.498 0.677 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1n[nH]c3c1CCC3)N(S(C)(=O)=O)CC2 916159427 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469.560 0.372 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c2ccccc2c1=O 933527806 QWBYCYKNXDFURY-UHFFFAOYSA-N 452.427 0.753 50 20 JCGD CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1778077065 FAZCKQOYLGMVAB-MRUHUIDDSA-N 475.970 0.442 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCO3)C2)C1 1778281354 RIRIRFHEJCVSGI-BWKNWUBXSA-N 487.601 0.090 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCCNC3=O)C1 1778918478 DSDLAZXRXKSITG-SOIKWTOOSA-N 467.954 0.398 50 20 JCGD COc1nc(C)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032464 KWCIDELBUGBVID-JOCHJYFZSA-N 454.487 0.154 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)cn1 1779862717 YFHTWGAODXCNDF-NTKDMRAZSA-N 481.557 0.587 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccccc1F 1781416064 LVWIBUAMIBSCJQ-DNQXCXABSA-N 491.564 0.380 50 20 JCGD 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C[C@H](NC(=O)c1ccccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1821660467 VALKCNOIJZQBEM-YWZLYKJASA-N 490.329 0.609 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H](O)Cc1ccccc1 1822078773 COCMYLOHVVBEJS-SFTDATJTSA-N 462.315 0.999 50 20 JCGD O=C(CCc1ccc(O)nn1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1824483526 RKSHRBRMTZJKFD-OAHLLOKOSA-N 467.316 0.177 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053724 YOQALXUWLQPEIY-HXUWFJFHSA-N 496.329 0.370 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(S(C)(=O)=O)c3)CCO2)C1 1830181987 DFNHGAIISKTWAB-FXAWDEMLSA-N 474.963 0.414 50 20 JCGD O=C(c1cn2c(Cl)cccc2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728266 RHDQCXGLJQOPPQ-KUHUBIRLSA-N 457.314 0.657 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1F 1830736617 VFLHOKNDWWLGDM-OXJNMPFZSA-N 461.893 0.701 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1834798381 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Cc1ccc2oc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc2n1 1836265086 WEVKSPHCLZAFSS-XMMPIXPASA-N 479.298 0.200 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3CCCC4)C2)C1 1837461518 XCIIEBQSICXJBO-AREMUKBSSA-N 493.564 0.948 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccn3)C2)C1 1838527094 HCTUWYASMGZUSV-QFIPXVFZSA-N 485.453 0.694 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1839144968 PNOXHKVGBBJIPG-APWZRJJASA-N 466.000 0.132 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839150618 RLPNIKISDIDSQX-IRXDYDNUSA-N 457.376 0.585 50 20 JCGD CN1CCC(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)CC1 1839197510 ZQKCMJAPIHXNQR-AEFFLSMTSA-N 450.349 0.865 50 20 JCGD O=C(c1cc2cn[nH]c2cn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200192 HMEUCMMQXBPLLM-PBHICJAKSA-N 456.272 0.718 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1839202170 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CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1841583012 ZIENJDXPIKZUQE-ZDUSSCGKSA-N 482.515 0.665 50 20 JCGD COc1ccc(-c2cc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)n[nH]2)cc1 1843011358 UXUZDENSNPILJM-UHFFFAOYSA-N 460.299 0.896 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012386 KMVAJMMYBLMJFV-QGZVFWFLSA-N 471.363 0.831 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CC1 1843012688 LYVCPHPUKLZESM-UHFFFAOYSA-N 469.347 0.751 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2)cn1C 109583260 MRXFNLXGEAAOQF-QGZVFWFLSA-N 463.516 0.117 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2CCCS2(=O)=O)c1 726276746 MRUXVJHUVAURAJ-UHFFFAOYSA-N 475.593 0.087 50 20 JCGD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)C(=O)Nc3ccc(C)c(C)c3)C2=O)cc1 726281121 AGFUSGHPVQBPGL-HSZRJFAPSA-N 467.482 0.865 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cc(Br)c[nH]2)C1 728203145 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JCGD COCCCC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970253 VVLFMPNCAJQTKP-QHCPKHFHSA-N 461.563 0.589 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccccn1)CCO2)NC(=O)NCc1ccccc1 1780970276 TYLZFOYTCOQAQG-XMMPIXPASA-N 466.542 0.871 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C1CC(=O)C1)CCO2)NC(=O)NCc1ccccc1 1780970751 YCMJKZIMKUIBIQ-HSZRJFAPSA-N 457.531 0.142 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3ccnn3c1)C2 1782213271 KAZXKFNXPYFWHK-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nncn3c1)C2 1782215197 XZWGVXUNODTSJC-VGOFRKELSA-N 457.535 0.230 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782786939 KFGKLKOMDWARRK-LJQANCHMSA-N 452.540 0.438 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1783348346 YXZHGZCZFCGCLA-RHSMWYFYSA-N 466.398 0.415 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1783580001 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NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(=O)cco2)[C@H]1c1cccnc1 1806130825 HDPRKFLPELXXSQ-FOIQADDNSA-N 462.466 0.667 50 20 JCGD O=C(CCN1CCCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1806645927 XIPKPCTZIHVJGI-XUZZJYLKSA-N 464.375 0.957 50 20 JCGD COc1nccnc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365126 XDWPIAJSIFJETG-FXAWDEMLSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCCn2ccnc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374055 HVEDYKDWTFTEAG-NFBKMPQASA-N 461.331 0.758 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)n1cccc1C=O 1807388009 NMINCLJCHRMWNA-HCLVMJGWSA-N 474.326 0.956 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1808317845 LWSGFEVAKQJPLV-QRFRQXIXSA-N 461.390 0.610 50 20 JCGD O=C1Nc2c(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)cccc2C1=O 1810026218 JNYQYWWCEUVLLJ-VGOFRKELSA-N 498.304 0.530 50 20 JCGD CC(C)NCCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303755 VMFVNMWKNBWWOZ-UTKZUKDTSA-N 453.547 0.788 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccccc2C(N)=O)[C@@H]1c1cccnc1 1811289088 GAOAKCFXRBLJGW-VGSWGCGISA-N 466.542 0.873 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[C@@H]1c1cccnc1 1813030480 HVMKKUCCJKERLH-DHSIGJKJSA-N 481.962 0.807 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813619592 FQRSXJCKPCVESA-AKIFATBCSA-N 464.375 0.954 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)Cc1ccccc1)CC2)c1ccc(B(O)O)cc1 1815348474 PSCFKSAEXZEQIG-HKUYNNGSSA-N 465.340 0.652 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cnnn3)sc2C1)NC(=O)NCc1ccccc1 1815685602 IFTGCLJHCNBRGE-OAHLLOKOSA-N 498.573 0.088 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2 1817275712 AAVZLZKEMNQKSX-PKGYSGITSA-N 452.924 0.789 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800940 DVMNOZFDLSKMRF-BLLLJJGKSA-N 473.559 0.672 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1ccnn1)CC2 1819801850 ULRPHPLCWJZXLD-NSHDSACASA-N 455.504 0.049 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCC([C@H]3CCCCN3C(=O)[C@@H](O)CCl)CC2)CC1 1824185816 HTQWZMAGDRHYNX-MSOLQXFVSA-N 464.028 0.877 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1824598900 OGCTVZJNFKCXCY-BXUZGUMPSA-N 461.305 0.610 50 20 JCGD Cc1cc(NC(=O)CC(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)no1 1826085978 IKHWEGTWYVGTQM-LBPRGKRZSA-N 477.547 0.753 50 20 JCGD Cc1cn(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)c(=O)nc1O 1828925575 LUWJORZICCCSOB-LJQANCHMSA-N 497.556 0.189 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1)n1ccnn1 1831170697 JAWUAWNLMICQFC-KXBFYZLASA-N 454.535 0.771 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2CCOC2=O)CC1 1831873065 HVSHYVDVNNAKGU-SFHVURJKSA-N 451.568 0.821 50 20 JCGD CN(C)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834016520 NRGBQCFSUHGVCT-UHFFFAOYSA-N 494.600 0.645 50 20 JCGD COc1ncc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cc1C 1834334441 JUMVHANRFDCDKT-UHFFFAOYSA-N 474.606 0.957 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CNCP(=O)(O)O)CC2)CC1 1834665642 PVCVVEHFZPBSDU-HNNXBMFYSA-N 483.344 0.456 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4nc[nH]c4c3)CC2)CC1)c1cccc(B(O)O)c1 1834800138 SFEDSVWDKYLUQL-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834824239 ZKYQLJKGRAXANR-LJQANCHMSA-N 454.321 0.641 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cnco3)CC2)CC1 1835116447 ONKCQFHDMVVDMH-CVKSISIWSA-N 455.519 0.994 50 20 JCGD N[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1cccnc1 1835834398 MMBHKMQCODNZNG-UWWQBHOKSA-N 459.316 0.618 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1 1835837092 TWRADUWWKUOMKW-IBGZPJMESA-N 456.660 0.561 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)CSC(=N)N)CC2)CC1 1837827079 OCSAHYMKRLNBAX-AFUMVMLFSA-N 477.591 0.746 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(Cl)c(Cl)c1)CCO2 1837916256 YQJHZBHMIZQORQ-NRFANRHFSA-N 494.140 0.452 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1 1838536008 HQHRPQLOXFKZTL-DNVCBOLYSA-N 456.337 0.629 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(F)c1)CCO2 1839001764 FMKHJEXRNUUXKC-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccc(F)cc1 1839038829 DQBZUYHJWYVVKE-OPYAIIAOSA-N 471.913 0.059 50 20 JCGD C/C=C(/C)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054204 LQMDOSCIXLCWPU-DOENUCRNSA-N 473.574 0.755 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198372 CVRRZIPIXDICJO-RHSMWYFYSA-N 453.305 0.865 50 20 JCGD Cn1c(=O)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc2ccccc21 1839201419 XICKZXLRPPFXDB-OXJNMPFZSA-N 497.321 0.694 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(OC)c1 1839794072 CQGXOVARHCFFRC-PGRDOPGGSA-N 470.950 0.693 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCCC3(F)F)C2)C1 1840182455 JLQLJHQATDZAQP-OXQOHEQNSA-N 460.522 0.641 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(CN(C(=O)CC3CCC3)CCO2)C1)NC(=O)NCc1ccccc1 1840848796 PTLSXPIFEFYLPE-RUZDIDTESA-N 487.601 0.979 50 20 JCGD CC(C)[C@@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)N1Cc2ccccc2C1=O 1841587384 MZNKJNWRRSLGEO-QFIPXVFZSA-N 475.354 0.864 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)cc2)CC1 1843012698 GPZBJVAVLAVCBX-UHFFFAOYSA-N 462.359 0.249 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(Cl)ccc2NS(C)(=O)=O)C1 1845510352 VLYNLYVKTPEXDA-UHFFFAOYSA-N 485.994 0.902 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)Cc2ccccc2C1=O 1847608804 RXXJNPUQDVEXNE-PMACEKPBSA-N 490.520 0.116 50 20 JCGD O=C1COc2ccc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)cc2N1 24257175 VICZEQPGWPRSHT-UHFFFAOYSA-N 494.551 0.815 50 20 JCGD CS(=O)(=O)NCCNC(=S)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 727064609 KARYSROUXPFISX-UHFFFAOYSA-N 477.615 0.207 50 20 JCGD O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)C1CCN(c2ncccn2)CC1 728981197 PHDLWNLIBAVVMT-UHFFFAOYSA-N 466.951 0.862 50 20 JCGD CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(OCC(=O)N2CCCCC2)cc1 730569406 ZBYYURQYLWZBEX-UHFFFAOYSA-N 488.570 0.503 50 20 JCGD CC(=NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1 730576420 FNNUJTLNUVKWIR-DOTOQJQBSA-N 471.557 0.589 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1)[C@H]1Cc2ccccc2O1 748331921 YHZRLBHADZLKPV-GOSISDBHSA-N 475.483 0.646 50 20 JCGD CCc1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1S(=O)(=O)N1CCOCC1 751202251 QGVRWEUSQAPGPF-UHFFFAOYSA-N 464.500 0.054 50 20 JCGD O=C(COC(=O)CCn1cnc2ccccc2c1=O)NNC(=O)[C@@H]1COc2ccccc2O1 792694105 PGAGRUVRYLOTGW-SFHVURJKSA-N 452.423 0.317 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)cc2)c2ccccc2c1=O 915044975 MAHWJAWHHBBTPX-UHFFFAOYSA-N 460.468 0.893 50 20 JCGD C[C@H](Oc1ccccc1F)C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 915789178 XDRCNPYAMHCYSO-ZDUSSCGKSA-N 467.475 0.880 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccc[n+]1[O-])c(=O)n2Cc1ccccc1 916147921 OILCOTQOUSBEGT-UHFFFAOYSA-N 491.508 0.159 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)CN3CCCC3=O)ccc2Cl)C[C@@H](C)O1 920435586 KGVZQTCUEDCPIZ-BETUJISGSA-N 472.951 0.521 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCN(S(C)(=O)=O)CC2)cc1 920852154 NPMXLGSVYJGCDZ-GHRIWEEISA-N 486.554 0.445 50 20 JCGD COc1cccc(CC(=O)N2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)c1 921070868 DUUCXZLOYMIQML-UHFFFAOYSA-N 488.570 0.730 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccccc2N2CCN(C)CC2)cc1 1326469174 CRYLQFHHTAPVTK-UHFFFAOYSA-N 488.614 0.898 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ccncc23)C1 1778685385 DVZJHRYCOSSECN-AUSIDOKSSA-N 478.513 0.169 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Nc3ccccn3)C2)C1 1779328197 VINBKUUWPHHWIW-NFZPZHFSSA-N 467.530 0.846 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)CC1 1779544322 VOPFBXGPNSKQTG-DENIHFKCSA-N 468.671 0.516 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(N)=O)C2)NC(=O)NCc1ccccc1 1780559632 XMMXSLWDNXADIE-NTKDMRAZSA-N 488.589 0.112 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)Cc3[nH]nc4c(Cl)cccc34)C2)C1 1780941656 SRZNELZUDPQICC-QHCPKHFHSA-N 497.943 0.901 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccn1)CCO2)NC(=O)NCc1ccccc1 1780970500 WTMCVJSGRICXEP-HSZRJFAPSA-N 467.530 0.266 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1 1781338168 WBROIQOFFPBRJX-KUHUBIRLSA-N 478.384 0.877 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1781382821 BTFNFYJAEILMEY-XLIONFOSSA-N 495.411 0.686 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)NC[C@@]13CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C3)C2 1781593031 YFFRJDLUAUFMNV-GCUZGZFTSA-N 496.992 0.736 50 20 JCGD C[C@H](N[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)C1CC1)c1ccccc1 1782887607 LDCJCMQJPUNGBL-KKCLFWLVSA-N 491.397 0.939 50 20 JCGD NC(=O)NCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783021148 ATHXYMXGUMQTHS-DNVCBOLYSA-N 453.337 0.491 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)(C1)C2 1783435852 YSDNBJGLKOHSGF-XJPVNGNMSA-N 457.955 0.863 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)CCO2)C1 1783868605 IXLPOEURZLIXNN-YDGKCNFYSA-N 467.950 0.250 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 1783880344 BDRFRMHGXBMTFF-DYESRHJHSA-N 454.907 0.533 50 20 JCGD O=C(Cc1cccc2ncccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784457468 CRHQGTVFNXRVGG-APTRMMRNSA-N 473.338 0.751 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1 1785608171 FCRQKEJRUXVGEY-DJJJIMSYSA-N 491.383 0.370 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)n1 1786980151 OOCWPYVQBVTBJA-QRFRQXIXSA-N 454.336 0.225 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)CC1 1788111280 PFGPJISKSGAZFE-ZQDZILKHSA-N 484.388 0.328 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1F 1788607935 XCBPTVKPCUQPRK-VHFSOBRXSA-N 471.489 0.740 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21)n1ccnn1 1790638640 SVHSOCFVPGSXGA-WOYTXXSLSA-N 484.985 0.951 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1791581335 TUECNNRSIAYMSJ-XSLAGTTESA-N 463.604 0.915 50 20 JCGD COc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1791948610 UILMAPIDJFTCDB-GMVOTWDCSA-N 471.489 0.740 50 20 JCGD COc1nn(C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1794581751 HJLXWQWPVOFRSQ-HBCWATKFSA-N 487.469 0.779 50 20 JCGD O=C(Cc1ccc(OC(F)(F)F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1795372661 YZMWTBIQEQRVNX-UPHUGPLXSA-N 492.259 0.711 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(=O)nc2sccn12 1796188713 LHQUXBBZHNVVRD-MUJYYYPQSA-N 452.301 0.001 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)F)C2 1796908468 WJABCKAZFNZPBY-MHORFTMASA-N 495.332 0.706 50 20 JCGD C[Si](C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)co1 1797751664 NCALKQZULKJYRA-CCWDJLKJSA-N 471.590 0.340 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754437 XESGAIXBYKAOFW-BKEDOTJMSA-N 470.555 0.464 50 20 JCGD N#Cc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1Cl 1798590131 JFGURSKCLBZYND-HBCWATKFSA-N 468.901 0.727 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(Br)ccc1O 1798837443 HIWVARCBFOLRKK-HBCWATKFSA-N 489.131 0.352 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC=CO1)C2)NC(=O)NCc1ccccc1 1799097633 RBOSDZZRCZQYDL-IIZPIQPGSA-N 471.558 0.615 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)c(Cl)c1)C2 1801011577 OIJIBACXXGHHRM-FVCICTRLSA-N 458.346 0.965 50 20 JCGD CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1 1801786520 VUILZRHOYMTHDS-SWLURDMPSA-N 480.525 0.982 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1804190808 NZJQSMPSNFWEQY-GRDNDAEWSA-N 466.336 0.813 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CN2CCOCC2)[C@@H]1c1cccnc1 1806907103 PVRFDNUPFMLVIE-YEYZRDMLSA-N 481.557 0.554 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365896 MNBJXPDKOOERRL-LNGMVNIQSA-N 490.369 0.482 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807366084 SCOBOTUGZXZPID-CRAIPNDOSA-N 466.332 0.288 50 20 JCGD CC(=O)c1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n[nH]1 1807369360 HSJBQDANEUINDU-UTKZUKDTSA-N 461.287 0.321 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809973217 ARUWVVVRYGYQOD-NHCUHLMSSA-N 468.359 0.967 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810121482 LAOVDHPQIWIKGC-GZWABDKCSA-N 457.361 0.240 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1ccccc1=O 1810302049 FDJPYOMYQOBEFI-RADWXHQJSA-N 489.536 0.823 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc(-n2ccnc2)ccn1 1811583439 XXPXJWVYNUTUEO-YKSBVNFPSA-N 496.336 0.976 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813407241 MKEKGCZURLTIPT-KPDCDPCYSA-N 474.326 0.944 50 20 JCGD Cn1cccc1C(=O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1813478585 AFWIORMREDICBI-UZLBHIALSA-N 475.509 0.621 50 20 JCGD CCOc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nn1 1815360943 RNISWNAIFHVISC-CQSZACIVSA-N 467.316 0.551 50 20 JCGD CC(=O)O[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(C)C 1819247885 RMVLPFSJZFUKGJ-ICSRJNTNSA-N 456.308 0.983 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])[nH]n1 1819402711 IFIXJTPRUBKJRF-CYBMUJFWSA-N 468.434 0.659 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CC(F)(F)C(=O)O)[nH]n1 1819403130 VVANQIFTJDLIJI-CYBMUJFWSA-N 465.417 0.824 50 20 JCGD CC(C)(C)n1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)nn1 1821632026 VIFAOTCIYBMOTC-AWEZNQCLSA-N 468.348 0.709 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2ccc(O)nn2)n[nH]1 1821640413 PXVFJLXKCJBAKM-QGZVFWFLSA-N 479.501 0.843 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2 1824713632 BJWSDYVIDFINKP-SKDRFNHKSA-N 455.880 0.425 50 20 JCGD Cn1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)cccc1=O 1825738003 BQLBHPKBYBSFSK-LJQANCHMSA-N 466.542 0.931 50 20 JCGD O=C(Cc1ccc(O)cn1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059741 IBSBXKVXBCODIT-QFIPXVFZSA-N 451.332 0.943 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](N)CN)CCN2C(=O)OCc2ccccc2)C1 1829049058 DSDIOFQLVMUNET-FGSXEWAUSA-N 465.982 0.742 50 20 JCGD Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1F 1830093661 BOBGMMTXMMWSSR-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1830538920 VNHIXJFQQXWZOZ-OXFYSEKESA-N 469.380 0.439 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1830542668 BBORMAOPOKNZAB-PZTGFMGMSA-N 486.407 0.875 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1 1831449214 JFBRRTMWQJQHQH-BLLLJJGKSA-N 453.355 0.132 50 20 JCGD Cc1nnc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)s1 1833021219 YQOJJXQMBYQKGM-HOCLYGCPSA-N 465.345 0.926 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1833265454 WUCDELWDWNUNOE-WFASDCNBSA-N 472.384 0.187 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)nn3)CCO2)C1 1833829620 GRIHVXJHVIAHKE-YCRPNKLZSA-N 499.952 0.384 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CNc4ccccc43)CC2)CC1)c1ccc(B(O)O)cc1 1834797963 QDKREIGOMNSIAJ-QHCPKHFHSA-N 476.386 0.761 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3c(F)cncc3F)CC2)CC1)c1cccc(B(O)O)c1 1834801186 PNFMVTCQUSTENF-UHFFFAOYSA-N 472.301 0.539 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cccc(N4CCOCC4)n3)C2)C1 1834821198 BBMRYXPUMAUGGK-NRFANRHFSA-N 497.390 0.773 50 20 JCGD CC(C)Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n(C)n1 1834946918 NNBUVTLLYZITOK-UHFFFAOYSA-N 495.433 0.797 50 20 JCGD CC(C)N[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)C(C)C 1835736940 LIHFDXDJRBLVAF-QFIPXVFZSA-N 487.649 0.893 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc(Cl)ncn3)CC2)CC1 1835738216 ZXLPTYWGFZUORQ-UHFFFAOYSA-N 486.964 0.628 50 20 JCGD Cn1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C(F)(F)F)c1 1835936958 LZJVRHDDUPZXQF-NRFANRHFSA-N 495.263 0.108 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3Cl)C2)C1 1835939594 UWDYPPRJZVELDN-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ccc(F)c1F 1835941970 VEXPYWMLOIRSOX-QHCPKHFHSA-N 474.269 0.337 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1nc3ccccn3n1)CCO2 1836393327 UGFHLLLBLKNIER-GOSISDBHSA-N 452.309 0.584 50 20 JCGD CCC(=O)C(=O)NC1CCN(C2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1836527344 FRFANOSXIJZCFY-UHFFFAOYSA-N 486.617 0.883 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1 1836833329 NICFTXRAYKRQQU-DEOSSOPVSA-N 491.508 0.012 50 20 JCGD CC[C@@H](C)[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836890862 DNSWIOAOBWLMKZ-FOIQADDNSA-N 461.563 0.704 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1 1836896006 LTNFWEOCCFFUDM-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD COc1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837459607 LOVXBJBLIZLOHA-HSZRJFAPSA-N 469.498 0.078 50 20 JCGD Cc1cnn(CC(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1837978716 SYTPPDRAEYMVMX-UHFFFAOYSA-N 469.546 0.502 50 20 JCGD COc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838295013 VTUFJTMXFLGLQE-NRFANRHFSA-N 475.527 0.139 50 20 JCGD O=C(c1nn[nH]c1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1838767422 HVKJPTMRZGWNDS-ZWNOBZJWSA-N 474.209 0.584 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1839036789 OQRJGXQQMIDGNE-OWZDWXTDSA-N 459.877 0.935 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3C3CC3)C2)C1)NC(=O)NCc1ccccc1 1839054275 QTALIBOWQDAZQG-XLGIIRLISA-N 499.612 0.835 50 20 JCGD Cc1nn(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1F 1839197961 NWHGSAMQSVNUIG-CJNGLKHVSA-N 451.268 0.628 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)c(C)n2n1 1839200413 HLWWTXNEGDYGCZ-YJBOKZPZSA-N 485.314 0.502 50 20 JCGD O=C(c1ccc(Br)cc1O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839268485 SZPZECITGCJRIQ-YJBOKZPZSA-N 477.739 0.824 50 20 JCGD COc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)ccc(F)c1F 1839381761 CCXLFUUGHHXHFD-QHCPKHFHSA-N 490.268 0.037 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839937538 UXKBHJLLLYDBKJ-VWLOTQADSA-N 466.343 0.378 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnn3CCOC)C2)C1 1839964195 JTVCHMQWNIOKRB-HNAYVOBHSA-N 473.368 0.773 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1840054997 AUAQWAPBOMAYQC-XBHMSOGKSA-N 495.932 0.434 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2s1 1840185129 JWZZFSSVGFQDEG-QFIPXVFZSA-N 477.587 0.981 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1[N+](=O)[O-] 1840187314 RXTXHPFQHWBZAY-QFIPXVFZSA-N 493.517 0.046 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CNCP(=O)(O)O)C1 1842873320 JNAZNBAFLTWFJE-LBPRGKRZSA-N 468.875 0.047 50 20 JCGD CCc1nn(C)c(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c1Br 1843147990 IOBAQVMEIWGVAM-UHFFFAOYSA-N 475.152 0.556 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)C(=O)c1ccccc1 1844263602 VVWIPCWGMLZKQI-UHFFFAOYSA-N 450.499 0.274 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C1)C(=O)NC[C@H]2C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847568790 LXOWJNDTKQVCQM-PPJUTFMOSA-N 484.981 0.161 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@](C)(O)C(F)(F)F)NC(=O)NCc1ccccc1 1847987659 CRXFHTDTKKKOSY-FTRWYGJKSA-N 471.480 0.848 50 20 JCGD COc1ccc(CC(=O)OCC(=O)NNC(=O)c2ccccc2)cc1S(=O)(=O)N1CCOCC1 8853617 JNZDPGSRKZAKFG-UHFFFAOYSA-N 491.522 0.263 50 20 JCGD Cn1c(=O)n(CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc21 10824260 MJTYWNROABVINP-UHFFFAOYSA-N 451.892 0.492 50 20 JCGD CCOC(=O)/C(C#N)=C/Nc1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1 18988627 BSWSRRYYZZVKPT-FOCLMDBBSA-N 450.517 0.927 50 20 JCGD C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727063945 MZWKUCLXHOXKMC-SECBINFHSA-N 467.255 0.647 50 20 JCGD O=C(COC(=O)CNC(=O)NCc1ccc(Cl)cc1)NNC(=O)[C@H]1COc2ccccc2O1 728341598 AGEYVJJNLCRJFR-QGZVFWFLSA-N 476.873 0.670 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CS(C)(=O)=O)o2)c1 751280632 IGKVTFFBTRIPSP-UHFFFAOYSA-N 457.530 0.930 50 20 JCGD Cn1nc(C(=O)NNC(=O)CSCc2cc(=O)n3ccsc3n2)c2ccccc2c1=O 893129983 NYDQBLPADHKWMM-UHFFFAOYSA-N 456.509 0.697 50 20 JCGD CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)o1 915244728 BCUQXNMCAUKIKV-HNNXBMFYSA-N 481.483 0.501 50 20 JCGD CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1 916383956 XLUPWKWOZMSYPH-UHFFFAOYSA-N 450.521 0.726 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)CNc3ccccc3OC)cc2S1(=O)=O 916986740 KJZKVDPBSWSOLP-UHFFFAOYSA-N 462.484 0.359 50 20 JCGD O=C(COC(=O)CNC(=O)c1ccc(Br)s1)NNC(=O)[C@H]1COc2ccccc2O1 917317313 DAEBGKSFHFUDGT-GFCCVEGCSA-N 498.311 0.771 50 20 JCGD Cc1ccc(C)c(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 920050477 BGXLUXIUSFNEKI-UHFFFAOYSA-N 465.488 0.899 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)c2ccccc2c1=O 920239870 GKYXFHRRVCVJFN-HNNXBMFYSA-N 478.575 0.955 50 20 JCGD Cn1c(=O)nc(O)c2nc(CCC(=O)NNC(=O)c3ccc(COc4ccccc4)o3)[nH]c21 920275165 MZVMZFDDXAAAPH-UHFFFAOYSA-N 452.427 0.928 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1778060865 UADHYCDNBGKQPV-JOCHJYFZSA-N 483.916 0.744 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3c1OCCC3)C2 1778092806 RDUDGSBGBCETSQ-KBDRGJQMSA-N 497.556 0.927 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)C[C@@H]3CNc4ccccc4O3)CCO2)C1 1779032719 WVNHTVZWKQFMCP-GYCJOSAFSA-N 480.525 0.392 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)C3CCN(c4ccccn4)CC3)C2)C1 1780958633 RUAHTZBPJIEXLI-VWLOTQADSA-N 478.358 0.122 50 20 JCGD CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1782026058 XNLVPGATCWHKFJ-YJBOKZPZSA-N 480.370 0.755 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)o1 1782215062 QLPKPNNBGMGIJZ-VGOFRKELSA-N 463.535 0.739 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)CCO2 1783937389 IMBRNXDFAPNAOY-OFVILXPXSA-N 471.602 0.854 50 20 JCGD COc1cc(OC)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786984888 VHSCVSQZUUPFIF-SSKFGXFMSA-N 468.315 0.291 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3nnc(C)s3)C[C@@H]21 1787508938 NEOMLKCZNSGRRB-XUFZZIBESA-N 473.559 0.503 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])[nH]3)[C@H]2C1 1789391374 FEIIIBOSIJFRMB-YPMOQXHOSA-N 471.474 0.650 50 20 JCGD CCOc1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789477915 JNYNRZSYYUMFFX-ZRCAFCQKSA-N 467.526 0.991 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnccn3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724859 PPNHQKSVOAFUME-BVSLBCMMSA-N 495.584 0.345 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21 1789866559 RNWFVSSWBYIJEY-YRBFXIGRSA-N 470.419 0.628 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CS(C)(=O)=O)nc3)C[C@@H]21 1791254077 KLNCAODIZRVJPM-OWLYRPNTSA-N 473.979 0.473 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791287907 BYHZBDWGDATZPD-VJANTYMQSA-N 495.621 0.809 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(O)cc4)CC3)C[C@@H]21 1791288001 MPDFSDRNUFAFPH-VDGAXYAQSA-N 458.559 0.777 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c(C)c1 1791292513 WEUBJAVRYWXVHW-IHPCNDPISA-N 474.558 0.748 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1792255379 KDUKMZXWOYREBJ-SIRPWMCASA-N 457.955 0.482 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC(=O)NC1 1792582756 HNQBWRZTCJGGDC-ULXNIHAVSA-N 458.465 0.988 50 20 JCGD CCNC(=S)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793879045 CFHUIHIEVYIPGB-FQLMCAECSA-N 492.042 0.192 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCn1c(=O)oc2ccccc21 1793985298 LZQKVGXLDJGULP-NXEZDXNNSA-N 451.907 0.828 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1C(=O)c2ccccc2C1=O)c1ccc(B(O)O)cc1 1794117981 GQWSOSDENBLJRT-REPLKXPHSA-N 475.310 0.305 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(S(C)(=O)=O)cn1 1794747624 SFEPISWJIIKUKH-MVRRYPJTSA-N 486.554 0.871 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c(O)c1OC 1796443653 ABRLTQANVKKJPV-RVQRMFQJSA-N 499.524 0.747 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3ncccc13)C2 1797754138 WOOVQTAERCGNJN-HBCWATKFSA-N 461.482 0.145 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1Cc3ccccc3C1=O)C2 1798440655 VDXSKKZJXKSOFO-BCDXTJNWSA-N 476.537 0.983 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1F 1798443634 QFQXLXJUYLSDQD-QDMKHBRRSA-N 489.529 0.793 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)N(C)C)C2)NC(=O)NCc1ccccc1 1799865641 FWQTVMWORAEJIR-REPLKXPHSA-N 473.578 0.242 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1802246498 ZEQALZZDSVZQSZ-JAPOXJDPSA-N 455.515 0.692 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1802894168 QUKHBZDYTKZWDC-VHQPJYBDSA-N 488.972 0.867 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)CC1 1807087075 OUSUZADLQSDFPP-QGZVFWFLSA-N 494.357 0.218 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1 1807363633 MZPSJYPJIQBMMK-UTKZUKDTSA-N 465.344 0.484 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364348 FDPWVIUTURPJJC-JHMKDJTOSA-N 451.332 0.632 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1 1807903394 PODZLMVJFJSXQF-LEAZDLGRSA-N 451.999 0.977 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1813074628 URWMTWZMDMYJGF-CVDCTZTESA-N 497.600 0.761 50 20 JCGD N#Cc1ccccc1OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347775 OEQMFQINMGXFRF-QGZVFWFLSA-N 476.323 0.999 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361099 XCQOGSOIPSYOSS-XJKSGUPXSA-N 465.344 0.944 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793393 MLMRTPNWEYWXTF-CHWSQXEVSA-N 468.543 0.900 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](N)CN)CCN2C(=O)OCc2ccccc2)C1 1829049075 DSDIOFQLVMUNET-SPEDKVCISA-N 465.982 0.742 50 20 JCGD O=C(C(Cl)Cl)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H]3C[C@H](O)CN3)C2)C1 1829359916 LXAULUNWNFPKSG-PNLZDCPESA-N 499.395 0.965 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c1 1830177575 HPBWNRXLWJZVRV-LJQANCHMSA-N 489.388 0.945 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832050900 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1835934339 WDWYEBMHHZCKFL-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD CCOc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1 1836199076 PDXLPXCJKQZNNY-UHFFFAOYSA-N 481.362 0.054 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCCS3(=O)=O)CC2)CC1)[C@@H](F)Br 1836414087 WDIUCHQEMYWAJQ-LSDHHAIUSA-N 468.389 0.826 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c2cc(O)ccc2n1 1836826648 MQKMAOUDKICTFE-RUZDIDTESA-N 499.568 0.692 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(C)(C)O)C2)C1 1838528146 HWGXDJLSLGBCKL-JOCHJYFZSA-N 479.486 0.751 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCO2)C1 1838628697 QXYFZHBJNBDXFG-VBKZILBWSA-N 485.877 0.647 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2)C1 1840152584 MRKDXRHYBXSWGR-ZOCZFRKYSA-N 493.985 0.236 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc(OC)c1C 1840187288 QPHGFGIZAATQBJ-XMMPIXPASA-N 492.573 0.455 50 20 JCGD 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Cc1cccc2c(=O)n(CCC(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)cnc12 793074705 QZGCKNFMFXYWEP-UHFFFAOYSA-N 463.903 0.857 50 20 JCGD C[C@H]1Oc2ccccc2N(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1=O 811880890 PZCFZOMUSWECGQ-OAHLLOKOSA-N 488.522 0.283 50 20 JCGD CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 912642979 YESVIFXQXPFOCQ-UHFFFAOYSA-N 498.558 0.935 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNC(=O)c2ccc(Cl)cc2)c1 916262695 NTUNNXKPWXFADB-UHFFFAOYSA-N 467.935 0.964 50 20 JCGD COc1cc(C(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)cc(OC)c1OC 916517534 XZOQJSYRVMVKAP-UHFFFAOYSA-N 466.516 0.776 50 20 JCGD O=C(NCCOc1ccc(F)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916612785 CAYYIZPXLBDLMG-UHFFFAOYSA-N 466.491 0.870 50 20 JCGD COCCn1nccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1778231937 CRDYFCFHFHNZRQ-ORNKLYHCSA-N 499.572 0.791 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CN3CCN(C)CC3)CCO2)C1 1780097638 BTLOGVGGYGGQMF-HSZRJFAPSA-N 489.529 0.211 50 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50 20 JCGD COc1cc(C#N)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797752931 MWHMFZFHYGLSOL-CWPLJXCYSA-N 464.482 0.082 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Cl)nc1Cl 1798028166 BYBDEXIZIPQPPC-FVCICTRLSA-N 464.114 0.585 50 20 JCGD CN(C)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1Cl 1800313141 YUFGDFVWIJJEAP-WOSNLTMFSA-N 485.777 0.526 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C3)CC2 1800416081 NMWWKPQJCLZGIA-RGKFVRLKSA-N 472.586 0.763 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Br)c1)C2 1801011238 CUNSOKBXGPQOAV-ZSBFGKGUSA-N 468.352 0.420 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H](F)CN1C(=O)OC(C)(C)C)C2 1801011262 FFSWBFLBPHCJBK-QOSLBHJFSA-N 499.584 0.297 50 20 JCGD O=C(CN1CCSCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1802445971 JOSUSZWNDVFBSN-KNQAVFIVSA-N 468.388 0.130 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808418103 ZEPKZJHZFBDRQB-GCMWRYGPSA-N 482.545 0.668 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810234522 RFWQRWQRKLINKL-OGWOLHLISA-N 482.545 0.107 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1 1810546131 OQEFFBYUISTADY-YSIASYRMSA-N 450.612 0.590 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1 1813070324 HVCDTLWLQHBGRY-IERDGZPVSA-N 472.506 0.265 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)COc2cccnc2)[C@@H]1c1cccnc1 1813071366 SZVZBAQARXAUPF-FDDCHVKYSA-N 454.531 0.934 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3c1OCCC3)CC2)c1ccc(B(O)O)cc1 1815348455 PIQPGJSASMPLOB-AWEZNQCLSA-N 467.316 0.342 50 20 JCGD CC(=O)N[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)C(C)(C)C 1819793340 MEKBWVHNKXNOML-SJKOYZFVSA-N 487.586 0.918 50 20 JCGD Cc1nccn1CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800047 JUZNPYVKXZIPNH-GFCCVEGCSA-N 454.516 0.573 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1826829065 AVLPOVLDWRSUAM-CHWSQXEVSA-N 468.543 0.900 50 20 JCGD COc1nn(C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050311 MFWBXEOOWXBAAY-HXUWFJFHSA-N 454.336 0.656 50 20 JCGD COC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548604 LSPCJEVJDOZAJF-WZONZLPQSA-N 495.960 0.991 50 20 JCGD CNC(=O)CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828574996 GEEHCFLIQOCUQO-JTSKRJEESA-N 480.949 0.174 50 20 JCGD O=C(C#Cc1ccc(Cl)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830467373 ZKLLXIJPJWSHSB-XMMPIXPASA-N 482.729 0.142 50 20 JCGD O=C(c1nc(-c2ccccc2)ns1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830722470 CCOXTQGQHUMSLW-MGPUTAFESA-N 466.947 0.875 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CSC1CCCC1)CCO2 1831363394 FXKHDXOEXMOEMG-OAQYLSRUSA-N 456.609 0.492 50 20 JCGD C[C@@H](CC(N)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1831609498 PFGNXPAATWAMKB-SLXWPLRWSA-N 476.480 0.840 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@](C)(O)CC(=O)O)CC1 1831875491 WIZAIMQLTWKKMI-JTSKRJEESA-N 454.568 0.595 50 20 JCGD CC[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549401 LKSPEYRKLZXARL-AVYPCKFXSA-N 463.959 0.346 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@]3(C)CCCN3)C2)C1 1832552248 ZBGZJBMWJYEVDF-KNXBSLHKSA-N 489.013 0.717 50 20 JCGD O=C(c1ccc(N2CCOCC2)cn1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1833618140 XGOGJXMLEGLUIY-FQEVSTJZSA-N 473.357 0.792 50 20 JCGD CN(CC(=O)N1CCC(N2CCC(NC(=O)c3cnc[nH]3)CC2)CC1)NC(=O)NCc1ccccc1 1834169570 AXCFEYLMNLNRGY-UHFFFAOYSA-N 496.616 0.941 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCCC4)CC2)CC1 1835572758 LTMHCJWTZCSRKI-UHFFFAOYSA-N 473.622 0.778 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1 1835737823 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COc1cc(C)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459534 IODMCAHXFLEDKO-XMMPIXPASA-N 483.525 0.386 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1 1837655697 TWHNHDWNWBOHCJ-KXBFYZLASA-N 462.330 0.824 50 20 JCGD Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n[nH]1 1837919175 MXGPFHWPYHHBHS-UHFFFAOYSA-N 454.336 0.253 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(Cl)s3)CCO2)C1 1838157957 DSTKRNQAQNAFJB-LJQANCHMSA-N 480.934 0.179 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1 1838479773 DQMFRBTVZXXCFO-KZULUSFZSA-N 456.293 0.664 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ncccn3)C2)C1 1838526786 CXVBDPZWNQNRCR-HSZRJFAPSA-N 499.480 0.623 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3F)CCO2)C1 1838859340 UIWRYUWJDOUNBZ-JOCHJYFZSA-N 475.452 0.347 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1N(C)C 1839116310 YTHVLXNOZNBLJZ-XMMPIXPASA-N 491.589 0.204 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2)C1 1839144325 VJFFTOFQBKDVLU-MRUHUIDDSA-N 477.002 0.702 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)N1CCN(C)CC1 1839154585 RTYXKHYLUUSNGL-LSTHTHJFSA-N 465.422 0.315 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839203072 YUGPBQYIMGIDTA-HSMVNMDESA-N 455.277 0.695 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1839966527 HZXYMCPDBCBAJW-UTKZUKDTSA-N 498.422 0.962 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1840033041 RAHDHDFYDQYCCL-SPLOXXLWSA-N 495.374 0.730 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nc2nccn12 1840035170 IHJUCPMMBLCCOG-LIRRHRJNSA-N 466.336 0.891 50 20 JCGD Cc1ccn2ncc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2c1 1840184267 YCOBOVCLCPKSQT-QHCPKHFHSA-N 472.546 0.086 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840391023 QCAYPTPNKDTKKS-UZUQRXQVSA-N 485.371 0.012 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1 1840484110 ZCSIGQWMKYTLEO-AUUYWEPGSA-N 456.337 0.838 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)CO2)C1 1843012467 RAXMZEPBHKCJKD-SFHVURJKSA-N 499.373 0.209 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@H](O)c2cccc(Br)c2)C1 1845040651 OQXFUVDPMYENBJ-GOSISDBHSA-N 473.132 0.680 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1846384201 POUIMPDRHXZPDI-AWEZNQCLSA-N 459.975 0.695 50 20 JCGD CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC[C@@H]2C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847563002 LRBLPPHWMSPUFH-QZWWFDLISA-N 499.008 0.551 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@@H]1COc2ccccc2O1 1847753825 XQEULZTXZMKMID-JLSDUUJJSA-N 451.483 0.731 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3nc(-c4ccncc4)no3)cc2)CC1 726376792 BNSLDKGOMSFWDR-UHFFFAOYSA-N 471.499 0.741 50 20 JCGD C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N1C(=O)NC2(CCCC2)C1=O 726521362 DTKZPFITCIFFRE-HNNXBMFYSA-N 491.570 0.875 50 20 JCGD C[C@@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NC(=O)C1CCCCC1 727292807 CVEXPKMNFKWPLY-INIZCTEOSA-N 480.587 0.944 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC 728959857 RBSMWLHLEZNVAC-UHFFFAOYSA-N 457.491 0.776 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cn(C)cn2)c1 751259646 BJOPMXZMFDKGOJ-UHFFFAOYSA-N 465.513 0.853 50 20 JCGD CSCC[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 894389682 VJBDYQIGCGMHKP-BRWVUGGUSA-N 471.543 0.720 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccc(C)c(C)c2)cc1 913450315 WYLPLPABOYJBES-UHFFFAOYSA-N 463.512 0.985 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C#N)cc2)c2ccccc2c1=O 913587872 CPAWLBWOYOQMJC-UHFFFAOYSA-N 468.495 0.589 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2csc(N3CCOCC3)n2)CC1 914559592 QQUMMVZGQWFVSD-UHFFFAOYSA-N 467.577 0.890 50 20 JCGD COc1cc(C=NNC(=O)c2csc(N3CCOCC3)n2)ccc1OCC(=O)N1CCOCC1 916338172 JAODUKCHXDIMCL-UHFFFAOYSA-N 489.554 0.990 50 20 JCGD CC(C)[C@@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919886383 VZWLDBWRQBNQCD-VTZXFWRVSA-N 454.593 0.861 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ncoc1C)c(=O)n2Cc1ccccc1 920255352 RTLFZGSXUBFYCM-UHFFFAOYSA-N 451.443 0.186 50 20 JCGD Cc1ccc2cc(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)ccc2n1 1777907052 WNFCCEDEVRLWQT-RUZDIDTESA-N 459.311 0.980 50 20 JCGD C[Si](C)(C)c1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)co1 1778997263 MKEACLPGZDPWOD-QFIPXVFZSA-N 471.590 0.581 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3cccnc13)CCO2 1779030225 KTJAUCQLSSRDFL-XMMPIXPASA-N 460.494 0.991 50 20 JCGD C[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)N1CSCSC1 1779147335 RRZQTVUHZJIUKX-XOBRGWDASA-N 480.616 0.172 50 20 JCGD Cc1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn2[nH]cnc(=O)c12 1780019565 FRZLJVDEYYCIJE-DYVFJYSZSA-N 456.272 0.465 50 20 JCGD O=C(/C=C/c1cccc(O)c1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781846816 XZFDTGCVAKFLAX-SJHHFFFWSA-N 464.327 0.913 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1781984920 VRADPKHICGIERC-JOCHJYFZSA-N 471.250 0.479 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2 1782178054 DXSUCZYXVMGXED-NOAAKOMESA-N 463.959 0.597 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782213924 ATFSONLSPREYFV-NRAIQUKZSA-N 478.590 0.629 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782213926 ATFSONLSPREYFV-YBJWPOLQSA-N 478.590 0.629 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1 1782264404 MSGDDEUTCUJLGA-GCFUEJLLSA-N 491.508 0.913 50 20 JCGD CCN(CC)[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1782813765 IYFOCNZQUIMZCH-JYFHCDHNSA-N 479.386 0.893 50 20 JCGD 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CC(=O)C[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726867 YLONANHRYPPJAD-MQGJPIDWSA-N 487.601 0.928 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C[C@@H]21 1789864535 VUQOHBJWXDZYMF-QXKUPLGCSA-N 474.986 0.752 50 20 JCGD CC(C)(C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccccn1 1791485739 IPNLAGOJHXHZSG-IHPCNDPISA-N 451.332 0.333 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cnnn3)[C@H]2C1 1791689104 VONGQMIUWIEVQC-DTPILHQWSA-N 487.473 0.361 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792975002 GPQGFZBQDBFURB-NDKCEZKHSA-N 454.351 0.308 50 20 JCGD CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2 1793456100 XKRCKOICZGHUKS-PFFSRIRZSA-N 474.986 0.752 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccco1)NC(=O)NCc1ccccc1 1794616977 ADDAHGVDEMTTLU-RMFSNUHRSA-N 455.515 0.829 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1F 1795736305 XMKYELWZAMQHGG-CWPLJXCYSA-N 473.285 0.228 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnccc1C(F)(F)F)C2)c1cccc(B(O)O)c1 1795737209 DLJXZJCIXZTXKV-UPHUGPLXSA-N 491.275 0.616 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Br)c1)C2)c1cccc(B(O)O)c1 1795740257 LFIQJQLGQQCYSH-JLVBRIDZSA-N 474.120 0.041 50 20 JCGD Cc1cn2c(=O)c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)cnc2s1 1796191436 LRASNZDDBZYFLD-BJWYYQGGSA-N 466.328 0.310 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796368078 BUEDYAJTIUJXAK-URLPEUOOSA-N 473.933 0.970 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2cnccc12 1797566130 UCMUCDLZACYREA-DFZQMDCHSA-N 463.498 0.900 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1797694581 IIAARHRWUHQKJE-QMHWVQJVSA-N 490.001 0.416 50 20 JCGD 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O=C(CCc1cncnc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1815528840 DBVWYAXCSBBASH-INIZCTEOSA-N 451.317 0.472 50 20 JCGD CC(C)n1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1 1818293368 VOLKHUZPKGADGT-KRWDZBQOSA-N 451.296 0.882 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3ON=C(c4ccccc4)O3)sc2C1)c1ccc(B(O)O)cc1 1819586633 NEKYVYLYOGRWPR-ZHRRBRCNSA-N 492.322 0.783 50 20 JCGD CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)nn1C 1819797757 IXTFDDOYIKTGAL-LLVKDONJSA-N 468.543 0.977 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)[nH]n1 1822416391 CGZSLJIAEAGGNM-CQSZACIVSA-N 460.495 0.349 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncnn1C)CC2)NC(=O)NCc1ccccc1 1822518396 OBHRBOXFVPTRHQ-HNNXBMFYSA-N 497.585 0.844 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2)N1CCN(C)CC1 1822696739 FYKGLLPDCFWYCL-GJZGRUSLSA-N 465.624 0.064 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)COc3ccc(O)nn3)sc2C1 1824557828 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O=C1Cc2cc(C(=O)N3CCC(N4CCC(NC(=O)c5ccc(B(O)O)cc5)CC4)CC3)ccc2N1 1834798528 HQSNLHDAJKXLRB-UHFFFAOYSA-N 490.369 0.360 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc(Cl)nc3)CC2)CC1)c1cccc(B(O)O)c1 1834800267 BBVPQGMLLCVOAK-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)C1(O)CCC1 1834800664 WRVSHONRRSVEAO-QGZVFWFLSA-N 457.380 0.103 50 20 JCGD Cc1ccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1835160484 COMMOVRGSAUCIR-XMMPIXPASA-N 483.525 0.143 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1835754815 NILNTSNKPAMZIA-GOSISDBHSA-N 490.395 0.838 50 20 JCGD O=C(C[C@H]1OCCc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926988 ATGJMBNDIIMDEI-ZEQKJWHPSA-N 494.353 0.141 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C(F)(F)F)C2)C1 1835931341 NFUPQKBLUUOZHP-JOCHJYFZSA-N 492.259 0.769 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836718708 ANZKPBCAFHFAQE-OAQYLSRUSA-N 464.994 0.982 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3ccccc13)CCO2 1836939922 RZLAJBQCKMXSQN-RGXRWQALSA-N 493.524 0.767 50 20 JCGD C=C(C)CC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459495 RYGOCGGJKBENCS-HSZRJFAPSA-N 459.547 0.748 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1837882331 XHFYTLCTLLSMFT-HIFRSBDPSA-N 451.337 0.268 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnnn3C)C2)C1 1838526793 DHHJOKPYTPEQSL-OAQYLSRUSA-N 488.457 0.032 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839021730 VEXAMZCQTGWQGN-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839155513 VRWUPUAUJLPSSH-VQTJNVASSA-N 485.405 0.749 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)c(F)cc1F)CCO2 1839288730 KKPUUFCMFMPKQZ-NRFANRHFSA-N 472.464 0.547 50 20 JCGD O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839482487 ZDFGWXZAZKFBRU-DNVCBOLYSA-N 467.866 0.141 50 20 JCGD O=C(c1cc2cccnc2nc1O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839513067 VWLFOGCOKYQFNA-FOIQADDNSA-N 450.879 0.005 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCS(C)(=O)=O)C2)C1 1839967731 WQRTXFNVNRTSDO-CJNGLKHVSA-N 455.371 0.051 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1 1840031146 GVKNRRPMDFSCOQ-DJJJIMSYSA-N 469.336 0.893 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1840083889 GDBJHOFDIFILJY-QRBUAGKRSA-N 456.898 0.904 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1 1840153803 ZRMJEWGGCBEUKV-HRAATJIYSA-N 463.922 0.796 50 20 JCGD COC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1840321436 BXDUZSPDXYLUIL-UTKZUKDTSA-N 498.374 0.805 50 20 JCGD CO[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1846402718 ASDLKUSOMJXJJA-APWZRJJASA-N 489.378 0.041 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)c1 16594082 VBPWLLZWWSKLAP-UHFFFAOYSA-N 466.541 0.334 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1 725873480 ZXLLEQWDXAAHQD-UHFFFAOYSA-N 469.907 0.410 50 20 JCGD CS(=O)(=O)NCCNC(=S)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1 727082858 VHOAUVICYXXKAX-LJQANCHMSA-N 461.613 0.658 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)n1 728734196 WXFLFSIKIIYWGN-LBPRGKRZSA-N 472.570 0.599 50 20 JCGD O=C(CC1CCCC1)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 750864523 ABQSLMZAYIUYNA-UHFFFAOYSA-N 452.533 0.165 50 20 JCGD CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 761465251 UYIHOQBZFYSILG-UHFFFAOYSA-N 474.948 0.154 50 20 JCGD C[C@]12CCC(=O)N1[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)CS2 912642984 YLQWPXFSTQFERB-BEFAXECRSA-N 452.558 0.686 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1 914559384 LURJSILHTAPAIU-UHFFFAOYSA-N 482.588 0.847 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2c[nH]c(C(=O)N3CCCC3)c2)c1 914562783 CZJSIIYOBWHNLA-UHFFFAOYSA-N 497.599 0.905 50 20 JCGD Cn1c(N)c(C(=O)/C(C#N)=C\c2cc(Br)ccc2OCC(=O)O)c(=O)n(C)c1=O 917623713 VRJVTDAWMTVKAR-YHYXMXQVSA-N 463.244 0.682 50 20 JCGD C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 917725360 NDHXUTPCDFEBQC-UHFFFAOYSA-N 472.932 0.527 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1 918138741 ZQCLOKSCBDLGAI-UHFFFAOYSA-N 473.490 0.359 50 20 JCGD O=C(c1nc2c(=O)[nH]c3ccccc3n2n1)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1778057199 VVHIYXSLDNBCSE-IBGZPJMESA-N 465.297 0.818 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)[C@@H]2SC(=N)NC2=O)C1 1778083249 PWPMONYZFBVMAW-ROOHJGOOSA-N 460.984 0.557 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1778436300 AETAFXAYNBMABG-DEOSSOPVSA-N 460.299 0.375 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372204 BGKBHUXCPGADFX-HOYKHHGWSA-N 492.540 0.478 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCCN3Cc3ccccc3)C2)C1 1780885955 HRNATWPSBGSQMI-IGKIAQTJSA-N 491.397 0.865 50 20 JCGD Cc1noc(N)c1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970678 ZWXVWUTVYNQYGL-HSZRJFAPSA-N 485.545 0.355 50 20 JCGD COc1c(C)cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1C 1781871650 BMOBYPJPOSYPJH-XMMPIXPASA-N 452.316 0.749 50 20 JCGD O=C([C@H](Br)Cc1ccccc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)N1CCOCC1)CCO2 1783021519 CTNOYIYJJJXKGQ-UZKOGDIHSA-N 496.402 0.473 50 20 JCGD O=C(/C=C/c1cc(F)c(F)c(F)c1)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1783718270 LFJMTVJUPOOPIW-NVIZVJJSSA-N 474.244 0.941 50 20 JCGD COc1ccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1 1783779534 ANDKANVSBMZOGI-VDGAXYAQSA-N 462.547 0.427 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3COc4ccccc4O3)C[C@@H]21)c1cccc(B(O)O)c1 1786983539 RQVNZUHLIBMWIW-UDSSINMLSA-N 480.326 0.190 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@@H]21 1788607910 UROHWBKPJLCYOF-YSSFQJQWSA-N 482.497 0.429 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cc(Cl)ccc4n3)C[C@@H]21 1788610159 GWURLDILBDNDKB-IXDGSTSKSA-N 497.943 0.893 50 20 JCGD Cc1cc(C)n2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)c2n1 1790530557 PXIKBJTWMYHBCD-NYVOZVTQSA-N 476.342 0.538 50 20 JCGD C[S@@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1792892434 OBGOCTKHOXPEAX-MAXUKSSJSA-N 480.027 0.886 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(S(C)(=O)=O)CC1 1797136716 FYYMVIOCSDCAON-DMRZNYOFSA-N 480.425 0.279 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cn2cc(Br)ccc2n1 1797477109 BJGGOTJEDRISOF-YHYOWMERSA-N 471.739 0.900 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)c2n1 1798440695 VEIZZJIIGDZOLK-MUJYYYPQSA-N 462.514 0.910 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799075665 KLENQMNFULQQOB-USGNIVHTSA-N 482.733 0.342 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1n[nH]c2cc(Cl)ccc12 1799081140 KFDGKKXINLETNC-HSAQVAQVSA-N 476.965 0.721 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)[C@@H]1C[C@H](O)CN1 1799143389 QYIYZZMURGGKRX-WXJALIKYSA-N 466.376 0.305 50 20 JCGD CS(=O)(=O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(Br)cc1 1800333878 UUGNXMXTARNYBS-SQABCVSLSA-N 496.383 0.990 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(C)c1C(F)(F)F)C2 1801009658 YQWCEMJKQBFCBS-DRXBFXEBSA-N 460.457 0.015 50 20 JCGD CCS(=O)(=O)CC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1803514162 HFLZEVPNUMDXJG-QOZRKGCKSA-N 488.570 0.656 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H](CNC(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1 1804007041 OLJRAZRMLVMFBS-GDBMZVCRSA-N 453.201 0.981 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2 1804376282 KJBMZWHDWZZLHI-MHORFTMASA-N 463.579 0.914 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCN2CCOCC2)[C@@H]1c1cccnc1 1808415300 UZTADZUZVKEGBO-SHIASZOCSA-N 495.584 0.944 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1 1809978696 XCTWFHAEDACOGT-UHFFFAOYSA-N 477.370 0.950 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1 1810354647 UFDUJLOFFAPHHW-YFVAEKQCSA-N 450.612 0.590 50 20 JCGD CC(C)(C)n1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1 1811552703 NWHBTXFNHSPCJH-WIYYLYMNSA-N 476.346 0.741 50 20 JCGD Cc1cc(C)n(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815337122 NIKGMRBRHQMUDZ-MRXNPFEDSA-N 453.333 0.562 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nc3ncccc13)CC2)c1ccc(B(O)O)cc1 1815340373 LAEXLSUZTGKTBX-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3cnnn3)sc2C1 1815675515 JJFLUDHGMPCKIV-JQWIXIFHSA-N 484.970 0.874 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3ccc4c(n3)OCCO4)sc2C1)c1cccc(B(O)O)c1 1816956707 SZDUPHVOQQBIBI-CQSZACIVSA-N 480.311 0.529 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ccc(F)cn3n1)CC2 1819799642 FACUYDZTWIONHZ-NSHDSACASA-N 495.500 0.863 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc[nH]n1)CC2)NC(=O)NCc1ccccc1 1822517956 FPETZSFNOTXIFA-CQSZACIVSA-N 483.558 0.833 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)sc2C1)c1ccc(B(O)O)cc1 1822623959 WQUONSFFIGSLRW-UAGQMJEPSA-N 482.371 0.450 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CSc2nc[nH]n2)n[nH]1 1822713175 UHSKZJBAUKQAEM-CQSZACIVSA-N 470.519 0.625 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827056524 MAJCIKCSOOQPCY-PMACEKPBSA-N 489.378 0.443 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cnn3ncccc23)CC1 1827525076 MXCGBUNLVWOVJP-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525607 SQKUBOWPWANNJK-KKSFZXQISA-N 469.922 0.003 50 20 JCGD Cc1c(Cl)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830135157 VVFKGWIMUXPWJY-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCN(Cc4ccccc4)C3)C2)C1 1830726037 NQAGDUQPYSZJHU-YZUZCNPQSA-N 480.005 0.955 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1830732824 BKFZBVXIKAEMSN-DYESRHJHSA-N 454.907 0.533 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2 1831263183 NJKLSWBIUXZJNO-HYBUGGRVSA-N 487.557 0.009 50 20 JCGD O=C(CCN1C(=O)c2ccccc2C1=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1832534699 KSUQCDGLWVGXRF-UTKZUKDTSA-N 467.881 0.664 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccnc(OC)c3)CCO2)C1 1832600125 CWCUOSHWWIDRFZ-DYESRHJHSA-N 455.939 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C34CC(F)(C3)C4)CC2)CC1 1833518868 QWOXXLXAKTVYDG-UHFFFAOYSA-N 458.538 0.763 50 20 JCGD CCC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1833532095 AMUAQZFBFVILMM-HNNXBMFYSA-N 464.958 0.405 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccnc(F)c1 1833587361 CNUWWNYZOFCKIY-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD O=C(CCN1C(=O)C=CC1=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1833613905 YWMMFRGPKXXOPH-UHFFFAOYSA-N 469.380 0.658 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@H]1CC(=O)N(C2CCCC2)C1 1833686058 OHMSZWKIZSZOMT-OXJNMPFZSA-N 469.026 0.949 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)cn3)CC2)CC1 1834336683 UYQNRZWMBZVIAX-UHFFFAOYSA-N 467.530 0.285 50 20 JCGD Cn1nc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c2c1CCC2 1834798510 DVYUIQAROZFLFG-UHFFFAOYSA-N 479.390 0.088 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccc2nc[nH]c12 1834990319 AOWCSVVFPZDKKW-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)CNC(C)(C)C)CCO2)C1 1835617268 YIRVHXAUNSVHPG-QHCPKHFHSA-N 492.529 0.978 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1835941848 RSTVNRNMSBUVPX-WZDPVOGJSA-N 490.365 0.558 50 20 JCGD Cc1ccc2oc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc2n1 1836264920 MWPKTFUGDHJYDF-XMMPIXPASA-N 479.298 0.200 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1 1836380809 HLSWTVXGMFSUGC-FXAWDEMLSA-N 473.979 0.714 50 20 JCGD O=C1NC(=O)[C@@H](CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)N1 1837116398 BUAQPLQPVDPIFF-TZMCWYRMSA-N 463.304 0.274 50 20 JCGD Cc1cc2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)[nH]c2cc1C 1837348805 UZHKZIHEROQAHG-XMMPIXPASA-N 486.573 0.623 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc(O)cn3)CC2)CC1 1837586450 UKYUPXGSDACBQK-UHFFFAOYSA-N 453.304 0.393 50 20 JCGD CN(CC(=O)N1CCC(OC2CCN(C(=O)c3nc[nH]n3)CC2)CC1)NC(=O)NCc1ccccc1 1838011384 NFIFSINWJIHIPR-UHFFFAOYSA-N 498.588 0.763 50 20 JCGD CN(CC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1)NC(=O)NCc1ccccc1 1838064928 BPWAHYGXSVSSBU-QHCPKHFHSA-N 498.628 0.859 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4cccn4)nc3)CCO2)C1 1838121129 WITUFWWTRYSKAF-LAUBAEHRSA-N 463.922 0.591 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1 1838767896 XACPXSSGMZFOGB-YMTOWFKASA-N 470.246 0.677 50 20 JCGD O=C(c1ccc2nn[nH]c2c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839629872 SEVKUZUQOXHSJZ-RHSMWYFYSA-N 456.272 0.718 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C1)CC2 1839792490 JXKWBWWQVOPWLF-LYHRCORUSA-N 466.962 0.856 50 20 JCGD CC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802323 SNZRYBGEEFQELN-NQIIRXRSSA-N 482.375 0.585 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1840034258 GGWNOERTHAXGOR-XIKOKIGWSA-N 485.360 0.609 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1840035670 ZUAYWFKUKBYNKD-UGSOOPFHSA-N 457.325 0.519 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)nc4n[nH]cc34)C2)C1 1840151560 FWEOJBNKMQMXTO-LIRRHRJNSA-N 472.329 0.935 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2 1840269969 BPCAZFXJJIPMNR-HJJMNFBYSA-N 475.546 0.128 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnn3)CCO2)C1 1840409826 GMRUAYITBIEIAV-KSSFIOAISA-N 457.325 0.485 50 20 JCGD O=C(NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1 1840800094 GZGBGHZHHOWXQV-PXNSSMCTSA-N 486.338 0.953 50 20 JCGD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1 16148401 QRFZMKRSWNSEBB-UHFFFAOYSA-N 482.467 0.909 50 20 JCGD Cc1cccc2c(=O)n(CC(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cnc12 16202600 VHNWMHVJEIGDGQ-UHFFFAOYSA-N 485.522 0.187 50 20 JCGD CCn1c(=O)c2ccccc2n(CC(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1=O 16364886 YZZBTUPYPFXQIX-UHFFFAOYSA-N 469.410 0.096 50 20 JCGD Cn1c(=O)c2c(ncn2CCC(=O)NNC(=O)c2ccc(Br)s2)n(C)c1=O 24307988 GSRLYYKEHGZRFE-UHFFFAOYSA-N 455.294 0.109 50 20 JCGD COc1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1OCC(=O)NC(C)C 117278446 LPRBQPUZXUFRPQ-UHFFFAOYSA-N 467.482 0.920 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727165041 VNGMRGLEMPISCE-UHFFFAOYSA-N 464.280 0.161 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)n(C)c1 761463695 NJVVCPONMKKCEM-UHFFFAOYSA-N 491.979 0.431 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1 912861366 XVXGCPOEPWZGBK-GFCCVEGCSA-N 452.464 0.677 50 20 JCGD COc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)cc1 913395352 FPDVHSURVNDISF-IFXJQAMLSA-N 469.450 0.579 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c1 915060049 VQCKRTWIOPFGIR-QGZVFWFLSA-N 494.595 0.799 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCOCC2)c1 915884791 KFLQZHZJFRUYOE-UHFFFAOYSA-N 477.543 0.772 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)[C@@H](C)Oc3ccc(F)cc3)cc2S1(=O)=O 916746369 OMDODADCLKPMGE-GFCCVEGCSA-N 465.459 0.845 50 20 JCGD CC(C)(C)c1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cn1 1778414699 WWKDQZXZARXDCR-PXDATVDWSA-N 480.374 0.895 50 20 JCGD Cc1nc2ccccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1778483740 RVZOGFIPRCHPBG-CJFMBICVSA-N 476.342 0.764 50 20 JCGD O=C1Cc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)ccc2N1 1778923717 JOJGXJBDLBKQRN-PXDATVDWSA-N 477.326 0.302 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3cccnc3n2)C1 1778991901 WWHBWZRRPLGPDO-WZONZLPQSA-N 478.513 0.169 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)CCO2 1779296752 CQIGBEJGLKSXCZ-JOCHJYFZSA-N 484.589 0.866 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cn1 1779370996 DPPHJFWXYDNRIK-AUSIDOKSSA-N 452.515 0.830 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371511 WNFWEJMYJFNSPH-GQWAEJPESA-N 482.379 0.844 50 20 JCGD CCn1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cc1C 1779372516 KCDXCYDYUTYEAH-AUSIDOKSSA-N 469.546 0.651 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1781105915 KDOFQGMDZBZTFC-APWZRJJASA-N 457.413 0.627 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1 1781998148 UPLYNCQGWDDJAT-HSTIPLNKSA-N 450.330 0.348 50 20 JCGD O=C(Cc1ccc(Br)cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1785383685 USCFGBMPJFZWJS-KSYCFECVSA-N 460.756 0.966 50 20 JCGD O=C(NC1(c2ccc(NC(=O)c3cc(C(=O)O)ncn3)cc2)CCC1)c1cccc(B(O)O)c1 1787085903 PPBVUJMFLIJREE-UHFFFAOYSA-N 460.255 0.916 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc2c(c1)OCO2 1787807504 OSYIQEUNMFMVRD-MDKPJZGXSA-N 452.272 0.002 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609778 JPBUPUZPMDIBRT-JVPBZIDWSA-N 495.515 0.687 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C[C@@H]21 1788610363 NSOHJYPHTDICST-XERREHJYSA-N 481.509 0.363 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]43)cc2NC1=O 1789264882 XAHSAAMSNWBVBS-VERUCKTNSA-N 487.557 0.372 50 20 JCGD CC(=O)Nc1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791998719 JMAUCNNFUPPMPM-XJABCFGWSA-N 465.315 0.232 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)no1)C2 1793880113 PRWMRSLEZUAPIK-OXIQGZBJSA-N 458.899 0.716 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1796322607 VKDKEJZJAFLFID-ZDFLXESQSA-N 477.474 0.170 50 20 JCGD CC[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)N(CC)CC 1796439447 FFXBMBIPSXJSRV-QJNSJGLKSA-N 460.579 0.830 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1occc1Br 1796544267 MIKZOLAMBFDJIE-YWVIFJGQSA-N 463.093 0.239 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)nc1 1796729763 HKTNAORNKUKYCO-BBIADKPPSA-N 496.568 0.640 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1799279620 SCCCNDLNNXPAIM-ABXQLRGKSA-N 461.302 0.582 50 20 JCGD Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(C)n1 1801230450 PAGZEZRGSXHKJX-JHDGKUDLSA-N 451.332 0.214 50 20 JCGD COC1(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)CCC1 1801615100 JXXYVRRIESOFLI-JHDGKUDLSA-N 487.601 0.881 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)C[C@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1804347998 LSFBCPICNJATGK-HLPPOEQASA-N 466.336 0.859 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1806341042 VRBFOTJQUQGOIB-QFBILLFUSA-N 460.137 0.866 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374301 YRULRNWSXLCFCJ-RXVVDRJESA-N 475.314 0.374 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1807376702 VZISCPFMHXNDEA-AVRDEDQJSA-N 488.309 0.576 50 20 JCGD CNC(=O)CC(=O)N1CC[C@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1807454007 RIUIHCIEOLIJLL-HYBUGGRVSA-N 495.584 0.570 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@@H]1SC(=N)NC1=O 1808392738 IHYIQLIDQWFQLD-MQFWEAQZSA-N 453.952 0.490 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1 1808415552 YDAVFVPYWPTVKP-FTVRPSQGSA-N 474.543 0.266 50 20 JCGD CC(C)=NO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808845555 KJCOKOXVVMWKLD-LKUPVBHCSA-N 452.320 0.882 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)[C@@H](O)N1CCOCC1 1810349654 LQNFTNDNVSVXBM-KVSKMBFKSA-N 455.353 0.523 50 20 JCGD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1 1811207704 XPBLZKHJVHEVTG-FOIQADDNSA-N 476.497 0.512 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)c1cc(=O)nc2cccnn12 1811334458 NHSJMYCSAUDQHM-ZSZQSSIHSA-N 456.890 0.404 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(CO)on2)[C@@H]1c1cccnc1 1811591301 ALPWYZNHOGJLGK-LIRRHRJNSA-N 465.470 0.194 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348374 LQHLWIFIXQZGSD-AWEZNQCLSA-N 474.348 0.573 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nc3ccncc13)CC2)c1cccc(B(O)O)c1 1815354469 DFYJGISMFBKVPN-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815355100 MWKVAVXBNHPKMF-GFCCVEGCSA-N 452.139 0.834 50 20 JCGD Cc1noc(N)c1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1817288463 OPKYGKLIAVIKPF-CQSZACIVSA-N 453.463 0.907 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cnnn2)n[nH]1)NC(=O)NCc1ccccc1 1817615640 BYCKFYRZVQDLMG-GOSISDBHSA-N 495.548 0.435 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1817977681 OHPVVITWTLCOKX-FUHWJXTLSA-N 468.348 0.422 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n[nH]1 1818112665 DPKZBAGXILWIFD-KBRXJYTESA-N 486.533 0.687 50 20 JCGD Cn1cccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c1=O 1819401978 ZGTFQAIYTLLMBR-QGZVFWFLSA-N 464.486 0.727 50 20 JCGD Cc1nnsc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797372 USTPRAGVFHWXFN-SECBINFHSA-N 458.529 0.841 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797815 LCAAGQNTPJHZNX-RYUDHWBXSA-N 473.559 0.672 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cccn(C(F)F)c3=O)sc2C1)c1ccc(B(O)O)cc1 1820254218 XDWXEWQVDIKVEF-CYBMUJFWSA-N 488.281 0.919 50 20 JCGD O=C(CNCP(=O)(O)O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1 1823004767 VWOKPWFHWNISFV-LDWIPMOCSA-N 459.234 0.470 50 20 JCGD CN(CC(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cnnn2)CC1)NC(=O)NCc1ccccc1 1827196553 NQCROURPQLZQFF-OAQYLSRUSA-N 497.604 0.639 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccnnc2O)CC1 1828924150 JTPFTCOJXFYOGA-GOSISDBHSA-N 453.503 0.728 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc2ccccc2)C1 1829052610 PLNFVWXBVJHUFW-CECAUBDESA-N 497.955 0.566 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1830543633 WYZXYJUHQXUTTG-JLTOFOAXSA-N 494.346 0.191 50 20 JCGD O=C(c1ccncc1C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728597 VQZZPWZPEUHRLN-YOEHRIQHSA-N 451.829 0.770 50 20 JCGD O=C(c1ccc(OCCCO)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830730588 AIZXHYUGTTXFON-GHTZIAJQSA-N 456.923 0.118 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737043 CRFPTDLCKCVPGY-DRSNIGMVSA-N 489.997 0.832 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C(C)(C)NCCC#N)CC2)CC1 1834715266 MHMZUZXQKLYRPK-UXHLAJHPSA-N 498.632 0.974 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cc(=O)n2[nH]cnc2n1 1834796111 KUNFJBAOSKHKJK-UHFFFAOYSA-N 480.367 0.388 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cnn(C)c3)CC2)CC1 1835118372 VEQXMGGBWONMFT-JVWAILMASA-N 468.562 0.739 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CC(C)(C)O)CCO2)C1 1835269133 ZGJSTPYTXKWTAS-JOCHJYFZSA-N 479.486 0.751 50 20 JCGD O=C(c1ccnc(C(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927029 BVVZYFUXXRLBDC-JOCHJYFZSA-N 475.257 0.083 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1835932139 PXJAVYRKSFXFCD-UQBPGWFLSA-N 466.343 0.549 50 20 JCGD O=C(c1ccc2occc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937117 PHIQPJKPYPQVNM-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(=O)COCCO)CC2)CC1 1836107381 HIVANWLUNLVEEG-UHFFFAOYSA-N 492.529 0.714 50 20 JCGD Cc1ccc2oc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc2n1 1836264919 MWPKTFUGDHJYDF-DEOSSOPVSA-N 479.298 0.200 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837319928 NNLPRGFBTCZQDN-XHDPSFHLSA-N 475.258 0.722 50 20 JCGD COc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837456617 LEJPFFYYYQOSSM-VWLOTQADSA-N 497.552 0.397 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccncc1Cl)CCO2 1837888522 YAHCBHHAINBKAA-QVGKIPNLSA-N 488.932 0.939 50 20 JCGD O=C(CC[C@H]1CCOC1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920773 DHXPWWARDKNQTQ-SFHVURJKSA-N 458.364 0.795 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC3(F)F)C2)C1)NC(=O)NCc1ccccc1 1839054161 JEKYMIJTUGYGHL-GCJKJVERSA-N 495.527 0.444 50 20 JCGD Cc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1839312042 ZQGQZCYNRLJPFA-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840084717 CGFRUYPCHZTMPU-JOXKVKLASA-N 498.316 0.298 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840803675 PORPFBXHLLPQTD-BXTJHSDWSA-N 463.959 0.346 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843013999 LWXDPLQXVUGZJM-QGZVFWFLSA-N 457.336 0.440 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2ccc3ncnn3c2)C1)NC(=O)NCc1ccccc1 1844140234 RDVSHTBWCKYGKN-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)O[C@H]2C1 1846149087 OOFAFQOXCQZUJM-RLLQIKCJSA-N 499.373 0.208 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)[C@H]2OCC[C@H]21 1846184369 QVJQETSIUNCMCY-XUVXKRRUSA-N 499.373 0.208 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cc2)CC1 1846897287 SSJJIGHYYCBEAW-UHFFFAOYSA-N 491.596 0.958 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846962235 ZFDUTXVHNIUIQW-MRXNPFEDSA-N 460.535 0.805 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN 1847944157 HMBDLSCLVAHWNP-QCSYZSNVSA-N 490.561 0.429 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)Cn2cnc3ccccc32)CC1 17405345 FXRHXNMCCSPKHX-UHFFFAOYSA-N 460.516 0.889 50 20 JCGD O=C(NCC(=O)N1CCc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 726281310 LMAJUTPRRDZYKU-UHFFFAOYSA-N 487.538 0.241 50 20 JCGD O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1ccco1)NNC(=O)[C@H]1COc2ccccc2O1 728331224 GHVIUSSPXDMEKJ-KBXCAEBGSA-N 457.439 0.805 50 20 JCGD C[C@@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)C1=O 728377892 SHDUVDUYNPZCQM-BTYIYWSLSA-N 458.496 0.189 50 20 JCGD COc1cccc(NC(=O)COc2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)c1 729275132 LRXYQXXJPDEZKI-CYBMUJFWSA-N 464.500 0.411 50 20 JCGD CC[C@H]1Nc2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2NC1=O 729717663 IFOPTNMFPBCPQH-FZKQIMNGSA-N 454.439 0.973 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)cc1OC 749290378 CYKNOJAFSCAEIF-AWEZNQCLSA-N 497.551 0.923 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])n1C)c(=O)n2Cc1ccccc1 789855342 NJAASZQDYYJWHQ-UHFFFAOYSA-N 494.468 0.136 50 20 JCGD COC(=O)c1c(S(=O)(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)n[nH]c1C 912520656 GBZYJIHCGMTNAP-UHFFFAOYSA-N 496.505 0.886 50 20 JCGD Cc1cnc(O)n1-c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 919969871 GHJCEWTWLMALBC-UHFFFAOYSA-N 485.522 0.982 50 20 JCGD CC(C)(C)C(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 920338157 ITBGVCPNRIPRBE-QGZVFWFLSA-N 480.587 0.753 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4[nH]ccc4s3)C2)C1 1778067937 PALCKCBXJCWFFE-OAQYLSRUSA-N 454.512 0.985 50 20 JCGD C[C@H]1CCc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)n[nH]c21 1778600330 DNECQCIZUYXCCJ-OFJJYEOVSA-N 466.347 0.581 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)Cn3ccnn3)CCO2)C1 1780096704 FTLXSISPIOOOHF-HXUWFJFHSA-N 458.431 0.255 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968278 ICKLIELRPGPSKS-MHECFPHRSA-N 488.589 0.029 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cncs1)CCO2)NC(=O)NCc1ccccc1 1780968663 DFXVEIIGBFQNIT-JOCHJYFZSA-N 472.571 0.933 50 20 JCGD O=C(COCCO)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1781319383 WQBCZSDIBZBQCM-XLIONFOSSA-N 455.349 0.831 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)[C@@H]1CCCS1(=O)=O 1781656159 YJVIVXJJYQBWLH-VPWBDBDCSA-N 455.346 0.768 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1 1781716911 PVPYIZJKNVFSNY-XMMPIXPASA-N 460.299 0.309 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)C(Cl)Cl)C3)cc21 1782217978 GGBPTFRYMXBCKB-AUUYWEPGSA-N 458.346 0.948 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc(F)cc3F)C2)C1 1783378083 TXFSCBKCCYZQTB-QFIPXVFZSA-N 459.453 0.650 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1783685134 AMIVSSAXVPVJKZ-VUEDXXQZSA-N 457.955 0.816 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cn(C)cc1C(F)(F)F)CCO2 1783934176 BPLPTVDALBRYLO-LJQANCHMSA-N 459.469 0.860 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)c1cccc(Br)c1)CCO2 1783935178 QHZVODKWMOHDRX-PZJWPPBQSA-N 497.390 0.685 50 20 JCGD CC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1784336273 OUUGNXSHJSCOMH-ACRUOGEOSA-N 487.601 0.928 50 20 JCGD COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cn1 1785097500 OPVIJNIWAHBRTN-FHWLQOOXSA-N 461.563 0.376 50 20 JCGD Cc1ccccc1OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786979447 KFULTZABJSOAMG-VCOUNFBDSA-N 452.316 0.347 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cc(F)ccc4n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979857 USEHVKPERGUGCZ-QSFXBCCZSA-N 466.278 0.060 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4cccc(F)c34)C[C@@H]21)c1cccc(B(O)O)c1 1786985244 VEKDPJDSWVBPGP-QOKNQOGYSA-N 466.278 0.289 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611464 YQUNDMKCMWFJHC-SLUIBLPYSA-N 468.514 0.141 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)[C@H]2C1 1791039188 RRPHXNRTPHEFTM-VTIKRNQZSA-N 483.569 0.249 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#CC(=O)O)[C@H]2C1 1791079031 WMMMIMKUSOKXFB-OWQGQXMQSA-N 459.411 0.201 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(OC)ccc3[N+](=O)[O-])C[C@@H]21 1791253561 DXEMLODSCRAOBH-XPCVCDNBSA-N 456.883 0.846 50 20 JCGD CSc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1791452425 QWKYHFINPYMBEM-NYVOZVTQSA-N 468.384 0.924 50 20 JCGD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(F)c1F 1791967096 RFHUIYHYHWIOJW-SNRMKQJTSA-N 458.270 0.860 50 20 JCGD Cn1c(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc2ccccc21 1792815373 BWWSZMMVHWUTIV-NHKMSHSESA-N 461.327 0.304 50 20 JCGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)CBr)cn2[nH]cnc(=O)c12 1792872515 LQMVGTOIQDRQRO-DNVSUFBTSA-N 466.336 0.565 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCc2sccc2C1)c1cccc(B(O)O)c1 1794160570 OHGFQAQCZMVTMO-ACDBMABISA-N 453.373 0.738 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)cnn1C 1794891840 UHBYAFKQSZBVPH-HATOLVCRSA-N 483.573 0.278 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795739208 QTGRMLDUZPFCDH-HATOLVCRSA-N 456.424 0.621 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccc(F)cn3)CC1)C2)c1cccc(B(O)O)c1 1795741430 XFAQXRLLFBXVSW-BBIADKPPSA-N 496.348 0.020 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cc(Cl)cn1 1795760927 MPYJVJQEBOIIFY-POKDIBPUSA-N 461.910 0.260 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc2nnc(Br)n2c1 1795926204 WEZBXVYPLJYRQI-GFQSEFKGSA-N 472.727 0.295 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1797208709 OBPBVTUYLYXCIK-XJTKPRQNSA-N 477.961 0.771 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#CC1(O)CCCCC1 1797783109 CXFWFYFIODZHME-DVRBRGDMSA-N 469.542 0.409 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCC(O)CC1)C2)NC(=O)NCc1ccccc1 1799097249 LHKPDNXOQVWRKJ-XSVLDXLUSA-N 487.601 0.473 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(Cl)cc1Cl)C2 1801009268 XTJPLEIXVVXIBR-DPIQGUFMSA-N 458.346 0.965 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1802202695 RPQNPBDVOOHOCV-OHQCYIMMSA-N 463.934 0.523 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CNC(=O)c2cccs2)[C@@H]1c1cccnc1 1804573819 HWNAJRWLGSXCRV-JTSKRJEESA-N 486.598 0.952 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(=O)c1ccccc1 1806236257 NOWDGHJZJSMXCZ-UNMCSNQZSA-N 457.295 0.964 50 20 JCGD Cc1nnc(CCC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)s1 1807369734 UBQWABQTLSBUHZ-AVRDEDQJSA-N 479.371 0.874 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373773 GASPULVUKSYBAE-YZGWKJHDSA-N 457.361 0.195 50 20 JCGD C[C@]1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCCN1 1808083062 OQDRBQRKNATKEW-BVZALQNUSA-N 451.531 0.542 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1808592598 VPTDDDAGRFEESL-GCJKJVERSA-N 488.309 0.576 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1 1809237484 ZRUWKGMVBSMSMF-MAUKXSAKSA-N 486.496 0.151 50 20 JCGD Cn1cc(CCC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1810301617 AQRSDJIXCGSOFF-AVRDEDQJSA-N 476.541 0.766 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C2=NN(C)C(=O)CC2)[C@@H]1c1cccnc1 1813071555 URTYGJKPWIFVEQ-HRAATJIYSA-N 457.535 0.069 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccn4c(O)nnc34)sc2C1 1816965926 AREUOJGZVSDWOI-SNVBAGLBSA-N 493.509 0.430 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cn3ncccc3n2)[nH]n1)c1cccc(B(O)O)c1 1817476026 AEZKUPFDQUEIDQ-SFHVURJKSA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)[nH]n1 1819403281 BXVZGSCYHAQIKN-QGZVFWFLSA-N 477.485 0.748 50 20 JCGD COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1828865968 QBAJEGRCSXTRDO-XMMPIXPASA-N 489.573 0.458 50 20 JCGD O=C([C@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1 1828970505 IMNSAYOOTWHTOJ-YQQAZPJKSA-N 450.349 0.947 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1 1830182076 DRAMXILLOUASOA-SFHVURJKSA-N 465.355 0.964 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(-n2nccn2)c1 1830732103 RLNGLIPCABFRKO-WIYYLYMNSA-N 463.922 0.245 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@@H]1O)CCO2 1830818616 IPAFWYBMXWIYRW-LMVRJCEZSA-N 452.935 0.339 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cc(C)on3)C2)C1 1831652109 WEPUXZQQAHDDMY-YWZLYKJASA-N 456.927 0.577 50 20 JCGD C[C@](O)(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)C(F)(F)F 1832162630 QGSMZMFMLIKKLU-KKUMJFAQSA-N 451.269 0.992 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1 1833033156 PTLBWVPRMVSBHM-SCLBCKFNSA-N 474.377 0.718 50 20 JCGD COc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1OC 1833314005 ZURYQAYQGZJTTM-MRXNPFEDSA-N 454.955 0.884 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)no1 1835108173 PTJGMMRBJVLNDG-INIZCTEOSA-N 455.943 0.483 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)/C=C/c3cnccn3)CC2)CC1 1835737529 YXLIHNVWYUKGQT-OWOJBTEDSA-N 478.557 0.374 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938301 RRKQKJVQOBAWER-SKELBMGJSA-N 468.315 0.441 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=S)NC)CCO2)C1 1837466999 ARZORLCJYAWABI-DYVFJYSZSA-N 465.414 0.100 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCCC4)CC2)CC1 1837919259 VGPYYFDAXMGUHR-UHFFFAOYSA-N 480.374 0.825 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)cc(Cl)n1)CCO2 1838240214 RPPREQATEOMRCG-NRFANRHFSA-N 494.140 0.452 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1)CCO2 1838850469 ZAWPUYPGSTXVCA-VAHWYXDJSA-N 453.499 0.891 50 20 JCGD CCN1CCC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)CC1 1839203719 UGQPKPBZTOMZJM-CRAIPNDOSA-N 450.349 0.865 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1840033262 YZZNYAJDUPINRW-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(C#N)c3)C2)C1 1840182668 PMGMVFIQYFYJLM-XMMPIXPASA-N 471.558 0.320 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3ccnc3C)CCO2)C1 1840387472 NOMPZIQGPOZXGV-JZZXMACJSA-N 499.572 0.562 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1841287623 YIVMQHIGHYSNJZ-ZDUSSCGKSA-N 450.399 0.892 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1847100752 WQOQCMDLRHOLIB-ZIAGYGMSSA-N 475.974 0.131 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cnccn1)NC(=O)NCc1ccccc1 1847670743 NYMWDTJEWHYAJK-PMACEKPBSA-N 451.531 0.567 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)[C@H](C)O)cc1C 9084208 SEUXSOZDACVBSM-LIRRHRJNSA-N 497.957 0.989 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cccnc1 20900507 HIKYXVJYADKBJS-HNNXBMFYSA-N 474.948 0.278 50 20 JCGD CS(=O)(=O)OCCN(CCCl)c1ccc(C(=O)N[C@H](CCC(=O)O)C(=O)O)cc1 27741670 QVWYCTGTGHDWFQ-CQSZACIVSA-N 450.897 0.756 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](CO)NC(=O)c2cccc(Br)c2)n1 728728876 CSOKTUPOEJOMFN-CYBMUJFWSA-N 499.343 0.238 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1 728848136 WSWPWWHRMWMPKW-QGZVFWFLSA-N 491.574 0.546 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)NCCN=c1ncnc2n(C)[nH]c(Br)c1-2 729624980 IMVBUYINPADKFH-UHFFFAOYSA-N 487.322 0.512 50 20 JCGD O=C(COC(=O)[C@H](c1ccccc1)N1CCC(O)CC1)NNC(=O)[C@@H]1COc2ccccc2O1 731247386 DPXYEDYIJRMBMW-UNMCSNQZSA-N 469.494 0.715 50 20 JCGD C[C@H](O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)OCC(=O)NNC(=O)c1cccs1 776971505 YEODUSWWSWFHPB-DJJJIMSYSA-N 491.547 0.933 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1 784682933 RODREBJVIRAOSH-UHFFFAOYSA-N 467.887 0.825 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)[C@H](C)Oc3ccccc32)cc1OC 811789235 VEGZQTQGPHRQBL-ZDUSSCGKSA-N 457.439 0.822 50 20 JCGD O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 912642944 OPIRRMQRALTZPB-HDICACEKSA-N 476.555 0.797 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)c2)CCN1 912684800 DPVBIHJZGSYWEZ-UHFFFAOYSA-N 494.913 0.079 50 20 JCGD COc1cc(N2C[C@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)cc(OC)c1OC 914280448 OPBVMCIAWFVWHF-CYBMUJFWSA-N 495.492 0.773 50 20 JCGD O=C(COc1ccc(F)cc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 914457394 XDBSMHAVAFZBJH-UHFFFAOYSA-N 455.439 0.826 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(F)c1 914746626 QIBVZUHVOUUVRR-UHFFFAOYSA-N 464.884 0.708 50 20 JCGD CCCNC(=O)CN1CCC(NC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)CC1 916518697 HMTSMSBWWBDRPG-UHFFFAOYSA-N 471.562 0.912 50 20 JCGD COc1ccc(OC)c(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 919789942 CZUCAXBSJVLQCR-UHFFFAOYSA-N 492.554 0.911 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(C(F)F)c3)CCO2)C1 1779028082 BZEHIIZEAWGUOB-OAQYLSRUSA-N 460.441 0.775 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-c4cc[nH]n4)cc3)CCO2)C1 1779036871 HOWDWBVWLYZGLG-XMMPIXPASA-N 475.509 0.833 50 20 JCGD CCSc1cccnc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1780463282 YUQUNLVMIBUXQV-QFIPXVFZSA-N 455.345 0.631 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1 1781380524 NLTQGDKAGZNLNT-HXUWFJFHSA-N 495.411 0.688 50 20 JCGD COC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1783622013 PUPVCMQOOOXSGK-UFYCRDLUSA-N 475.590 0.737 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1CN(C(=O)OC(C)(C)C)C1)CCO2 1783936590 XQZQGQKKOFUFSN-JOCHJYFZSA-N 467.567 0.056 50 20 JCGD CC(C)(C)OC(=O)N1Cc2[nH]nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)c2C1 1784086843 PMAGSGSPSAVCQS-PYTWLRIVSA-N 497.980 0.853 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3cnc[nH]3)C2)C1)NC(=O)NCc1ccccc1 1784313368 ZNFRNNYTEBHSCR-UROCCOEBSA-N 481.557 0.599 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3nccn3)C[C@@H]21 1785079179 JBWXIEYJGVBHLQ-VGWMRTNUSA-N 470.958 0.390 50 20 JCGD CCSc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982164 PPTYAXXGCBKJFN-VDGAXYAQSA-N 469.372 0.781 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N(C)C)nc3)C[C@@H]21 1787508644 MPFLFTZXUNIMEY-NYLMZZAHSA-N 481.557 0.875 50 20 JCGD Cn1ncc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)cccc21 1788065587 XYJKQUNFNLZBPW-BUKVSMQUSA-N 462.315 0.160 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c(F)cccc34)[C@H]2C1 1788395821 GAHSPYJBKKYOFZ-QRTARXTBSA-N 460.510 0.668 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cnnc4)cc3)C[C@@H]21 1788610628 NCHNMTFCHCHHMO-NDXORKPFSA-N 490.524 0.173 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1788640510 UZOKKGBTTYSWPN-VGWMRTNUSA-N 463.325 0.246 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(C)(C)C)C[C@@H]21)NC(=O)NCc1ccccc1 1789726604 CVAPLZDRQVQOFI-ACRUOGEOSA-N 488.633 0.700 50 20 JCGD CN1CCN(C2(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]43)CC2)CC1 1789806926 LCUCZVZDZVZBSP-BOSXTWCSSA-N 461.434 0.982 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cccc(N2CCOCC2)c1 1796191615 FTRWUCNDJAVCRM-UADZTWIMSA-N 463.343 0.769 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccncc1C(F)(F)F 1796625360 VSJWSKKJCBTZQT-ZSBFGKGUSA-N 463.221 0.297 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CC(N)=O)C2 1798522760 WIJGCFAIOPFSOO-BNVDUDBASA-N 462.459 0.235 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799825348 DUQAWNMSONGSEA-OPMZPASUSA-N 452.316 0.509 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CC[C@@H](N)C(N)=O)[C@@H]1c1cccnc1 1803010093 ZNIYSJGBPIEQLW-DUFGSWQCSA-N 454.369 0.711 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H](N)c2ccccn2)[C@@H]1c1cccnc1 1807166787 GCGWWISJJOVBEV-WTNAPCKOSA-N 453.547 0.555 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365471 KEZRPEWJYFYWRU-LAUBAEHRSA-N 488.288 0.577 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369792 VVWXKRNLZBSCNP-UTKZUKDTSA-N 479.277 0.491 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376842 WRQHMSOAHQGIDE-GCJKJVERSA-N 470.298 0.438 50 20 JCGD Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1807525829 QVCOMYSVVDOVAC-MGPUTAFESA-N 464.486 0.334 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cn2ncccc2n1 1809355492 HUZVJOMHCCULRT-GCJKJVERSA-N 470.298 0.438 50 20 JCGD Cn1nc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c2c1CCC2 1809358992 CBKRDWHJRKOJTA-WZONZLPQSA-N 473.342 0.617 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810248813 OBCBBVUYVZVJFL-HLAWJBBLSA-N 451.332 0.654 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n(C)n1 1810297881 FUWZPCUDUHVQDZ-MGPUTAFESA-N 478.513 0.456 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)nc2)[C@@H]1c1cccnc1 1810302297 HTBNHCJEAOBKMT-MGPUTAFESA-N 461.482 0.814 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccccc2C(N)=O)[C@H]1c1cccnc1 1810305023 IOUFUOPNWPIQBP-KKSFZXQISA-N 487.520 0.812 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1 1813071075 MIUCDRZTXWFDCH-KKSFZXQISA-N 459.576 0.863 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813619593 FQRSXJCKPCVESA-PMVMPFDFSA-N 464.375 0.954 50 20 JCGD Cc1cnc2c(C(=O)N[C@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)cnn2c1 1815344116 IOWDWUQEKXKZLK-HNNXBMFYSA-N 476.327 0.714 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816674189 NSCPWOJUIRNTHO-HYORBCNSSA-N 471.330 0.731 50 20 JCGD CC(=O)NCCC(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817282909 ODFPFZXTAUELIX-RCMPGLAHSA-N 459.532 0.715 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc(OCF)cn2)[nH]n1)c1ccc(B(O)O)cc1 1817470894 LEVJAYWZBRPJPR-KRWDZBQOSA-N 468.254 0.805 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ncccn3n1)CC2 1826086322 RQYLWNMAVJPKBI-NSHDSACASA-N 457.520 0.180 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)CC1 1827643821 MAMVRQFJCBJBHF-LEWJYISDSA-N 458.607 0.944 50 20 JCGD Cn1ncnc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828549106 VNVWDYRJAIGZMO-JTSKRJEESA-N 490.948 0.481 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830543649 XNDCBEIIORGBJJ-BEFAXECRSA-N 461.353 0.983 50 20 JCGD O=C1CCCc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc21 1830728018 NDRBOABOVLJOKW-DENIHFKCSA-N 450.919 0.875 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830730761 DJKMFRQZRFMRGX-IIBYNOLFSA-N 453.923 0.072 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCOC3=O)CCO2)C1 1831022929 BELRHGRPNYMFDD-AKMURLTLSA-N 490.463 0.780 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1831135990 AZYXJCDYRJCSOB-OXJNMPFZSA-N 481.949 0.909 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1831645687 CZVLXCWUIXNMJW-QRWLVFNGSA-N 451.911 0.912 50 20 JCGD O=C(NCCC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)c1ccc[nH]1 1832876144 QTTIJJVLYVKDRS-IBGZPJMESA-N 471.352 0.376 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1)n1cnnn1 1833266059 MIGPDTZULKXVMC-KBPBESRZSA-N 456.389 0.837 50 20 JCGD CC(=O)N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(C)(C)C 1833402034 DDTLPSAYLDPAES-QFIPXVFZSA-N 486.422 0.102 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797812 JMMPFZAMLPBDKQ-HNNXBMFYSA-N 480.212 0.583 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCCc3cccnc3)CC2)CC1)c1ccc(B(O)O)cc1 1834800565 NDBOMTSYOKZLEB-UHFFFAOYSA-N 478.402 0.970 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1834821651 SFWNHQQXPODURK-SFHVURJKSA-N 452.309 0.584 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)n1ccccc1=O 1834823456 WAXXKGWSGHTNIS-DNVCBOLYSA-N 456.337 0.651 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cn1 1834962625 IMSWEVVXHAMPBE-LJQANCHMSA-N 487.022 0.411 50 20 JCGD O=C(CCc1ccccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929612 YMEKWNPFWCUPAR-DEOSSOPVSA-N 486.761 0.723 50 20 JCGD Cc1ccc2[nH]c(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2c1 1835930701 VFIBNCMPHXNOQL-VWLOTQADSA-N 477.326 0.540 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccc4sccc4c3O)C2)C1 1835932263 XADIFISBTXBATI-XMMPIXPASA-N 496.350 0.671 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836715029 HFPOFCFHHVLSGT-LJQANCHMSA-N 488.006 0.838 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3scnc3c1)CCO2 1837063095 HAZMKYKGPCEELS-HSZRJFAPSA-N 481.339 0.360 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)n1ccccc1=O 1837684375 QTOBLDHAYLXQRA-DNVCBOLYSA-N 456.337 0.651 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)C1 1837712383 OIVVCZSAXZWWGN-QHCPKHFHSA-N 492.649 0.840 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1837713151 JZISFTUIQJUJEC-HXUWFJFHSA-N 452.584 0.587 50 20 JCGD O=C(c1nc(O)n2c1CCCC2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837759078 OOIFMDUMVYRYQF-KSSFIOAISA-N 475.315 0.686 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838386304 GBJGHNFNKNYVQT-IBGZPJMESA-N 452.596 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cncc(O)c3)CC2)CC1 1838395538 ZIXLJQHMAYGDLU-UHFFFAOYSA-N 468.514 0.712 50 20 JCGD CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)on1 1838779867 IGTOQZSYCPYTHL-NRFANRHFSA-N 451.524 0.241 50 20 JCGD CCSc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1838847190 PAENDVJBQYNKPX-QHCPKHFHSA-N 485.371 0.257 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)C1 1839109243 YRXZHHIFHRWRMJ-IGMJJTELSA-N 479.933 0.205 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839150406 LPLGTPVGTGZFHK-XOKHGSTOSA-N 474.407 0.007 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4ccc(F)cn34)CCO2)C1 1839592335 BBUHCWHTFQQCNT-YWZLYKJASA-N 454.886 0.797 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839935118 DNYFCKVUEHREIF-VWLOTQADSA-N 481.553 0.615 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)c4ncccc34)C2)C1 1840184178 BDRJDIOYLXDKDA-QHCPKHFHSA-N 472.546 0.016 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1 1840185294 JOLPZPNMUAHFEI-OAQYLSRUSA-N 454.474 0.408 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840189777 LKCGJNLJVJGPQV-FQEVSTJZSA-N 457.358 0.644 50 20 JCGD CN(CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)C(=O)OC(C)(C)C 1840910490 BTQBODIWPSZJSN-KKSFZXQISA-N 477.986 0.690 50 20 JCGD CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840914126 BGAMYBTUEZSZDD-GEYWLOKFSA-N 492.013 0.982 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(CC(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)=NO2)C1 1841353789 PLCUOKNZYLBWNH-QVKFZJNVSA-N 470.954 0.945 50 20 JCGD O=C1Nc2ccccc2Cn2nc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)cc21 1843011754 PEOKTLMSLAYMGW-UHFFFAOYSA-N 485.309 0.308 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2)NC(=O)NCc1ccccc1 1845039181 NQHACGADHVFBOB-RTWAWAEBSA-N 496.612 0.937 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@]2(NC(=O)OC(C)(C)C)CCOC2)C1 1845209097 NKIVUIAACOUDFX-JOCHJYFZSA-N 467.567 0.247 50 20 JCGD C/C=C(/C)C(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1845968726 USWPTJUDAVSWGB-VTLRUXEHSA-N 485.390 0.972 50 20 JCGD COc1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)cc(OC)c1OC 1847972412 BOYMXTNFCSTGKB-OALUTQOASA-N 468.315 0.450 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)NC2CC2)cc1S(=O)(=O)N[C@H]1CCCC[C@H]1C 9889319 WHABNKBBSFOTFP-DOMZBBRYSA-N 452.533 0.592 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=S)NC1CCOCC1)N(S(C)(=O)=O)CC2 727780543 QUSCRPAPGGQTBK-MRXNPFEDSA-N 486.616 0.627 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)NNC(=O)[C@@H]1COc2ccccc2O1 728339717 ABKYVTGAXQKZJV-YWZLYKJASA-N 497.460 0.551 50 20 JCGD O=C(CN1C[C@H](C(=O)N2CCOCC2)Oc2ccccc21)NNC(=O)c1ccc([N+](=O)[O-])cc1 741753532 COKNBFPGKOQNKX-LJQANCHMSA-N 469.454 0.482 50 20 JCGD CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)N1CCOCC1 745996222 QZRMFRCJYNWNJS-AWEZNQCLSA-N 463.354 0.825 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)COC[C@H]1CCCO1)N(S(C)(=O)=O)CC2 746385820 KFFSVYDFWNBMDO-WBVHZDCISA-N 485.559 0.296 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)COc2ccc(C)cc2)c1OC 901452914 QAOYAYTVEDFSPP-UHFFFAOYSA-N 493.538 0.873 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C 904226074 JDRGPYYWXWBVNB-LJQANCHMSA-N 491.522 0.455 50 20 JCGD COc1ccc(C(=O)NCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1[N+](=O)[O-] 912852098 KGPJCEDCWFUGHP-UHFFFAOYSA-N 464.460 0.088 50 20 JCGD Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 913181482 WXUNHNBRVDCQIW-CYBMUJFWSA-N 455.514 0.262 50 20 JCGD CC(=O)NCC(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1 913506548 ZRJWVTASLJYQDB-UHFFFAOYSA-N 452.920 0.814 50 20 JCGD CNC(=O)c1cc(S(=O)(=O)NNC(=O)c2nc(Cl)c(Cl)c(N)c2Cl)cn1C 914688855 FLCYVPPCDRWRPF-UHFFFAOYSA-N 455.711 0.945 50 20 JCGD COCCS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(OC)cc2)c1 915636804 WHHNHYBGBLQKOI-UHFFFAOYSA-N 485.540 0.318 50 20 JCGD CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc(C(C)C)nc21 918209131 KCUAMNWHLUWITH-GFCCVEGCSA-N 465.532 0.472 50 20 JCGD Cc1cc(=O)c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nn1-c1ccccc1C(F)(F)F 919886429 XACZRFHCYSVRFG-NSHDSACASA-N 473.433 0.691 50 20 JCGD CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)s1 1317927569 SJJBAOBPQCNHDN-UHFFFAOYSA-N 459.575 0.343 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091930 ZUZOSXIWXIJAEG-GAVSOMEASA-N 474.562 0.549 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1 1779033683 BMOQRLUEDMNTNG-HSZRJFAPSA-N 463.498 0.179 50 20 JCGD Cc1ccc(NCCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(C)c1 1779117527 UCUPGKVTRMWWBT-RUZDIDTESA-N 465.359 0.929 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)N2CCOCC2)C1 1779418887 WLKAAJMXUSGQKI-QGWWYQLQSA-N 462.385 0.324 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1 1779613374 NEODFZYDUYOUHS-HSZRJFAPSA-N 476.497 0.228 50 20 JCGD CCc1cc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)n(C)n1 1779623171 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O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)[C@@H]1CC(=O)N(Cc2cccs2)C1 1785189457 SRPGGQPRPQBVBD-YFUQURRKSA-N 469.991 0.676 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc(C)c1C(=O)O 1786985239 UPIQORZOOJQVDJ-YYWHXJBOSA-N 480.326 0.589 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787506523 CKRRBKUORGFIMV-MMGYIDLSSA-N 460.535 0.015 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610840 BWUOHSJQYLEOMK-ZRCAFCQKSA-N 485.516 0.669 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c(F)c1 1791293736 GKLBMHUMXUTXQT-FNHZYXHNSA-N 450.511 0.801 50 20 JCGD COc1cccc(Cl)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1792018908 BEGFZVJPQJUURY-KNBMTAEXSA-N 472.734 0.936 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(O)O 1792800762 NLJUIWLRJIOTFZ-HSUGLBASSA-N 450.289 0.256 50 20 JCGD 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N#Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc(C(F)(F)F)c1 1799784661 IQVUQBKTMLBZGM-XEMDLRDOSA-N 487.243 0.774 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccc2o1 1799906738 WYKGNRVJKPLSFI-IVWMJMPLSA-N 450.455 0.343 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c1OCCC2 1799935948 XRYYZKCQVPIGNE-OBAMXFLESA-N 469.502 0.003 50 20 JCGD CC(C)(C)OC(=O)N1CCc2nc[nH]c2[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1800322533 CPLNOVVRESLQSL-HYUSYPKPSA-N 497.980 0.433 50 20 JCGD COCCOCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1800847817 YNXIPYYEKSEPGG-HGKCTWBKSA-N 481.384 0.057 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3CN1C)C2 1801010607 LHWMSQBCUIDCMR-SRYPRDQNSA-N 457.575 0.006 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1)C2 1801011559 NURYOUQQXYSKQD-KOCGSJPCSA-N 499.584 0.298 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1)c1cccc(B(O)O)c1 1801415229 JVMKGVMCEIZKPW-HNKHHVNMSA-N 476.264 0.775 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1801880393 HKGWSKRHTIRDJS-IYWMVGAKSA-N 483.374 0.875 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)C1 1801880668 RPOVPWQCLUNVQB-YRPNKDGESA-N 483.374 0.875 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1802140678 BJJAQWZIPAAOJN-AGYLXNLDSA-N 493.605 0.418 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807363129 OFWMUKBCRWAMTK-UGKGYDQZSA-N 477.330 0.238 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n(C)n1 1807369410 IZPJWASSFOMJSA-DYESRHJHSA-N 463.303 0.137 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1807374800 JJYCKSJZEANBAU-MMKNMNOBSA-N 462.359 0.421 50 20 JCGD CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807944211 NZQRGBIWPYNDBE-CJNGLKHVSA-N 458.910 0.792 50 20 JCGD CCn1nc(C)cc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807984972 XXBNDYHGQTXCBS-SIKLNZKXSA-N 461.331 0.920 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ncn(-c2ccccc2)n1 1808548811 WNFFOSXQHYEDJY-NFBKMPQASA-N 496.336 0.976 50 20 JCGD O=C1Cc2cc(C(=O)NC[C@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)ccc2N1 1809683015 BGCNFKGMKIYUGO-DVECYGJZSA-N 484.321 0.889 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(O)nc2)[C@@H]1c1cccnc1 1810302296 HTBNHCJEAOBKMT-FOIQADDNSA-N 461.482 0.814 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810572876 QVTMFJURFLALDQ-XTQVGHSUSA-N 473.342 0.977 50 20 JCGD O=C(CCc1ccc(O)nn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1812323945 CZHXPXFVGXXIEB-FDDCHVKYSA-N 475.314 0.209 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1 1812393597 PICSSXZXGOUOAA-WHOFXGATSA-N 455.309 0.414 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1812863488 HPIOMPRZUXHUPU-NVBFEUDRSA-N 475.307 0.311 50 20 JCGD C[C@@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1 1814779997 CXXBIISEVNTEDK-JOYOIKCWSA-N 478.311 0.873 50 20 JCGD COc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815337291 QYSUNBAFAMPYFY-AWEZNQCLSA-N 452.301 0.766 50 20 JCGD COc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1 1816610019 RKMUCXABGBOXJE-KRWDZBQOSA-N 450.264 0.508 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NNC(=O)C1)CC2 1817282216 YYMHFYXOFPROBD-OEXWIMQBSA-N 456.488 0.065 50 20 JCGD N[C@@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)c1cccnc1 1817474482 HBWYGHHLBTXDHZ-AZUAARDMSA-N 462.319 0.881 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2cc(Cl)cn2)[nH]n1)c1cccc(B(O)O)c1 1817475546 SOXMMCQARZAPPI-KRWDZBQOSA-N 456.699 0.946 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc4ncccn4n3)sc2C1 1819015670 ALSQVCLMSCFCFB-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD COCCn1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1 1822414548 WGTJFXUCRALQGK-KRWDZBQOSA-N 460.539 0.932 50 20 JCGD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn2[nH]cnc(=O)c12 1827057881 LVKQPHLZOUEAQB-OAQYLSRUSA-N 491.357 0.558 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1F 1830149341 LUSXKMCASZMWHN-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1830540250 PGYBVVSELVYUNY-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830737765 ISQSKNYNNWGVON-GLUMNXNNSA-N 456.898 0.904 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCCS2(=O)=O)CC1 1831874936 ORBQUNBNVFRQRC-ZWKOTPCHSA-N 456.609 0.556 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1832399708 FLGIMRAIJVUQGP-RUZDIDTESA-N 481.553 0.615 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833306022 JOSRHRNHOAWGLA-ROUUACIJSA-N 491.029 0.433 50 20 JCGD CC(C)(C)n1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1Cl 1833602637 IKQFMJDMNPKIPK-AUUYWEPGSA-N 463.362 0.961 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(O)cn3)CCO2)C1 1834583602 OCYNRAAJATZROE-HTAPYJJXSA-N 498.964 0.989 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(C)(C)C 1834798111 SRSSAGWZUKYDES-JOCHJYFZSA-N 486.422 0.102 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCC4)CC2)CC1)c1cccc(B(O)O)c1 1834800061 OQCIGTQXBWSUAT-UHFFFAOYSA-N 465.363 0.008 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834821807 ZJXOSFJMYWJFIP-SFHVURJKSA-N 459.341 0.385 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)C1=NN(c2ccccc2)C(=O)C1 1835134587 JVHBDUCHTXMRPV-HXUWFJFHSA-N 475.977 0.951 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccn4nccc4c3)CC2)CC1 1835628946 RXRSSWNENJZRMK-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1835642006 DDWRLSNQIZNBCU-BFUOFWGJSA-N 483.393 0.489 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2 1835642057 HGABCWWBDOOULJ-MRUHUIDDSA-N 477.002 0.702 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4c(O)cccc34)C2)C1 1835932195 SLMKNRXKUWGMHJ-VWLOTQADSA-N 491.309 0.004 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934344 WIULWDSJWNALCM-VWLOTQADSA-N 495.316 0.230 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4cccc(Cl)c43)C2)C1 1835939850 KYRRKCDGNIHVAA-CPJSRVTESA-N 498.772 0.820 50 20 JCGD COc1cc(C#N)cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1836124252 YDVMGFDEWUPJGR-UHFFFAOYSA-N 490.369 0.746 50 20 JCGD CN(CC(=O)NC1CCN(C2CCN(C(=O)c3cnc[nH]3)CC2)CC1)NC(=O)NCc1ccccc1 1836343507 GJRKFIDBBMOGKO-UHFFFAOYSA-N 496.616 0.941 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2 1836623929 AYEFFKPBWOEMGJ-RTWAWAEBSA-N 484.280 0.354 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CC3(F)F)CC2)CC1 1838269879 ORCKJBMOIBJXQH-KRWDZBQOSA-N 451.474 0.953 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1 1838474281 CGMNCMNOWAUAAD-ORAYPTAESA-N 470.320 0.911 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CN)C2)C1 1838528188 KIWDGWFBCNUZEG-LHSJRXKWSA-N 464.475 0.185 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)cc1)CCO2 1838958547 GYKYISLBVOWUEH-QFIPXVFZSA-N 458.707 0.404 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202727 NUORXRZFSMAFCW-SJLPKXTDSA-N 485.347 0.203 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1OC 1839375834 OHDXOKHBRGOWHA-HSZRJFAPSA-N 496.536 0.286 50 20 JCGD CC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839861007 ZPDNMOLVFHYHLF-GHTZIAJQSA-N 482.375 0.585 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1839962733 PZHCZQQGALMTGT-PBHICJAKSA-N 474.312 0.421 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCOCCOCCOC)CCO2)C1 1840077876 QKZZSFNSSRYCLI-XLIONFOSSA-N 495.411 0.686 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)nn3C(F)F)C2)C1 1840154328 SIDUKLPUAIYFQY-UGSOOPFHSA-N 450.870 0.910 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cc[nH]c34)C2)C1 1840184527 SBMOIGKQFVCNDL-HSZRJFAPSA-N 457.531 0.611 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(F)c1F 1840701359 NKXLRAKWZPROPB-HSZRJFAPSA-N 489.479 0.656 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCO2)C1 1840887802 DHRVQACSDFCKTH-JXFKEZNVSA-N 473.885 0.987 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1Cc3ccccc3C1)CCO2 1840944390 DTQHOGUQLBKLOO-DEOSSOPVSA-N 458.559 0.231 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C[C@H]2C[C@H]21 1843015516 LPXWWHOZBKDTAG-QRQLOZEOSA-N 469.347 0.581 50 20 JCGD N#Cc1ccc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c(C(F)(F)F)n1 1843168968 JWWYJROBRLXKNO-UHFFFAOYSA-N 458.205 0.783 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCC3)C2)NC(=O)NCc1ccccc1 1845038984 QTAQFLKPNHTNOK-UHFFFAOYSA-N 465.558 0.993 50 20 JCGD Cc1cc(C)nc(NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccc(Cl)cc2)n1 22235211 JOVCROOEJPBTRM-OAHLLOKOSA-N 475.980 0.972 50 20 JCGD Cc1nn(-c2ccccc2)c2sc(C(=O)NNC(=O)Cn3c(=O)c4c(ncn4C)n(C)c3=O)cc12 115047925 YTFQPERQJCDAPQ-UHFFFAOYSA-N 492.521 0.604 50 20 JCGD CSCCNC(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 726278014 ACLDQLFZLIZFTN-UHFFFAOYSA-N 487.586 0.757 50 20 JCGD CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1 728713291 PAZXBMKJGPPWJS-MRXNPFEDSA-N 493.929 0.946 50 20 JCGD C[C@@H]([C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1CCOCC1 729624590 YIRJGPCXEIHXOM-CVEARBPZSA-N 453.565 0.524 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c1 743855495 DOETXRXKYPHRBE-UHFFFAOYSA-N 454.464 0.488 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CCOc3ccccc3)cc2)CC1 747181024 DIUMNHSDBXAHMJ-UHFFFAOYSA-N 474.539 0.770 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccccn1 821892659 LHDAHDSXCJTVMN-QXSWTLKVSA-N 466.541 0.236 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)N2C(=O)c3ccc(C)cc3C2=O)cc1 890570948 OMHQZLWWKMLXEW-HNNXBMFYSA-N 472.523 0.756 50 20 JCGD C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)ccc1F 915165510 GMWUQWBQDMJHNU-UHFFFAOYSA-N 455.489 0.768 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c1 915166084 ZBXAWGOONIMZMM-LBPRGKRZSA-N 464.431 0.952 50 20 JCGD O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NNC(=O)c1ccc(-n2cnnn2)cc1 916513765 QZXSRDAFNDOAQP-UHFFFAOYSA-N 453.482 0.568 50 20 JCGD Cc1cc([N+](=O)[O-])c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C 918726461 NHMCWOPJQKJSIF-UHFFFAOYSA-N 498.539 0.856 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919884527 HNHHDFNHZWHQOM-AWEZNQCLSA-N 458.562 0.301 50 20 JCGD N#CCCn1cc(/C=C(\C#N)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(-c2ccccc2)n1 919887331 ZZMRIFMJQDZFLD-QIPHDZALSA-N 467.511 0.888 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 921298856 NIJHVJWWRFPFQD-CYBMUJFWSA-N 456.521 0.382 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4sc(N)nc4c3)CCO2)C1 1779030732 GZRORDQYSOEEEB-JOCHJYFZSA-N 481.538 0.634 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@]3(CN(C(=O)[C@H](C)Br)CCO3)C2)n1 1779236254 OZZBXMJNYJDILZ-LIRRHRJNSA-N 455.353 0.900 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ccccn13)C2 1779372601 NAZBHQVRJWKIIC-NTKDMRAZSA-N 477.525 0.774 50 20 JCGD Cc1nc(C)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)o1 1779736110 FLUXLKFDMVLPOT-VGOFRKELSA-N 456.503 0.731 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)ccn3C)C2)C1 1780104238 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O=C(CNc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1786809879 XAGCSOLCBBPXRO-NDXORKPFSA-N 455.295 0.211 50 20 JCGD CNc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1786827287 IRJUNTLBICNQAH-YSSFQJQWSA-N 452.515 0.634 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cnc3O)C[C@@H]21)c1ccc(B(O)O)cc1 1786978717 MZAZGFYHSDZNNZ-KKXDTOCCSA-N 459.695 0.028 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3Cl)C[C@@H]21)c1cccc(B(O)O)c1 1786983270 LAZQRWMYBDTTEZ-ZRCAFCQKSA-N 474.725 0.995 50 20 JCGD N#Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)ccc1F 1786984763 GSQYXGJFJHPRDL-XJABCFGWSA-N 465.290 0.213 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCOCC3)C[C@@H]21 1789222223 HRGIWOJGIMRLPE-LRQRDZAKSA-N 490.513 0.446 50 20 JCGD O=C(COCCO)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)Cc3ccccc3)C[C@@H]21 1789918219 GHQPXZJBDYBAJZ-OKYOBFRVSA-N 469.376 0.981 50 20 JCGD NC[C@H](N)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)Cc3ccccc3)[C@H]2C1 1790779372 CBXJNNUNQDYZJN-JCECYMMASA-N 453.381 0.258 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)C(F)(F)F)[C@H]2C1 1791311946 RNVBTIUKFGVXGI-RHYQMDGZSA-N 458.275 0.676 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3cnnn3)[C@H]2C1 1791689105 VONGQMIUWIEVQC-YWKPPDPDSA-N 487.473 0.361 50 20 JCGD COc1cc(Cl)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1792027927 HBBNIDPFPZFYPN-JHVJFLLYSA-N 472.734 0.936 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1793841619 OWNWPSUWAVXFDJ-IYWMVGAKSA-N 487.362 0.254 50 20 JCGD Cc1cc(C)n(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n1 1794121896 HZGUXBXIMULAOB-RUMRUAAYSA-N 497.600 0.436 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncnc1 1794819933 LBAGGHAOVJLOSP-FZKCQIBNSA-N 453.927 0.812 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1sc2nccnc2c1N 1795706929 XLMCVGWNIZQMBS-MJXOOREPSA-N 496.553 0.611 50 20 JCGD Cc1cc2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)[nH]c2cc1C 1797672219 FEYRKGYEZDYXTK-VPTLXERWSA-N 456.547 0.756 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=COCCC1)C2)NC(=O)NCc1ccccc1 1799097129 DTZVOIAYLWUWAO-VTYHHJSWSA-N 471.558 0.617 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1CCc2cccc(Cl)c21 1800327409 DKUXTYMMJAHLEB-YZIUBNRHSA-N 468.746 0.953 50 20 JCGD C=CC[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)NC(=O)OC(C)(C)C 1801014141 HZNKTRWBBVMXSH-SUWCGCSTSA-N 495.621 0.809 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801014381 OCRBZFVNGIXNIN-RCJHGTSTSA-N 469.583 0.252 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1801384870 BAZQSFMJYGNMAA-KEVRVKNQSA-N 471.602 0.633 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cc1cccc(F)c1)NC(C)=O 1802042528 ZLOMYJKQTIVQFZ-ZRSLWSEBSA-N 469.941 0.716 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1806340757 LYXRMRPYUUXLJH-LPHOPBHVSA-N 460.137 0.866 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1 1808417106 IXUZFVZPOPYDPC-WXHUCPAQSA-N 492.496 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN2CCCCC2)[C@H]1c1cccnc1 1810297757 DHOBNAMRLXBGNV-GCJKJVERSA-N 465.558 0.886 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1810538844 ABZDQHJXBXQJFC-RXVVDRJESA-N 482.679 0.669 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCN2CCCC2)[C@@H]1c1cccnc1 1814266158 LBWMABUPTPSXDK-GCJKJVERSA-N 465.558 0.886 50 20 JCGD O=C1Cc2cc(C(=O)N[C@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)ccc2N1 1815344086 GXIPWJZRMNQAGT-INIZCTEOSA-N 476.323 0.857 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3ccncc13)CC2)c1cccc(B(O)O)c1 1815356704 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C=CCNC(=O)/C=C\C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830533699 SAOLQJKBDKQVCX-DAFSOKFYSA-N 458.353 0.332 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1830538293 AZBYXSGFBFFDJX-MEDUHNTESA-N 460.285 0.419 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1830538683 MPJQADFGRXRCOM-ACJLOTCBSA-N 467.324 0.225 50 20 JCGD O=C(C1CCN(c2ccccc2)CC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830610245 MFRZOSUNIHKKLL-REWPJTCUSA-N 465.978 0.959 50 20 JCGD O=C(c1cn2c(Cl)cccc2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728264 RHDQCXGLJQOPPQ-IFXJQAMLSA-N 457.314 0.657 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2)C1 1831638100 ASXLDXLRHNOKNK-GCKMJXCFSA-N 477.986 0.736 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1 1833309647 IKXRLNBNSHSWOX-RBUKOAKNSA-N 485.390 0.141 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CC2)CC1)c1ccc(B(O)O)cc1 1834799041 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N[C@H](CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccnc1 1807259900 NHOGURNYQKJUOP-BGWNEDDSSA-N 473.342 0.566 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C2=NN(C)C(=O)CC2)[C@@H]1c1cccnc1 1808408028 GLHKFSOLRFWILJ-FIMQGSNUSA-N 492.540 0.830 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1809227632 ZKVMQWZECRWKEA-XXBNENTESA-N 461.331 0.664 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(C)C 1810100337 ITINAGHLMQQLNF-NNWRFLSQSA-N 467.331 0.669 50 20 JCGD C[C@]1(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCCN1 1810305948 RCDWCOJZKCYOOG-ZDWFVDTJSA-N 451.531 0.542 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3nc4ccccn4n3)C2)CC1 1810471658 YVASMQNFNWKMNU-UHFFFAOYSA-N 462.514 0.886 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1810528837 BYSUTRROWCKHTB-JXMHFOAZSA-N 479.541 0.912 50 20 JCGD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1 1811206582 ZDNZVTGXTVTBSD-DYESRHJHSA-N 461.287 0.193 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1 1812868708 KEQUUBRWBHKXRM-WHOFXGATSA-N 455.309 0.414 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)[C@@H]1SC(=N)NC1=O 1813070968 OVDHDCFYKGOZSE-LZBRWLDZSA-N 489.602 0.263 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1 1813072901 HXEWWKPCQQERKV-JTSKRJEESA-N 453.547 0.917 50 20 JCGD COc1ccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nn1 1813072909 IAZVCPUBIDPYBT-HRAATJIYSA-N 455.519 0.573 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813437493 OYBCZTZTCXZVCV-KPDCDPCYSA-N 474.326 0.944 50 20 JCGD O=C(Cc1ccc(O)cn1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813496818 VVTQRRGVPJTEPZ-MBSDFSHPSA-N 460.299 0.424 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)NC1)CC2 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N=C(N)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1828975012 SFSUSTJCHLXDOX-HXUWFJFHSA-N 485.372 0.725 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c([N+](=O)[O-])c1 1830733646 QQCBOMLQCUBLQQ-FXAWDEMLSA-N 471.894 0.202 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830738372 OLKYCJYBKOQMSI-QFBILLFUSA-N 459.858 0.333 50 20 JCGD Cc1nc[nH]c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549469 QGLYIAQMKANWOT-YCRPNKLZSA-N 485.969 0.920 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832872325 AQVGXQUUOZUMBA-FOIQADDNSA-N 485.379 0.622 50 20 JCGD NC[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)c1ccccc1 1834757200 VUDHAUXQXDCKOX-QFIPXVFZSA-N 493.612 0.613 50 20 JCGD Nc1n[nH]c(CCC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)n1 1835668369 NUIMXPNEPUBYGV-HNNXBMFYSA-N 460.352 0.582 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1836286411 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C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1840032865 MJKIZFUBUWYYOK-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1840035414 QJCFUJMVQCTBHI-ZMZPIMSZSA-N 459.293 0.657 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1 1840036949 TZYMWARLPSKPCF-BFUOFWGJSA-N 454.321 0.639 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(Br)cnn3C)C2)C1 1840152941 ZATIDQXVTPEFOU-CXAGYDPISA-N 479.759 0.506 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1840154636 ASIWGVPFENAMBA-VBKZILBWSA-N 484.962 0.450 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1 1840154908 JOYWFJKRUNYHMN-LPHOPBHVSA-N 457.867 0.624 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1 1840155164 RONVBLOWCRDPQY-IFXJQAMLSA-N 457.867 0.624 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@](C)(O)CC(=O)O)CCO2)C1 1840180976 LPGQJHZEVPVGFF-KURKYZTESA-N 455.335 0.295 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1 1840184517 RUSVZTMMUOESNU-JOCHJYFZSA-N 476.509 0.145 50 20 JCGD O=C(CCN1C(=O)c2ccccc2C1=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840186470 IWFVLBLQNVTHBS-OAQYLSRUSA-N 484.336 0.933 50 20 JCGD Cc1ccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)s1 1840394923 FRHQXRXVQURCJY-YVSHKSEASA-N 470.356 0.520 50 20 JCGD COc1cc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840640813 PVXXXYCUWBTCPJ-HSZRJFAPSA-N 487.488 0.217 50 20 JCGD CC(C)(C)OC(=O)N1Cc2[nH]nc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)c2C1 1843010844 KCONAOXBCBXIQZ-UHFFFAOYSA-N 495.345 0.471 50 20 JCGD CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1847072836 HEVAMLMFJDZCIJ-GOSISDBHSA-N 459.352 0.877 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CNC(=O)OC(C)(C)C 1847511471 QEDXEFRKHPAUNG-PNSAHNHYSA-N 476.534 0.208 50 20 JCGD 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Cc1sc2ncn(CC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c(=O)c2c1C 807636272 MAVONECNCPJGLB-OAHLLOKOSA-N 472.479 0.605 50 20 JCGD O=C(CCC(=O)N1CC[C@@H](B(O)O)C1)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 864233532 INOYGQUQKYRYMH-CQSZACIVSA-N 457.745 0.028 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCN(C(C)=O)CC3)c2)cc1 913429487 AXODMJXDXFSVIO-UHFFFAOYSA-N 489.554 0.421 50 20 JCGD CC(C)CS(=O)(=O)CCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916032649 DLGOTMFZJKYLRL-UHFFFAOYSA-N 489.616 0.248 50 20 JCGD CCOc1ncccc1CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916400829 VZWWQRSJKIHLEN-UHFFFAOYSA-N 491.570 0.964 50 20 JCGD C[C@H](CN1CCCCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916462075 PPXHYSSUHRBVCV-MRXNPFEDSA-N 453.565 0.526 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCN(CCO)CC2)cc1 920853722 RPWRWJUEEWPIQR-NBVRZTHBSA-N 452.515 0.478 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCS(=O)(=O)c3ccccc3)nc2)CC1 921248349 WEGVCNPMGVFZPX-UHFFFAOYSA-N 496.615 0.508 50 20 JCGD 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C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)CCO2 1839082868 RZBOZUGCXGNAOL-SPEDKVCISA-N 467.639 0.695 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)no1 1839154034 ZKUKNCIZAOYLSO-MOPGFXCFSA-N 477.345 0.406 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(=O)[nH]c1C 1839197803 ISZAPTFBZKCGOZ-SUMWQHHRSA-N 461.288 0.147 50 20 JCGD O=C(CSc1nc[nH]n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839203461 LTLGDVMMWYGBOX-RISCZKNCSA-N 452.306 0.044 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839210601 VOWOMEQTMHURSE-BFUOFWGJSA-N 484.377 0.522 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(CC#N)cc1)CCO2 1839361869 KTJKQUBBDHESLG-QMFOPCRCSA-N 492.536 0.957 50 20 JCGD Cn1nc2c(c1C(=O)N1CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C1)CCC2 1839583661 LLVMCTYIURVTBW-CRAIPNDOSA-N 459.316 0.669 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3ccncc3=O)CCO2)C1 1839665204 QGNPXMLUPJXTFT-CIOPSUNISA-N 499.474 0.585 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OCCCO)cc3)C2)C1 1840154224 PYXSHSPBKMIQEV-UGKGYDQZSA-N 470.950 0.772 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c(Cl)ccc4c3OCO4)C2)C1 1840184565 VOVIGNGOOISGCA-JOCHJYFZSA-N 496.948 0.512 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc2c[nH]nc12 1840184988 GSOFVBWVJBMOGP-QHCPKHFHSA-N 472.546 0.314 50 20 JCGD O=C1Nc2ccccc2Cn2nc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)cc21 1843014160 FBKRCFKTZZBUIB-UHFFFAOYSA-N 485.309 0.308 50 20 JCGD COC1(CC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CN(C(=O)OC(C)(C)C)C1 1843846908 DGXXOSGVEKBTMO-UHFFFAOYSA-N 487.362 0.209 50 20 JCGD C[C@@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1ccnn1 1845814498 HLMUMDMTNAPWLR-KRWDZBQOSA-N 454.535 0.389 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@]1(C)CN(C(=O)OC(C)(C)C)CC[C@@H]1O 1847239484 VUROIAONBLOOML-LZDTVADOSA-N 495.621 0.569 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n1 1848306794 NFRZRFUUSGSYEF-KGJUXEOCSA-N 451.487 0.989 50 20 JCGD CSCC[C@@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)NNC(=O)C1CC1 11776535 YBAFJAFMCQJRMF-OAHLLOKOSA-N 477.008 0.999 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H](C)Oc3ccccc3F)CC2)cn1C 109582967 BNHZASCEKDPNRP-ZDUSSCGKSA-N 467.523 0.883 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H]1CCCOC1)c(=O)n2Cc1ccccc1 727726421 YQTVSTQTOIVOLA-GOSISDBHSA-N 482.541 0.638 50 20 JCGD COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)cc1 729275989 UUXAHKDUAVGWLR-CYBMUJFWSA-N 484.556 0.503 50 20 JCGD Cn1[nH]c(Br)c2c(=NCCNC(=O)NNC(=O)COc3ccccc3C#N)ncnc1-2 729626141 JCAGAPZDEIBSQK-UHFFFAOYSA-N 488.306 0.192 50 20 JCGD O=C(NCCS(=O)(=O)N1CCSCC1)NNC(=O)c1ccc(F)cc1Br 730672793 MVCBRVHLBXKCJW-UHFFFAOYSA-N 469.358 0.911 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 832870443 KLBCKVCHLUFEJM-LBPRGKRZSA-N 475.365 0.522 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CNS(=O)(=O)c1cccc(F)c1 912848150 GWIMXOPQVGQULW-UHFFFAOYSA-N 457.509 0.167 50 20 JCGD COc1ccc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1S(=O)(=O)N1CCCC1 912921393 PDRSKNBZGVMABP-HZPDHXFCSA-N 468.576 0.740 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)Cn1c(=O)oc2cc(S(N)(=O)=O)ccc21 914602230 KZYVUIFDBROFQR-UHFFFAOYSA-N 472.483 0.002 50 20 JCGD O=C(COC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1)NNC(=O)[C@@H]1COc2ccccc2O1 914856456 YKQFRUIPKNYBGA-SFHVURJKSA-N 468.397 0.516 50 20 JCGD Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c(O)nc1=O 915058879 ZQZCUBKFNOLVOU-UHFFFAOYSA-N 457.468 0.039 50 20 JCGD COC(=O)c1ccccc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 916111058 KPGWVDKYCMASOD-UHFFFAOYSA-N 455.514 0.412 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)c1 918138087 JUIZNXQDGPIKPK-UHFFFAOYSA-N 465.507 0.727 50 20 JCGD CC(C)(C)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1 920473585 SMYVKDLLFPMUOV-UHFFFAOYSA-N 454.549 0.351 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1 1778933578 QAPFBBWIRQYUIF-GAJHUEQPSA-N 459.547 0.453 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1779073549 QEOLXFREEAOQEH-WOSRLPQWSA-N 453.261 0.002 50 20 JCGD COC(=O)C1(C(=O)N2CCO[C@]3(CCN(C(=O)c4cc([N+](=O)[O-])ccc4OC(C)=O)C3)C2)CC1 1780098137 CWRGXPCLYHRYTC-NRFANRHFSA-N 475.454 0.917 50 20 JCGD COc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C#N)c1 1781172642 BPRYXOUTSKULAA-DEOSSOPVSA-N 478.509 0.252 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1782173940 UCJOUEJTPCBBLW-WHSLLNHNSA-N 485.006 0.659 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1782671404 WHMKLPUSXANORK-WPKBUWHJSA-N 457.300 0.720 50 20 JCGD COc1ccc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(F)c1 1783658960 FEUWGYOOXLMSDU-HLZSCNFSSA-N 468.290 0.671 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1783685131 AMIVSSAXVPVJKZ-REABXYAWSA-N 457.955 0.816 50 20 JCGD COC(=O)[C@@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2)NC(=O)OC(C)(C)C 1783787477 OUMFZTIDCBKVII-BBEGDGIKSA-N 465.906 0.807 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ncn4nc(N5CCOCC5)ccc34)CCO2)C1 1783875348 LYQHAFCAVBUYPY-OPAMFIHVSA-N 492.964 0.263 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783942008 GDYKAEYSRQLRQS-KZULUSFZSA-N 454.351 0.896 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C[C@@H]21 1783966992 NXYJUYCRDWOVHA-MDLJMBGESA-N 482.379 0.606 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784093646 CYRQIZYSTHEQSN-KSWRQPAISA-N 459.971 0.965 50 20 JCGD CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785583874 QRGLNMPWSXTYGO-UZUQRXQVSA-N 483.610 0.883 50 20 JCGD Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(C)s1 1786980238 YIWBAGXOPMMNDP-QRFRQXIXSA-N 457.361 0.276 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)[C@H]3CCCS3(=O)=O)CCC2)cc1)c1ccc(B(O)O)cc1 1788143865 ZWDJUKXESZNCMN-LJQANCHMSA-N 456.329 0.691 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc2ncsc12 1788403392 LMAHPXAQOBOSBC-QSFXBCCZSA-N 465.340 0.883 50 20 JCGD COc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788611342 VGASFUQKZMRQMZ-GMVOTWDCSA-N 471.489 0.740 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)ccc1F 1791946953 LOGCWLAIURKTPW-BXWFABGCSA-N 450.511 0.801 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(F)ccc1Br 1792689755 TUEKGUSAGZVKIX-HBCWATKFSA-N 491.122 0.785 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)ccc12 1795924296 ATVZEFIRNIXTAI-FSDCSDTHSA-N 464.906 0.314 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc([N+](=O)[O-])cc2c1OCC2 1796191854 GYVVZBYBYFJWRB-BCDXTJNWSA-N 465.271 0.775 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cccnc2n1 1797387390 ZKCVUNDNJATFSA-LOHQAQBBSA-N 464.486 0.067 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2cc(Cl)ccc12 1797510533 WFLGLOGWAKGHRL-DBWKPXFBSA-N 462.938 0.793 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1[N+](=O)[O-])C2 1797756346 CDAUHMOCYOMIRT-VTEUUUEMSA-N 486.460 0.178 50 20 JCGD COC(=O)CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798521417 HMWJETSQQHVWPN-VTEUUUEMSA-N 495.510 0.630 50 20 JCGD COCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl 1799279572 RJDWGSXMKKJQII-LORHWOILSA-N 455.379 0.882 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(C(=O)OC(C)(C)C)CC1)C2 1801014518 WGHLOHBCCREVNV-RMFSNUHRSA-N 495.621 0.596 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1803147734 GTLQUSTYIQVOSL-HPFXQQBRSA-N 497.980 0.456 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807365858 PPWPCKIARPUWPE-NNWRFLSQSA-N 450.348 0.565 50 20 JCGD CN1CCC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C1 1807367068 PUOBDLNWXKCOAP-JAXLGGSGSA-N 450.348 0.423 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCNC(=O)c2ccc[nH]2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369823 WXTMOCGGXHSEOD-CVDCTZTESA-N 489.341 0.229 50 20 JCGD O=C(Cc1cscn1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807489776 YXWNFCIJVJRXLO-LAUBAEHRSA-N 450.329 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1 1809707267 ZWUNTLJAJAVJRO-FOIQADDNSA-N 485.508 0.985 50 20 JCGD COCC1(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1810293590 GAETZZNMJCAAGX-QFBILLFUSA-N 452.515 0.826 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1 1810302503 LDOAWIKHBYTUEK-QVKFZJNVSA-N 485.508 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1 1812498268 JGHSMVBBBBIBTF-HLIPFELVSA-N 465.576 0.038 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnc3c(c2)CCNCC3)[C@H]1c1cccnc1 1813074875 UIOMOELMEKEGEL-CPJSRVTESA-N 493.612 0.857 50 20 JCGD O=C(C/N=C/c1ccco1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356337 CSLIEQKUFYEYIR-QCXKMSLLSA-N 452.301 0.761 50 20 JCGD Cc1cc(C)n(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1 1815926641 YOMMIRAVSYBPOU-LJQANCHMSA-N 450.308 0.909 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)n1 1817856624 ARCAIAAIVGIHIV-CYBMUJFWSA-N 497.298 0.674 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(=O)n2[nH]cnc2n1 1823002272 CBFSLMAPERSHRD-UPONEAKYSA-N 470.284 0.790 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1826719932 WLDCQIUTYRFSDH-QHCPKHFHSA-N 470.423 0.237 50 20 JCGD CC(=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548289 ICEMNCGSLBFYNF-UTKZUKDTSA-N 451.907 0.627 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)N1C(=O)OC(C)(C)C 1829640425 ZDOYIACZZQIVIJ-ACTFIFLWSA-N 489.997 0.831 50 20 JCGD CC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1830513341 CIPOOUWIAZZUEF-AUSJPIAWSA-N 463.959 0.346 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1830575809 YSZWRIVUXMOZRJ-PNHOKKKMSA-N 498.404 0.565 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1831655421 YINIKKJLRBADAX-WIYYLYMNSA-N 457.015 0.630 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)CCO2 1832042700 IPTRGMRVHOTWLL-YCRPNKLZSA-N 477.986 1.000 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(F)cc3F)CCO2)C1 1832141603 YEGPYALEENPMMK-KURNWNDPSA-N 480.512 0.807 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1cc(F)ccc1Cl)CCO2 1832273285 QHODGJIDFMNAND-QFIPXVFZSA-N 484.956 0.851 50 20 JCGD Cc1csc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1832979199 DGTJGFDPSMVAGP-HSZRJFAPSA-N 472.372 0.439 50 20 JCGD O=C(c1cnnc(Cl)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1833209709 VACWQKVLAJMOGB-IUODEOHRSA-N 451.680 0.891 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)CCO2)C1 1833726239 XBZPVISEMWLWIY-UZUQRXQVSA-N 493.992 0.495 50 20 JCGD CC(=O)C(=O)NC1CCN(C2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1834387001 PUBCCAKMUAEYQD-UHFFFAOYSA-N 472.590 0.493 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800377 FKDZZMXGRCHIMR-HNNXBMFYSA-N 480.212 0.583 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1F 1835490666 LLQMRQPVQWDKBH-MPBGBICISA-N 478.876 0.652 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(O)nc3)CC2)CC1 1835737825 FIRPDZWBPRSOPR-UHFFFAOYSA-N 467.530 0.285 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C3(c4ccc(F)cc4)CC3)C2)C1 1835927178 KCGUNEJMFIHJOI-XMMPIXPASA-N 482.317 0.307 50 20 JCGD COc1cc(C)ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835940901 DBYNQYBQHOSAKJ-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)no1 1835982679 NHWRIEXJNPSTQH-UHFFFAOYSA-N 454.336 0.416 50 20 JCGD Cc1cnc2c(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)cnn2c1 1836949230 DRJUDAMLKHHNKB-KSSFIOAISA-N 470.299 0.798 50 20 JCGD O=C(c1ccc2ncnn2c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837170367 OPSXQYVUJYWLDV-PBHICJAKSA-N 456.272 0.490 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1837677876 IERIPBNKMQMYKJ-NIKGAXFTSA-N 452.379 0.984 50 20 JCGD O=C(c1ccnc(Cl)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837924425 AUBJEXMTLDMENE-ABAIWWIYSA-N 451.680 0.891 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C3=COCCC3)CC2)CC1 1838395365 HYABAOORKBTKNK-UHFFFAOYSA-N 457.531 0.992 50 20 JCGD O=C(c1cc2cccnn2n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1838427125 WTJDONSSMNMZKQ-WMLDXEAASA-N 456.272 0.490 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CC(C)(C)O)C2)C1 1838528147 HWGXDJLSLGBCKL-QFIPXVFZSA-N 479.486 0.751 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1 1838621631 NEZXVILZQXCFFR-RBUKOAKNSA-N 491.633 0.759 50 20 JCGD CCc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838838865 CSWWMFDGKCBQKN-FQEVSTJZSA-N 453.565 0.149 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c(=O)[nH]c1C 1839151091 HZGSFNLCOOBOPS-RTBURBONSA-N 461.346 0.693 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839466955 DBJYTVGRXYJCBM-JOCHJYFZSA-N 493.517 0.052 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCO2)C1 1839914314 YYSXOWYQIWZHDQ-AIYYMTJKSA-N 471.558 0.581 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1 1840033816 ROPJVTWGFGGHCO-RNODOKPDSA-N 466.332 0.783 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc(Cl)n1 1840184802 AQFKXICOBSFWKO-OAQYLSRUSA-N 483.953 0.187 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nc1 1840185380 PLGFZEPMEDNIHP-XMMPIXPASA-N 491.589 0.377 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2 1840948897 UFYHEKUGVHXEEN-VXKWHMMOSA-N 464.274 0.182 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)c1ccc(F)cc1 1844264902 WNZJAYFGWNTABV-IBGZPJMESA-N 468.489 0.519 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2ccc(Br)nc2)C1 1844990286 OMTKEBRODLAVIN-UHFFFAOYSA-N 452.353 0.963 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@H]2F)C1 1845094102 DNDZURDJFXRZQE-OTWHNJEPSA-N 489.353 0.364 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1846129325 KKYAYASVVANANQ-CJAUYULYSA-N 483.374 0.831 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1846363391 GHBRGVMGJSNFDE-KRWDZBQOSA-N 451.955 0.790 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1ccc2sccc2c1=O 1848180656 OCFIGGBVPHTYOC-IRXDYDNUSA-N 466.523 0.577 50 20 JCGD NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 17514896 ZESSSVVSFYBUEX-UHFFFAOYSA-N 480.568 0.512 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NNC(=O)COc1ccc(Br)cc1 725871108 CNSYIEWCEAQKJX-UHFFFAOYSA-N 470.305 0.681 50 20 JCGD CCc1ccccc1OCC(=O)NNC(=O)NCCC(=O)N1CCN(c2ncccn2)CC1 726710477 BEHQLBRRSFWUMS-UHFFFAOYSA-N 455.519 0.487 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1nc(-c2ccccc2)no1 728080606 ISBIRFGYTSWIFV-MRXNPFEDSA-N 479.540 0.962 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cscn1)c(=O)n2Cc1ccccc1 728515819 UYPLJJMIRLOOEL-UHFFFAOYSA-N 453.484 0.346 50 20 JCGD N#Cc1ccccc1OCC(=O)NNC(=O)NCc1cccnc1N1CCC(C(N)=O)CC1 729611861 VUGLJAXVJHXFOJ-UHFFFAOYSA-N 451.487 0.564 50 20 JCGD CN1CCN(CC(=O)N(C)c2ccc(NC(=O)NNC(=O)COc3ccccc3O)cc2)CC1 730899640 GKIFNOBDEAFGLB-UHFFFAOYSA-N 470.530 0.834 50 20 JCGD CCN(CC)Cc1ccc(C(=O)NNC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)o1 746396223 FVTZUBDZAGVSNI-CYBMUJFWSA-N 453.521 0.048 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)NCc1ccco1)c(=O)n2Cc1ccccc1 754573291 BXMYXOSKUJUQES-UHFFFAOYSA-N 495.496 0.178 50 20 JCGD CCn1nc(C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)c2ccccc2c1=O 913081136 BMTSWIRYCRMVIF-QGZVFWFLSA-N 465.445 0.437 50 20 JCGD C=CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 915789075 FOGHZHQDQREENX-UHFFFAOYSA-N 472.932 0.527 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cn1c(O)nc2ccccc21 916093000 VDHCBLAPCHLPQG-UHFFFAOYSA-N 487.538 0.543 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)NCCC(=O)N2CCN(C)CC2)c2ccccc2c1=O 916433182 FITSIKXODMNBBH-UHFFFAOYSA-N 471.562 0.695 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cc2c(=O)n(C)c(=O)n(C)c2n1C 919690019 HHKKMIVCNSOBSJ-JTQLQIEISA-N 478.303 0.567 50 20 JCGD O=C(NNC(=O)c1ccc2c(=O)n(-c3ccccc3)c(O)nc2c1)N[C@H]1CCS(=O)(=O)C1 919889884 VYGUAIWJLRJZMS-ZDUSSCGKSA-N 457.468 0.222 50 20 JCGD COc1ccccc1NC(=S)NNC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1 920213592 JNIGOAPWOXEPEM-UHFFFAOYSA-N 465.557 0.811 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778115734 AEKIJALOSUTOOR-GUYCJALGSA-N 466.398 0.271 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1 1778245219 JSASPKRIBWNGPP-WMZHIEFXSA-N 451.483 0.132 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2 1779029589 ZHZVVVSFDUGMQG-QHCPKHFHSA-N 467.501 1.000 50 20 JCGD Cn1c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc2ccccc21 1779030761 WRQLANHRAPFLFU-XMMPIXPASA-N 462.510 0.934 50 20 JCGD N#Cc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1Cl 1779032580 NRSUMBPYWIVFET-QFIPXVFZSA-N 468.901 0.967 50 20 JCGD CC(=O)NCCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780098541 OIGXMTHSWLUJCO-NRFANRHFSA-N 462.459 0.490 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1780156237 NCMPHTIOBHMGKB-HNAYVOBHSA-N 473.295 0.970 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1cccn1 1780969734 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464.283 0.644 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)cc2C1 1797319040 OKWPZRIBSYOTTJ-DACLVMHWSA-N 497.980 0.437 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097587 PTIHFLWSCZICRB-RPUPUWCGSA-N 488.589 0.723 50 20 JCGD CCOc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1OC 1800858188 PUHMJBOQTXRGKY-NHKMSHSESA-N 482.342 0.220 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1801244034 AGHPLLNWVGQGHF-KUHBDSFDSA-N 485.969 0.035 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803148604 VFZSQKPCMPUSSP-QNDJGXFYSA-N 459.934 0.901 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363969 QQXLOVBGQCDHIH-VGSWGCGISA-N 470.298 0.666 50 20 JCGD Cc1nccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1808763417 MBYYRDHNRWJPBW-OXQOHEQNSA-N 460.498 0.812 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1810304197 APBFDCYJINKZBY-YJBOKZPZSA-N 466.498 0.353 50 20 JCGD CCCNC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350271 NPKAWICFZCEKJR-HNNXBMFYSA-N 458.349 0.355 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc2ncccn2n1 1819031953 UUCRARXOSGDHLR-SFHVURJKSA-N 459.275 0.752 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1819355076 IWGABOPRNHUQQG-HIFRSBDPSA-N 450.544 0.482 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824467536 PPUMENSKHZSKCC-SFHVURJKSA-N 465.576 0.353 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1828761675 JCFQACPJTFKJMR-XONZVBHBSA-N 490.561 0.805 50 20 JCGD CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCN2C(=O)OCc1ccccc1 1829001647 ZJJBUVKOHUDIQU-RUZDIDTESA-N 479.342 0.842 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1 1830535488 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C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836780582 DOLPSQINXLLICJ-VQTJNVASSA-N 488.372 0.323 50 20 JCGD COC(=O)CSCC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836870548 KGIUBEGNICGCTB-UHFFFAOYSA-N 493.586 0.204 50 20 JCGD N#Cc1cccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457129 YCRFRPQDUGISJW-RUZDIDTESA-N 492.536 0.260 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(C)n[nH]c1C)CCO2 1837804409 VGYYPXNEJJJXAC-XDEFOSFOSA-N 471.518 0.231 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921376 FSVLCFUSLJDYDF-JQIJEIRASA-N 457.336 0.019 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1838468918 SEOUCVFCGIVXBW-KKSFZXQISA-N 465.938 0.809 50 20 JCGD CN1CCC[C@@H](C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)C1 1838617485 RNMGAOIAAWNCQC-GOSISDBHSA-N 451.612 0.700 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)c(O)c1 1838887974 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CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccoc4C3)C2)C1 1840182825 VOVYDQWMWXYQPJ-MBSDFSHPSA-N 462.547 0.214 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840908548 NNJIQKYZAGRADP-GCKMJXCFSA-N 477.986 0.736 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1 1840957151 LYBRYYYZNDKXAQ-VGOFRKELSA-N 489.997 0.690 50 20 JCGD CSCC[C@H](O)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039304 CQODJLFIEZRWJS-SFHVURJKSA-N 463.604 0.650 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1)C2 1846385114 UJHCCOKLBYLQCL-INIZCTEOSA-N 451.568 0.820 50 20 JCGD CCn1nc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(C)cc3)C2=O)c2ccccc2c1=O 17189129 VGGRSHZTNRCZOX-XMMPIXPASA-N 476.493 0.953 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 28195620 WWSVGJSYDDEZKO-UHFFFAOYSA-N 456.521 0.383 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCn3c(=O)n(C)c4ccccc43)cc2)CC1 728214037 KXOGDOZELXTCRN-UHFFFAOYSA-N 472.571 0.810 50 20 JCGD CCNS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1 728729523 QIMSQRFTRCFNRA-UHFFFAOYSA-N 458.493 0.436 50 20 JCGD O=C(NC[C@H]1CN2CCC[C@H]2CO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 729620435 YJNBYAYFJYOGES-ROUUACIJSA-N 465.576 0.668 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1)NC1CCCC1 744059502 NKWIXLAXJVFTHZ-UHFFFAOYSA-N 481.575 0.431 50 20 JCGD Cc1cc(/C=C(\C#N)C(=O)NCCS(=O)(=O)N2CCOCC2)c(C)n1C[C@H]1CCCO1 748047953 XPESAHYUZADTKL-UMSHPIDHSA-N 450.561 0.969 50 20 JCGD C[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)c2ccc(Br)cc2C1=O 894397372 VFGCXZWCMHCCPK-SNVBAGLBSA-N 484.270 0.871 50 20 JCGD COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 913151691 UJQRHOUSPFVZDN-UHFFFAOYSA-N 490.538 0.679 50 20 JCGD O=C(COC(=O)c1ccccc1S(=O)(=O)N1CCOCC1)NNC(=O)c1cccs1 915007793 ACWQBGXPJIRVTI-UHFFFAOYSA-N 453.498 0.387 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@H](c3ccco3)N(C)C)nc2)CC1 915896381 BTEPREYTJKVCBQ-MRXNPFEDSA-N 451.553 0.540 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)n[nH]c2n1 917393624 NYGDYWLMHDLVCT-UHFFFAOYSA-N 481.546 0.748 50 20 JCGD CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1ncnc2[nH]cnc12 917900836 FXLLJACMZQEFRR-UHFFFAOYSA-N 458.504 0.035 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2nc[nH]c2c1 1779009930 PYKZSSUURPKVBZ-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)C1 1779034083 LVISDMNPKQQZCZ-NXHTTZLHSA-N 473.530 0.108 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2cn[nH]c2cn1 1779194068 XGJUQHPGOXAQHG-NFBKMPQASA-N 463.303 0.079 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1782158209 YMMOTKACSKQWEI-NRAIQUKZSA-N 478.590 0.629 50 20 JCGD COCc1oncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782211858 BMABZBFQSTZHTM-DYESRHJHSA-N 451.524 0.322 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1csc3c1CCCO3)CCO2 1783934112 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0.405 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1 1787449282 ISINQBFNNANWPW-NBOOPKSLSA-N 454.923 0.197 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccn(C)n3)C[C@@H]21 1787509089 RRNJSEYOTXBKCS-SKFHZHBLSA-N 455.519 0.076 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(O)[nH]3)[C@H]2C1 1788956474 OJWNQUAABBLFHO-QITLCBANSA-N 473.442 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(NC(=O)OC(C)(C)C)CC3)[C@H]2C1 1792338714 IQXZRIQCMFJTKL-ULQDDVLXSA-N 481.594 0.396 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C 1793086415 ZZTWVPPACNQEFM-IBEHDNSVSA-N 492.411 0.883 50 20 JCGD Cn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)cc1O 1793878350 WAJHNINXTBJBHM-LMWOUKEDSA-N 471.942 0.461 50 20 JCGD Cn1cccc1C(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793882266 BVFBAKFVSBBLHP-IVSAIRAKSA-N 482.965 0.930 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795113239 PWKUIWCDYZDTRD-FQLMCAECSA-N 478.384 0.637 50 20 JCGD Cc1snc2sc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)cc12 1796121229 WCFRHXOPRWOLIR-ZSBFGKGUSA-N 471.369 0.863 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)C2 1797753887 JNQZVKBHMLCVOU-UPHUGPLXSA-N 475.509 0.592 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798442564 BFYCUMILNUWXFA-OWLYRPNTSA-N 464.526 0.755 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn[nH]c1C(F)(F)F 1798710027 ALOGEOHAGSBUNS-KYWHXAPBSA-N 482.423 0.161 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)C2 1800976992 FJDRWCZPQJBQCK-IAFLNBNSSA-N 475.970 0.058 50 20 JCGD CC(C)c1nc(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)no1 1804411969 BAYPJLXSMIWPSA-XMSQKQJNSA-N 477.330 0.830 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cc2ncccn2)[C@H]1c1cccnc1 1804692657 ODJDPUAJYLSTSF-HRAATJIYSA-N 460.498 0.432 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n[nH]1 1805259401 UKKHLEWKGFVAJX-QRWLVFNGSA-N 476.497 0.639 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)C(=O)N(C)C)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1806944043 NQFCPDRSALCHTQ-UNMCSNQZSA-N 495.584 0.522 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnnc(Cl)c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360580 CMCSLZHHGHNLIQ-OXJNMPFZSA-N 465.706 0.838 50 20 JCGD COc1cnc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1807362149 DXUSOJVNBDVODO-UTKZUKDTSA-N 461.287 0.193 50 20 JCGD NC[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccc1 1807370399 COELZMFXOBJNBD-XWGVYQGASA-N 472.354 0.824 50 20 JCGD O=C(/C=C/C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)NCc1ccco1 1809978543 DEYIEJPNGGJLRA-BQYQJAHWSA-N 479.342 0.677 50 20 JCGD COc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1OC 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COC(=O)CSCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827048937 DFZLAAXSQWJYGQ-LJQANCHMSA-N 462.377 0.506 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CNC(C)=O)C2)C1 1829341182 YBOJXYGBMWOPTL-XXBNENTESA-N 494.976 0.828 50 20 JCGD O=C(c1ccc(N2CCCOC2=O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830736609 UYSNRJMEGRDADX-GCJKJVERSA-N 481.933 0.703 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1831110072 BXAVBXJFVREFSZ-FDDCHVKYSA-N 492.385 0.813 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3C[C@H]3F)C2)C1 1832551099 AWEYYUPOWVLQFZ-LDNFRZNASA-N 463.934 0.933 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cc3ccn(C)n3)CC2)CC1 1834846609 ACCJZRRAMJFZQM-WPWMEQJKSA-N 482.589 0.668 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1834973420 ZMMLAJQNPLATBN-CQSZACIVSA-N 450.931 0.015 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cc4cn[nH]c4cn3)CC2)CC1 1835641041 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CC(C)=NO[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921759 YBRISVWEEAVCGN-QGZVFWFLSA-N 459.352 0.780 50 20 JCGD O=C(c1ccnc(Cl)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200064 CPYHKCLGRUACDP-IAQYHMDHSA-N 451.680 0.891 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)CCO2 1839788864 JDTOHLCLSFAUCQ-JOCHJYFZSA-N 495.508 0.106 50 20 JCGD Cn1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)n1 1839801738 APOZLMDXVWBNBU-UTKZUKDTSA-N 492.374 0.891 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1839965789 LJPKXYZBMBCYHU-FXAWDEMLSA-N 487.439 0.396 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)C2)C1 1840150668 OQWDXFPMPDCIBL-YOSAUDMPSA-N 493.988 0.745 50 20 JCGD Cc1cccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c1 1840182806 VIIQQVRCKHYCMN-XMMPIXPASA-N 460.575 0.757 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840301089 CITAVGYYLMNKIZ-NTKDMRAZSA-N 460.575 0.695 50 20 JCGD CC(C)(C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ncc(Br)cn1 1841453838 NZMRBFWVYKESKS-UHFFFAOYSA-N 487.163 0.714 50 20 JCGD C[C@H](C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1)n1ccnn1 1845039364 IJDMBIVBEDGOLB-QGZVFWFLSA-N 454.535 0.389 50 20 JCGD COc1ccc(F)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1OC 1845423762 ZIEYIJDMPHBLLM-UHFFFAOYSA-N 457.462 0.972 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)N[C@H](C)c1nc(C)no1)N(S(C)(=O)=O)CC2 726277614 CTRDOFREGOOPPY-ABAIWWIYSA-N 496.546 0.736 50 20 JCGD CC(C)(C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)n1cc([N+](=O)[O-])cn1 726495538 PBLNCOXLJAEODK-UHFFFAOYSA-N 450.477 0.772 50 20 JCGD O=C(NNc1ccc(S(=O)(=O)Nc2ccccc2)cc1)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 728217884 USPQCJDVYQHFFB-YJBOKZPZSA-N 492.579 0.966 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CN3CCC[C@@H]3CO2)c1 729618292 IZMAXFBPHXEJCH-SJORKVTESA-N 453.565 0.524 50 20 JCGD C[C@@H]([C@@H](C)NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCOCC1 729623452 JMLXBFTZEJYNPU-CVEARBPZSA-N 453.565 0.524 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CN1CCSC1=O)N(S(C)(=O)=O)CC2 731760879 FSTHTVWQMANBMM-CQSZACIVSA-N 486.572 0.269 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H]2CCN(CC(F)(F)F)C2)cc1 747308517 RHASKTBJUARQJG-CYBMUJFWSA-N 451.471 0.583 50 20 JCGD O=C(NCC1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)c1ccc(-n2cnnn2)cc1 747310366 NBFLBHYUNZKRFA-UHFFFAOYSA-N 484.542 0.707 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(-n3cnnn3)cc2)c1 747410644 ZPMIUPQMAXUYRI-UHFFFAOYSA-N 479.544 0.316 50 20 JCGD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1 751281907 HNPXPARKFPHSNZ-VOTSOKGWSA-N 483.524 0.691 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)OCC(=O)NNC(=O)c2cccs2)c1 819799613 SMAONDYGCUVQOM-UHFFFAOYSA-N 496.567 0.453 50 20 JCGD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)cc2)[nH]1 915188034 JYGJVBNEOLVQAZ-UHFFFAOYSA-N 484.465 0.982 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)nc1 916379026 XZCUMUQOYNOSBV-MRXNPFEDSA-N 479.485 0.968 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc(OCC(=O)N(C)C)c2)cc1 918223868 PWSDEHYFMYJBOD-UHFFFAOYSA-N 491.570 0.613 50 20 JCGD COC(=O)CCc1c(C)nn(-c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)c1C 919885759 RCCAMPFHLXVORH-INIZCTEOSA-N 477.543 0.726 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN(C)C(=O)[C@H](C)n1cccn1 920542302 BMLQWKOTMLKKTI-LBPRGKRZSA-N 451.867 0.569 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(CCOC)CC2)c1 920814335 XKQFQQMDFHLMIS-UHFFFAOYSA-N 455.581 0.772 50 20 JCGD Cn1ncc2c(O)nc(CCC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)nc21 935775518 GPDGISODLHGAFZ-UHFFFAOYSA-N 452.519 0.361 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCO3)C2)C1 1778281359 RIRIRFHEJCVSGI-PXDATVDWSA-N 487.601 0.090 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc4scnc4c3)C2)C1 1778641871 VZHJPPBZQNLUPC-QFIPXVFZSA-N 451.313 0.733 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1 1779111912 FZWHDENKLPZDBT-HSZRJFAPSA-N 462.271 0.174 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1779176942 OKXHJDBUSVTACK-NJSLBKSFSA-N 468.352 0.456 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cn[nH]c3cn1)C2 1779372617 OMSPKIYXRSJNFD-AUSIDOKSSA-N 478.513 0.398 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/C(=O)NCc2ccco2)C1 1779492299 AFQPHBVYCCHLJS-SHRAGUKFSA-N 489.573 0.339 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)nn1 1779900225 MERFOXRGWWBNKM-DEOSSOPVSA-N 497.556 0.275 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(-n3ccnc3)ccn2)C1 1780213249 UODRBAXKXRCNMH-HYBUGGRVSA-N 483.573 0.768 50 20 JCGD CCn1nccc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970351 UPLDOUWRHHNMIB-XMMPIXPASA-N 483.573 0.693 50 20 JCGD CCOc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1O 1781109676 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C/C(=C\c1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840414410 KZMZAONHXNWUDP-HKRNCWMRSA-N 459.547 0.314 50 20 JCGD COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1C 1840643643 WNTOAQFPJBFCPK-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)C1 1841028216 WFPSCDSWDLWNEW-DLBZAZTESA-N 481.594 0.181 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)cc2)C(=O)C1 1843011945 MEWMVJSHUATOEU-UHFFFAOYSA-N 460.299 0.610 50 20 JCGD C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1845130591 LYOFNVQDEASKHC-FQEVSTJZSA-N 483.374 0.880 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)c2ccccc2c1=O 14888149 VFZHBHKGHIZVTB-CQSZACIVSA-N 487.513 0.935 50 20 JCGD CN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1 16785682 FFJCSEJXXJQPCS-OAHLLOKOSA-N 451.526 0.707 50 20 JCGD NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 726436397 QKAQWZBACKQHHB-UHFFFAOYSA-N 476.628 0.542 50 20 JCGD COc1ccc(NC(=S)NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1F 727500386 WQUDRYLHAKSQRS-UHFFFAOYSA-N 483.547 0.832 50 20 JCGD CCCCN1C(=O)C[C@H](C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)[C@@H]1c1ccc(OC)cc1 728385110 KLFHWQBERLZDOC-AYBZRNKSSA-N 451.545 0.967 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CSc2ccc(S(N)(=O)=O)cc2)n1 728732642 AQYHFHFNVWATNI-UHFFFAOYSA-N 458.543 0.124 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 728889821 QRHONZNLBGVLPF-GOSISDBHSA-N 488.570 0.612 50 20 JCGD CN(CC(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1)[C@@H]1CCS(=O)(=O)C1 729511723 UQASZFGNNGXYFD-LJQANCHMSA-N 456.524 0.870 50 20 JCGD CCc1ccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1S(=O)(=O)N1CCOCC1 913632583 FPNVLCKPKKAAPS-LJQANCHMSA-N 475.523 0.871 50 20 JCGD O=C(Cn1cnc2sc(-c3ccccc3)cc2c1=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919883619 FCHLBRPBJFYJKQ-ZDUSSCGKSA-N 461.525 0.643 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nccn3c2)C1 1778703083 DPNHXXKJDFTMSS-NTKDMRAZSA-N 477.525 0.774 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCCNC3=O)C1 1778918477 DSDLAZXRXKSITG-AVBTWRTFSA-N 467.954 0.398 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-c4cc[nH]n4)cc3)CCO2)C1 1779036869 HOWDWBVWLYZGLG-DEOSSOPVSA-N 475.509 0.833 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)N1C[C@H]2C[C@@H]2C1 1779372697 XOBYPYKWGFUXAH-UFCRAUCYSA-N 470.574 0.153 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnn3n2)C1 1779992530 SEXKXCNRATXQDZ-UQPPNZDLSA-N 492.540 0.991 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)Cn3cncn3)CCO2)C1 1780097195 SCHMWMBSGOGGHH-FQEVSTJZSA-N 458.431 0.255 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccn1)C2)NC(=O)NCc1ccccc1 1780559031 VEQOBLHVCBALBE-PXDATVDWSA-N 495.584 0.950 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc([N+](=O)[O-])cn1)C2)[C@H](F)Br 1780771005 PAZRRZDOAXDEHO-IVMMDQJWSA-N 462.276 0.996 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)c(N(C)C)c(F)c3)C2)C1 1782110245 RTVYTBZKHAGDPZ-JOCHJYFZSA-N 467.517 0.847 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)NC(=O)CO3)C2 1782214329 KNNUGGQUGXJLSI-NTKDMRAZSA-N 487.557 0.518 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1782959557 LLWKPWACTKIGFH-NQIIRXRSSA-N 495.510 0.541 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)n1C)CCO2 1783935701 YBRJWOKPBKUNGR-IBGZPJMESA-N 459.469 0.860 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(C)n1 1784294438 NLAMCALULTXBQR-DEOSSOPVSA-N 451.332 0.455 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c[nH]c4ncccc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786982218 RQQGALLSYXIIGR-NYVOZVTQSA-N 476.342 0.469 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(C#N)c1 1789841353 GCLGNQSJMCLUIM-SSKFGXFMSA-N 492.536 0.401 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]cc3I)C[C@@H]21 1791255647 XLHROTAWKATVFG-KQXIARHKSA-N 496.733 0.861 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)C1CC1 1793060900 AMKRLRMPTKRSFD-ORDFZIBCSA-N 459.971 0.869 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(=O)n1O 1794356299 YNTBTRDLJRPFSX-LOUJCGABSA-N 484.937 0.421 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1 1796193110 LQWOHAWTDYMODQ-ACDBMABISA-N 459.315 0.821 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(Cc2ccccc2)CCO1 1797247880 FKLFGCCTTYEDOS-LUYSREMJSA-N 465.978 0.731 50 20 JCGD Cc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797750740 RIHZCWLFMCSSRZ-VPTLXERWSA-N 453.499 0.276 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl 1799277566 XZYYGXGPGBGBET-VYSMIANISA-N 458.346 0.421 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC[C@H]2CCC(=O)N2C1 1799926425 NIUSCHLHYOKCIX-UHDSXZAQSA-N 454.531 0.338 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1CCc2cccc(Cl)c21 1800327876 RWNCBZORQGGADE-YZIUBNRHSA-N 468.746 0.953 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)N1CCOCC1)C2)[C@@H](Br)Cc1ccccc1 1800434838 DMJWBQLIFHAOSL-RVDAZCDBSA-N 496.402 0.233 50 20 JCGD CN1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)Cc2ccccc2)CC1 1800435566 LTMFXWJZRIQCEX-XAPVIXHLSA-N 493.446 0.830 50 20 JCGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1)n1cnnn1 1800437050 UJGRYEAHHHUPQQ-JFMONLCZSA-N 477.363 0.830 50 20 JCGD COC(=O)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)Cc1ccccc1 1800852068 FXMXRNQHHHOUAS-SFNKJDCFSA-N 453.923 0.444 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)nc1F)C2 1801009376 CDKKXJADHOJNGR-DPIQGUFMSA-N 486.342 0.559 50 20 JCGD 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O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)CC2)C1 1809974887 GIEMNSDELCIHIL-KRWDZBQOSA-N 494.357 0.218 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813020442 CKUPTAWXWXXOMP-PNJWGLBASA-N 491.353 0.836 50 20 JCGD COCCOCCOCCOCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1 1814877556 DPRDFQHIPQFYLH-DLBZAZTESA-N 476.958 0.698 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815364501 VGFHJFUWHQSZPF-CQSZACIVSA-N 459.333 0.638 50 20 JCGD CC(=O)N1CCN(CC(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Br)sc3C2)CC1 1823007807 PNDBNXPDNSNNFZ-NHYWBVRUSA-N 476.372 0.910 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)c1 1825454399 POVQADIKTXVVMC-QFIPXVFZSA-N 499.398 0.712 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)[C@@H]1SC(=N)NC1=O 1827052903 NNNGFEVTURHXLI-JVPBZIDWSA-N 486.403 0.402 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)c2cccnc2)CC1 1828923334 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CC[C@H](C)[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1 1832549349 IPVLZRMHEVSKIY-NRVIRDBHSA-N 492.013 0.982 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc([N+](=O)[O-])o1 1833005677 MMCGBFNAVFXGEN-UHFFFAOYSA-N 470.291 0.367 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1833452075 VFKKVQVGOXGZBM-IUODEOHRSA-N 485.420 0.576 50 20 JCGD C=CCCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(O)n1 1833695598 CGLBCQHDBNSXJQ-UTKZUKDTSA-N 453.923 0.576 50 20 JCGD O=C(c1ccnc(C(F)(F)F)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833792326 SHQKSEIVOQJGCA-SUMWQHHRSA-N 451.829 0.770 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCc4nc(O)nc(O)c4C3)CC2)CC1 1833833571 QAIZAKNBDHXUKG-KSSFIOAISA-N 496.008 0.818 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)cn3)CC2)CC1 1834297756 QYCGPUNMDRTICO-UHFFFAOYSA-N 469.521 0.718 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C)on1)CCO2 1834346883 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0.872 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(-c3cnco3)c1)CCO2 1839365615 VUDLLQQBCZTOPQ-RUZDIDTESA-N 491.309 0.405 50 20 JCGD O=C(COCCO)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802133 MOVCTRLXNRJODJ-WIYYLYMNSA-N 485.375 0.458 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1840035669 ZUAYWFKUKBYNKD-SCLBCKFNSA-N 457.325 0.519 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)C2)C1 1840150666 OQWDXFPMPDCIBL-REHUZNOOSA-N 493.988 0.745 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C#Cc3ccc(Cl)cc3)C2)C1 1840182856 WPXLOYDKZKMQNU-HSZRJFAPSA-N 476.961 0.521 50 20 JCGD COc1c(C)cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1C 1840185844 ZCSOPVDLDYTKPH-DEOSSOPVSA-N 476.574 0.755 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)C(F)(F)F)CCO2)C1 1840203693 OCCZKEHDURMNHV-IAQYHMDHSA-N 474.274 0.295 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)n1)C2 1841924950 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC[C@H](N)C(N)=O)C2 1799218147 YRFXSOLMOFGAJD-LOUJCGABSA-N 461.475 0.365 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1799229889 QBBMKWJDIYPWHW-SIRPWMCASA-N 459.971 0.823 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799350326 OKRPMAFHYHRBHS-GGFUIZRSSA-N 495.346 0.035 50 20 JCGD C[C@@H](CC(N)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799865562 CFJLGAXNGQKVFR-KANFNMMFSA-N 458.563 0.482 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C3)C2 1800326281 LLOLRYYWSMJSAK-RPUYLAQPSA-N 482.965 0.466 50 20 JCGD O=C1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)Cc2ccccc2)N1 1800436094 QRFLUKVZKCVXDI-KMOPNRPKSA-N 464.360 0.861 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]3C[C@@H]3N1C(=O)OC(C)(C)C)C2 1801008786 BAXXPDACJXWHMY-ABYCXSSWSA-N 493.605 0.347 50 20 JCGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)ccc2c1OCCO2 1801011685 YTNUUAZJADLFQT-VPTLXERWSA-N 460.531 0.342 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1Cc1ccccc1 1801192836 LLKIGBQQIZGBGD-XARGGIHNSA-N 471.602 0.614 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1)C2 1802344112 OIMHMEXEBQRCJU-XMTFNYHQSA-N 481.594 0.634 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803143195 WOCYTLUZRJFBQB-ZJPYXAASSA-N 455.895 0.182 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)COc2cccnc2)[C@H]1c1cccnc1 1804336855 DPLXNBFHKHLQTE-VGOFRKELSA-N 475.509 0.874 50 20 JCGD COc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1806043047 IVMJBXATVCPEEA-QRWLVFNGSA-N 476.497 0.512 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc3c(c2)CCNCC3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807367191 RPXACQUZLGTMAA-BWKNWUBXSA-N 499.380 0.478 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375016 KQYWIDAVBADCKR-XMSQKQJNSA-N 475.314 0.374 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCCNC3=O)[C@@H]1c1cccnc1 1809680043 KJNZWPRBGCKXNT-GJYPPUQNSA-N 474.949 0.985 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1810120222 GARMAJOPPKWWHJ-YKFAQDCNSA-N 451.593 0.619 50 20 JCGD CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1 1811552702 NWHBTXFNHSPCJH-RXVVDRJESA-N 476.346 0.741 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cccnc3)sc2C1 1817188399 WYEJNXSDFXBBQC-CJNGLKHVSA-N 480.554 0.332 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817477266 QJTKBENVTFBQHL-MGPUTAFESA-N 490.329 0.609 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)[nH]n1 1818111899 OICYNBMGJAFLMT-CVVLNJNASA-N 454.491 0.814 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4c(c3)CNC4=O)sc2C1 1819373594 FMQCPNUESKMMNN-AWEZNQCLSA-N 470.555 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)Cc1ccccc1)CC2 1819799559 DOKMSJWZEZCYPP-KBXCAEBGSA-N 480.550 0.971 50 20 JCGD CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)n(C)n1 1820631962 SFGTXZNHSWRLLL-OAHLLOKOSA-N 453.333 0.658 50 20 JCGD CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)COCCO)[nH]n1)NC(=O)NCc1ccccc1 1820710366 BAZKKKAHYPCCLQ-IBGZPJMESA-N 487.561 0.757 50 20 JCGD O=C(CSc1nc[nH]n1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822710894 MNULKGRFBUSCPD-OAHLLOKOSA-N 455.309 0.306 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050219 ITNYSKAAGJWBJE-HXUWFJFHSA-N 464.331 0.407 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)[C@H]1SC(=N)NC1=O 1827052902 NNNGFEVTURHXLI-GDIGMMSISA-N 486.403 0.402 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCc1cccc(C#N)c1)CCO2 1830463139 VKUJNWNGVLNSMP-XMMPIXPASA-N 471.558 0.320 50 20 JCGD O=C(c1ccoc1I)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830723066 KXIUOMBYRXMLJH-WBMJQRKESA-N 498.701 0.554 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccc2c1OCCO2 1830728136 QAKKDCPRLHQWSH-HRAATJIYSA-N 454.907 0.436 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnccn3)CCO2)C1 1830966934 ZHCCLNPGDRKKSU-HSZRJFAPSA-N 499.480 0.623 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCN(Cc3ccccc3)C1)CCO2 1832302463 YWUISDILSQAUKS-IMSXRSKXSA-N 480.005 0.955 50 20 JCGD O=C1C[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CN1Cc1cccs1 1832750536 XQFVFPFUBVYNHJ-XPIZARPCSA-N 485.990 0.153 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)C 1834801279 VODFAKOFPKTCES-JOCHJYFZSA-N 473.379 0.139 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3[nH]nc4ccncc34)C2)C1 1834822197 DDTKXZWHJXIGMU-GOSISDBHSA-N 452.309 0.813 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1835640594 NLYCRNMYHWPGOQ-ZHRRBRCNSA-N 491.029 0.950 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835844123 HRSGBFJSXMQFIU-JKSUJKDBSA-N 465.364 0.400 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1 1835939887 MSEAFZYRKGGELG-BKMJKUGQSA-N 478.354 0.242 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1 1836031902 FOIKKIFJSGORPL-JEWPKMHUSA-N 486.504 0.354 50 20 JCGD C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459365 NHMNEHSHRMHCFY-HXOBKFHXSA-N 457.531 0.524 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837637281 ZLELPVMBZBGXPO-FLWKIERCSA-N 469.922 0.162 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1csc(C(F)(F)F)n1)CCO2 1838190145 ZQXMZQLMDYNRFK-LJQANCHMSA-N 499.276 0.226 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1838404350 NRSKZIDKXJDLIR-QUCCMNQESA-N 466.406 0.872 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cn2[nH]cnc(=O)c12 1838472673 WONQIYIOLQRABJ-DJJJIMSYSA-N 482.335 0.184 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)C)C2)C1 1838528061 CDXQHFFDYBQPJX-OAQYLSRUSA-N 464.475 0.152 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1839155275 PVXUXFIGGQGABV-RBUKOAKNSA-N 461.346 0.808 50 20 JCGD Cc1nnc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)s1 1839197585 BKZVDWVGTUYCAH-GOEBONIOSA-N 465.345 0.926 50 20 JCGD O=C(Nc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1)C1CC1 1839249459 PQRIZFSCNMNLSQ-PGRDOPGGSA-N 465.934 0.705 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1839964630 XNKCEPHDNDMBSY-FUHIMQAGSA-N 469.380 0.581 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1839965167 PFBMRCMRDWAFBP-KSSFIOAISA-N 471.308 0.418 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1839965394 XHDVFGIKMKAITG-AVYPCKFXSA-N 498.378 0.225 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(NC(C)=O)n3)C2)C1 1840150688 PAHTVTVUDXWKGW-FOIQADDNSA-N 454.911 0.364 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(CC(C)C)nn3C)C2)C1 1840151962 SIYXSTPLSWFGPL-UWJYYQICSA-N 456.971 0.942 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccccc3)C2)C1 1840156295 MEJIBILHHOCVRG-PGRDOPGGSA-N 467.950 0.517 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1cccs1 1840375807 IFNOSFYUANHBKN-NYHFZMIOSA-N 473.555 0.620 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)C1CC1 1841410562 KPHRHSZZVZXMSC-IBGZPJMESA-N 471.363 0.877 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCS1(=O)=O)C2 1841925245 CIUHYJQXMKPDSU-KBPBESRZSA-N 463.984 0.899 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)C2=C3c4ccccc4C(=O)N3CC2)C1 1844650323 SPQQAQOCKQDEIT-UHFFFAOYSA-N 457.295 0.454 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC2(CCCN2C(=O)CN(CCO)CCO)C1 1846034625 NAEFCMYERILBIB-LDADJPATSA-N 491.386 0.846 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)=NO2)C1 1846122790 UOJJEQCDIAUJTD-CQSZACIVSA-N 456.927 0.555 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(F)c(C(=O)O)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1 13362393 SRDMCUFXCGNNAI-UHFFFAOYSA-N 487.487 0.168 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NC1CCN(CC(=O)Nc2ccccc2)CC1 725872255 BZVDTPCOYTWINC-UHFFFAOYSA-N 458.544 0.911 50 20 JCGD COc1ccc([C@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCOCC2)cc1 726083773 LOOGTEDNQGWPIB-KRWDZBQOSA-N 461.544 0.890 50 20 JCGD C=CCNS(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1 728213492 CQVBOOBKUCAYMC-UHFFFAOYSA-N 493.611 0.844 50 20 JCGD Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cccc(OC(F)F)c1 728486762 JINNXORTBGBLKS-UHFFFAOYSA-N 458.443 0.722 50 20 JCGD O=C(Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O)NNC(=O)c1cocn1 729310553 OHZOBXVIPBOATM-UHFFFAOYSA-N 499.487 0.906 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)COC[C@@H]1CCCO1)N(S(C)(=O)=O)CC2 746385818 KFFSVYDFWNBMDO-RDJZCZTQSA-N 485.559 0.296 50 20 JCGD CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)o1 746392190 MEZCZRZMSOCLCK-UHFFFAOYSA-N 454.505 0.810 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)NCCC(=O)N1CCN(c2ccccn2)CC1 748465879 DSDRTHLKLYJLJO-UHFFFAOYSA-N 450.503 0.721 50 20 JCGD C[C@H](NC(=O)CC1CCCCC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 749838787 TZSBJVSMALFJDK-INIZCTEOSA-N 480.587 0.944 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNC(=O)c2cccs2)cc1 751212548 SIHGXDBRLDXVQP-OJXHRBAXSA-N 469.523 0.429 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3cccc4ccccc34)c2)CCN1 911258954 UXXKOVOVGQGPSV-UHFFFAOYSA-N 466.519 0.964 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NC[C@@]2(N3CCOCC3)CCSC2)nc1 916636468 DMMWCIVURPCOOD-IBGZPJMESA-N 472.637 0.946 50 20 JCGD CCN1CCN(CC(=O)NNC(=O)c2ccc(CSc3nc(C)cc(C)n3)cc2)C(=O)C1=O 918013292 PRAUHPURZZGNQV-UHFFFAOYSA-N 470.555 0.837 50 20 JCGD Cn1cc(S(=O)(=O)NCC(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)cn1 919131136 YNVHZTADSCLDOJ-UHFFFAOYSA-N 455.496 0.810 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(=O)c1ccc2c(c1)CCC2 920338428 XKBLIYCHRHSUOY-UHFFFAOYSA-N 457.508 0.840 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1nnc(C)o1)C2 1778090885 FWQVDJYUKFOKLP-ZLMOUHMRSA-N 471.518 0.568 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1n[nH]cc1I 1779706015 DAZUZKXIYGUQHM-HWWQOWPSSA-N 496.733 0.742 50 20 JCGD COCc1c[nH]c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1780047316 SKEMMLXIIUGALP-NFBKMPQASA-N 455.320 0.282 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2nccn2)C1 1780818755 LVHXCZQRTFDXIF-GCKMJXCFSA-N 484.985 0.924 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CCN3CCCC3)CCO2)C1)NC(=O)NCc1ccccc1 1780970739 XXVITAGKYMUSQM-RUZDIDTESA-N 486.617 0.648 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCCC1)C2 1782210802 NBRGGILMDKOLAK-AUSIDOKSSA-N 451.612 0.749 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2)C(Cl)Cl 1782215244 MNVWMFIKBUBWNW-SJKOYZFVSA-N 465.359 0.769 50 20 JCGD C[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)Oc1ccccc1 1782877905 BAWXTDYKSIVIAP-HOYKHHGWSA-N 452.316 0.668 50 20 JCGD CCOC(=O)N(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)Cc1ccco1 1784302127 UTZCXXKLPRBMLP-XMMPIXPASA-N 499.329 0.062 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1785103123 PFXBFBCIHPXBKY-QHCPKHFHSA-N 451.288 0.082 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3ccco3)[C@H]2C1 1785139954 RCYOYEKMUFDOLA-ARQYOALSSA-N 455.471 0.576 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785547185 SIYRWYUVVARFGU-BDJLRTHQSA-N 464.407 0.850 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)N(C)C(=O)OC(C)(C)C 1786981652 COXOJQLCOIESSM-LQJIQPLVSA-N 489.378 0.215 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1 1787451592 YEGONLJVOZPZPF-MJDBTJCESA-N 464.922 0.269 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1787486409 CZCCHJYAIQOOMO-OQUILHJVSA-N 473.559 0.236 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)noc3N)C[C@@H]21 1787508649 FOQMXQVXHRREGS-HVEJOWRVSA-N 457.491 0.293 50 20 JCGD CN1CCN(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)CC1 1788141049 FDRVLRDFHOBCJA-UHFFFAOYSA-N 450.348 0.362 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1O 1788610250 SORBXWYIDWMOOJ-QSFXBCCZSA-N 453.499 0.606 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611299 RTMCMMUSXMOFKB-LRGYGIHKSA-N 466.542 0.552 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(F)cnc1Cl 1788846249 ZZSJSOZDYSLBIZ-KKXDTOCCSA-N 461.686 0.461 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790961491 MDOVVJDRJBWDNO-LLLHUVSDSA-N 453.142 0.133 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C[C@@H]21 1791290607 AOWIUIFWDLHBCT-QRTARXTBSA-N 491.501 0.290 50 20 JCGD CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2 1793445470 JLIGTAHUSGYCBV-PKLKDMKISA-N 452.939 0.990 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)C1CCN(Cc2ccccn2)CC1 1794158084 HIWCHMBAZNAZLF-PIKOESSRSA-N 450.967 0.483 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2 1796892784 SFEJMIREGSNUFJ-SGSBBIFLSA-N 476.534 0.602 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1COc3ccccc3O1)C2 1797748569 IXDHJTBIDAKKHT-CPBBTPEFSA-N 481.509 0.118 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@H]1CCCCO1 1797794164 YYOBLVSOUGCYOF-FTUNRGFVSA-N 463.560 0.148 50 20 JCGD CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)n[nH]1 1799095085 SXFNLSYLCNJDSN-OPMZPASUSA-N 483.573 0.522 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc1 1800431984 IZHFFJMYALMJQQ-HIRMHNASSA-N 458.964 0.212 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cc(C)c(O)nc1=O 1801972202 MISYKIKEHCURIO-QVHKTLOISA-N 457.325 0.020 50 20 JCGD O=C(Cc1cnc2ccccn12)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1803099290 NRSHFVAKVODXGX-CPJSRVTESA-N 483.337 0.971 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1 1803644315 GPPIWQCWYKVYQE-OHTSJNNMSA-N 467.486 0.330 50 20 JCGD Cn1cccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1=O 1803832109 BZZCXMKFFJUPMK-OXQOHEQNSA-N 475.509 0.412 50 20 JCGD CCOc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1804917575 RDPSMKJXTYESAP-XMSQKQJNSA-N 475.314 0.584 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H](O)c1ccccc1 1806804911 OPFPPHWXJSILHS-MDNUFGMLSA-N 459.311 0.815 50 20 JCGD CC1CCN(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1807361340 WTZBKVSXIKNVRQ-ZJSXRUAMSA-N 464.375 0.813 50 20 JCGD Nc1ncc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1 1807371499 VQVVSSREASDABM-CRAIPNDOSA-N 451.317 0.434 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807376462 ZSDXIAYAKLUWMM-XTQVGHSUSA-N 474.326 0.944 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[C@H]1c1cccnc1 1807744555 XKCMYRCRCJHCEK-DBYOASNMSA-N 484.601 0.861 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1808451134 ZRNMEJCFHPFIOL-UTKZUKDTSA-N 480.525 0.909 50 20 JCGD Cc1noc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810303004 OFZDCXOPJSYKOR-FOIQADDNSA-N 464.486 0.334 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccncc2O)[C@@H]1c1cccnc1 1810303229 QXQDPPBDCVXMRQ-FOIQADDNSA-N 461.482 0.814 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@@H]1c1cccnc1 1810306126 UQRTXBWVIBXHSI-ULYRPOKDSA-N 488.552 0.928 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1 1810349814 UKAZGWRAZWRBKZ-WVSUBDOOSA-N 469.380 0.769 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810526531 BSFJTWPACVPVRF-IIMJZQEZSA-N 465.514 0.090 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@H](O)CN2)[C@H]1c1cccnc1 1811361456 XZEMWIOIPJHQPM-NTPMHYTDSA-N 497.508 0.958 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1 1813071481 UCZVVGAFFLJUAQ-IERDGZPVSA-N 473.509 0.870 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1 1813327502 XFISPDVCJYUQRB-PRCFCKQXSA-N 467.574 0.989 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1cccn1 1813425080 FTJDMBVMNKZKBV-MDYRTPRTSA-N 462.514 0.857 50 20 JCGD CCN1CCC(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1814241907 FRKSQCNOCJULNZ-GMAHTHKFSA-N 464.375 0.813 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(=O)oc2)n[nH]1 1816644171 JIXGQHRCUFBCNP-MRXNPFEDSA-N 451.443 0.981 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccncc1=O)CC2 1817282885 NLWGJZMEVPSKQV-PKCARXMOSA-N 482.526 0.446 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(C(=O)O)ncn1)CC2 1819794071 YQDOZSOHKAPRGP-SECBINFHSA-N 482.482 0.169 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)OC(C)(C)C)sc2C1 1825509258 BUOZRMWREAOIAG-GFCCVEGCSA-N 468.580 0.953 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nn[nH]c1C(F)(F)F)CC2 1826088714 KGIIOVZPXWKXGM-QMMMGPOBSA-N 474.469 0.879 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cnnn2)CC1 1827680917 YLUJKTXAWCRQFK-WORIPGKHSA-N 455.523 0.427 50 20 JCGD COCCn1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1 1827824765 GJDHSPRJZRTXHX-QFIPXVFZSA-N 468.363 0.756 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1830732436 YEEVKKUOCKLCEC-YCRPNKLZSA-N 475.970 0.300 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)c1ccccc1F 1830732813 AXFNHPCCPVEIJB-VLCRHTCISA-N 485.940 0.233 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc[n+]([O-])c3)C2)C1 1832549493 RZKARGIMPQQYDF-JTSKRJEESA-N 498.964 0.522 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(C)cc3)CCO2)C1 1835162086 BSRLQVZKLWTOJE-AYDYRGASSA-N 497.552 0.964 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CNc1ccc(F)cc1)CCO2 1835585597 WWZFSXRIFKRTKT-JOCHJYFZSA-N 465.526 0.067 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836930986 OPRAWYRORYAWQB-UHFFFAOYSA-N 473.379 0.141 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)o1 1837453715 NSJFTXYNUWLQEM-YOEHRIQHSA-N 462.272 0.999 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837712955 AWLQCIXDYDDPLJ-HXUWFJFHSA-N 454.600 0.451 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)CCOC1 1839191220 AGDHVSQQJTWHRU-PNHOKKKMSA-N 479.933 0.661 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1 1840033411 CMGVLVPKLALBHO-KPZWWZAWSA-N 452.309 0.811 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3-n3nccn3)C2)C1 1840155263 VJBMOEIFNYLJBM-DYESRHJHSA-N 463.922 0.591 50 20 JCGD CCCc1onc(C)c1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184200 CPADNSBPWMNFRN-QFIPXVFZSA-N 465.551 0.379 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nc2ccccn12 1840184536 SGZIMONFJRZRTC-QHCPKHFHSA-N 472.546 0.086 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)CCOC1 1840189296 KFBQAAVJFQHOGD-WOJBJXKFSA-N 496.388 0.930 50 20 JCGD O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)Cn2cnc3cc(Br)ccc3c2=O)C1 1841647428 UQTKSGBPWJSMRW-OAHLLOKOSA-N 483.750 0.962 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1 1841923921 FLJQUKCDFXGIKK-KGLIPLIRSA-N 481.015 0.650 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cc(=O)cco2)C1)NC(=O)NCc1ccccc1 1842579778 QEGOGYFGCQYBCE-UHFFFAOYSA-N 453.499 0.803 50 20 JCGD CC(C)(CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)NC(=O)OC(C)(C)C 1843010532 YMRJAXKYSZMXAM-UHFFFAOYSA-N 459.352 0.877 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(Br)cc2O)C1 1845306014 JHKJBSUZNSNSMJ-UHFFFAOYSA-N 459.105 0.965 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)COc2ccc(Cl)cc21 1848038563 KKYDACSDHGXWOX-HOTGVXAUSA-N 477.949 0.640 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)c2ccccc2c1=O 14887820 CVFPOSPIFXONDZ-UHFFFAOYSA-N 459.484 0.673 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)[C@@H](NS(=O)(=O)c2ccc3c(c2)OCCCO3)C(C)C)n1 20917905 DHMQKQKSOSJNAV-FQEVSTJZSA-N 479.559 0.812 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(N3C(=O)CCC3=O)c2)cc1OC 104489574 DMPQXSZBYMFMRT-UHFFFAOYSA-N 455.423 0.975 50 20 JCGD COCCCNC(=S)N(C)NC(=O)CCNS(=O)(=O)c1cccc(Br)c1 726076733 ANBBZWHGGODJQQ-UHFFFAOYSA-N 467.411 0.992 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1 729274699 AQTPPBROEBWBAV-NSHDSACASA-N 458.493 0.325 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1 729276067 WLOHJZGLGOTGQK-LLVKDONJSA-N 458.493 0.325 50 20 JCGD COc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)ccc1OCc1c(C)noc1C 730570750 LDFMAEQWAMRYQN-UHFFFAOYSA-N 488.526 0.914 50 20 JCGD CNS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1 762411161 SXMRELZIJXQAEB-UHFFFAOYSA-N 460.921 0.560 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2C[C@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)cc1 771197336 OJAMVRCXSSSXOH-WMZOPIPTSA-N 495.941 0.777 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1 912924857 UUKWZMLLDUACLA-GASCZTMLSA-N 454.549 0.204 50 20 JCGD O=C(CC[C@H]1NC(=O)NC1=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1 913481761 HUSAZTYIVICKMV-OAQYLSRUSA-N 492.580 0.919 50 20 JCGD COc1ccc([C@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)N(C)C)cc1OC 915898311 VLQKIORZHDCDDV-KRWDZBQOSA-N 454.491 0.926 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1cccc(S(N)(=O)=O)c1 916197562 XLBSVMGVSWCTKO-CQSZACIVSA-N 495.583 0.824 50 20 JCGD O=C(NCCS(=O)(=O)Cc1ccccc1)NNC(=O)c1csc(N2CCOCC2)n1 916636051 OPMFDTSXYAOUOK-UHFFFAOYSA-N 453.546 0.539 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1OC 919820603 SGWSYNLPJYDMSL-UHFFFAOYSA-N 463.512 0.728 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1 1778620957 UAUBQTGCBUPQQR-JOCHJYFZSA-N 452.251 0.139 50 20 JCGD Cc1cc2nc(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)[nH]c2cc1C 1778925873 CLAXMKYFBPASEP-HSZRJFAPSA-N 456.547 0.996 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccccc3N)CCO2)C1 1779031562 UFPBLDYXKUZRQV-AWUSRGSFSA-N 450.499 0.424 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1OC 1779037072 MKINDGIEDXFIKG-HSZRJFAPSA-N 487.488 0.599 50 20 JCGD COc1ccccc1OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371088 BYLXBIVJEZKSHB-PXDATVDWSA-N 497.552 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N(C)C)nc3)C2)C1 1779762337 OBTZYJMMQAQGMO-VUEBRRCKSA-N 467.530 0.725 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1cccc(Cl)c1 1780931631 RVJMBLUAWOQPOR-GGAORHGYSA-N 493.992 0.720 50 20 JCGD Cc1noc(CC(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n1 1780970568 XJRGPQQVQRUODY-QHCPKHFHSA-N 485.545 0.097 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnn3c2)C1 1781329435 PUWGBRIVECNRHH-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1783169663 DTSZCJROKHJCLG-ZQGRQUNCSA-N 460.959 0.473 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Cc1cccc(F)c1)NC(C)=O)CCO2 1783882941 AEQRCWBJJBEOMU-NNMXDRDESA-N 469.941 0.957 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1C)CCO2 1783933418 JGDMWODMZMMRAS-GBXCKJPGSA-N 457.575 0.246 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1783936344 GMWQHKOIMSQMTR-VEYWIMSWSA-N 469.542 0.099 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)nn3)C[C@@H]21 1783971969 GNTNYAFYFYMHRP-XUXIUFHCSA-N 457.325 0.572 50 20 JCGD O=C(Cn1ccc2sccc2c1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1785255512 JIPNYJDFEVHJSU-HNKHHVNMSA-N 453.948 0.642 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c[nH]1 1786980140 MXHKAYZSNANAIK-VDGAXYAQSA-N 453.348 0.899 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OCCCO)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984815 MNUDLMCJVYHSEB-VJBMBRPKSA-N 482.342 0.035 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(N2CCOCC2)cc1 1787544680 WMCYXPRSUALNEH-FFGOWVMKSA-N 451.951 0.716 50 20 JCGD CCc1ncsc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609927 DPFIIVODPBIHBE-NUTKFTJISA-N 458.544 0.611 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C3CC3)C[C@@H]21 1788610521 XNUNQRVASYVVBN-RCBQFDQVSA-N 471.543 0.321 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1 1792529670 YCRVWHUUYWMLKS-VLMUSUEPSA-N 475.945 0.994 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793635385 QOMQZEISBQISJO-RMFSNUHRSA-N 489.378 0.265 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnc[nH]1)NC(=O)NCc1ccccc1 1794010607 RHGKAEASJPZEGM-BBIADKPPSA-N 483.573 0.278 50 20 JCGD O=C(CCc1ccc(C(F)(F)F)cn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1794098693 VPTXHYYJHFTLEF-VPTLXERWSA-N 491.275 0.616 50 20 JCGD CC1(C)Cc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)c2O1 1796259116 MKEAJYKNQYPQMZ-RMFSNUHRSA-N 464.327 0.597 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1796336572 SGJMAHIUTKTCAF-AICCOOGYSA-N 494.358 0.902 50 20 JCGD Cc1ccc(COCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1C 1796471900 TWSHJORQAXERFV-IRJINJETSA-N 460.575 0.783 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCOCC1)C2)NC(=O)NCc1ccccc1 1799095161 WNSOHKUGEYKPTM-VTYHHJSWSA-N 473.574 0.349 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799348193 CUYHXOSMFDFOTB-ITGHMWBKSA-N 482.347 0.542 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(N)=O 1799624286 AMNNQHNUICIYQO-RVQRMFQJSA-N 466.498 0.123 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1804197582 HXNBYZLQHPVNGN-LNLFQRSKSA-N 472.995 0.072 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807951225 YNQZZVVGXQWQBP-XEZPLFJOSA-N 489.334 0.701 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1808195410 FQIBAMGIDDZMKK-QAETUUGQSA-N 470.954 0.573 50 20 JCGD COc1cnc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)cn1 1808776054 RAEOAXRLOALUSS-UHFFFAOYSA-N 453.503 0.642 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)C(C)(C)C 1809978150 VYUUMVSOGGXIMP-HXUWFJFHSA-N 457.380 0.762 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1 1809986202 ZDEUIQZUWPHYDZ-JTSKRJEESA-N 453.547 0.917 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810476007 MWXOPXLYWJGNJR-PBEJRMEISA-N 462.319 0.009 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnncc2C(=O)O)[C@@H]1c1cccnc1 1810804713 SXBKPZSOUVFOTI-YWZLYKJASA-N 469.502 0.262 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc(Cl)ncn1 1811122962 JNXUSYPOIVWQHK-UZLBHIALSA-N 465.706 0.838 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)c1ccccc1)CC2)c1cccc(B(O)O)c1 1815354715 QUZNJJKNJRIJJC-QFBILLFUSA-N 451.313 0.782 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)c1cc(=O)n2[nH]nnc2n1 1816673767 HOFITGILSOKPEW-RRAGMBSWSA-N 471.272 0.185 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C(=O)O)ncn1)CC2 1817276879 FGJHSFYVOQXNNK-WCJGGXHISA-N 496.509 0.991 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1 1817471299 UMEDRUJUUIXOOI-IBGZPJMESA-N 497.342 0.508 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCNC4=O)sc2C1 1818916074 HKMZRFSHHLCHHY-WDEREUQCSA-N 466.951 0.953 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCSCC2)[nH]n1 1819400244 FZJGADNUYJNWCT-KRWDZBQOSA-N 472.575 0.763 50 20 JCGD CCOC(=O)C1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)CC1 1821803712 RBVOLCPAJCRTPE-KRWDZBQOSA-N 454.292 0.739 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CNC(=O)C2)n[nH]1)NC(=O)NCc1ccccc1 1821964405 VYFCMIISFXIRSJ-MJGOQNOKSA-N 496.572 0.884 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2 1826644676 YNQUOUMBYYFDBB-HONMWMINSA-N 454.940 0.125 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)n1cnnn1 1828925929 VWJQVFMCQJPYIE-RDTXWAMCSA-N 455.523 0.166 50 20 JCGD O=C(c1cnc(Cl)nc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1829521450 RVIWPCWEXKFXRZ-XHDPSFHLSA-N 451.680 0.891 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C\C(=O)NC3CC3)C2)C1 1830539105 BDZIMXWMCAUSAU-UBZBRERJSA-N 458.353 0.309 50 20 JCGD O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1832361673 XYMGDNRSZHYRFL-VHFSOBRXSA-N 490.370 0.924 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3nccnc3C(N)=O)CC2)CC1 1833263719 XRZGYPZQMSSVKZ-ZDUSSCGKSA-N 481.395 0.792 50 20 JCGD CN(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)nc1 1833648131 NNNKVUKZNGGYPJ-YJBOKZPZSA-N 459.316 0.908 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1833957631 RTBWACYNLGTTQH-OAQYLSRUSA-N 459.528 0.439 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1835095200 MMMGJZVPPXEWHK-ZWKOTPCHSA-N 491.029 0.697 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(F)cc(F)cc4[nH]3)C2)C1 1835930574 NMUYAYGZJAZJHO-DEOSSOPVSA-N 499.279 0.510 50 20 JCGD O=C(Cn1ccnn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1836212268 DJAUDKBAISZTSH-NQIIRXRSSA-N 492.374 0.741 50 20 JCGD CCOc1cnc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1837275688 PZXYZQLXIIIKCC-UHFFFAOYSA-N 497.556 0.800 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccccc4o3)C2)C1 1837459654 VEQSAVRCMGTKQV-XMMPIXPASA-N 479.493 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc43)C2)C1 1837460760 JZSXTMJJKILQRS-CPJSRVTESA-N 479.537 0.485 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)nc3)CC2)CC1 1838394515 FQOVEUSKAXAZPO-UHFFFAOYSA-N 468.514 0.712 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)nn3C(F)F)CCO2)C1 1838716026 PSTKZEXUQYSLOM-SCLBCKFNSA-N 450.870 0.910 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839031990 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COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3ccc(C)cc3)C2)C1 1840156836 VNEYLCARSTZPEH-PGRDOPGGSA-N 467.950 0.435 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4[nH]3)C2)C1 1840184570 VSFDCDCNKYLAQY-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD COc1ccsc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184938 CIUFUNFACFTWJY-HXUWFJFHSA-N 454.549 0.200 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187320 SABYELYHBVWKTA-QHCPKHFHSA-N 475.546 0.088 50 20 JCGD COc1cc(C)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840678811 MLLGTCYMLWOPJA-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1844702004 VEWGRUJHZCUYFE-UHFFFAOYSA-N 452.276 0.471 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cnc3c(c2)NC(=O)CS3)C1 1845669668 CZBLFSMBUNTKFE-UHFFFAOYSA-N 467.511 0.255 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)c1 110552541 PUPLIDZMMMYORD-UHFFFAOYSA-N 497.599 0.463 50 20 JCGD O=C(CNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)Nc1ccc(-n2cccn2)cc1 725860142 KTGCQDGSCJWZFU-UHFFFAOYSA-N 470.515 0.748 50 20 JCGD C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)CC2)C[C@@H](C)O1 728598676 LCKWSVCGAHPKHL-OKILXGFUSA-N 491.517 0.614 50 20 JCGD Cc1cccc(N2C(=O)N[C@H](CCC(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2=O)c1 730768492 GZWPGLVYNCXRFF-OAHLLOKOSA-N 472.527 0.954 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1 747778656 KFFVLPAOZQLWNU-OAQYLSRUSA-N 456.568 0.491 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1sccc1S(=O)(=O)NC1CCCCCC1 750715589 FZPCPHHSUYUVNZ-LBPRGKRZSA-N 463.603 0.945 50 20 JCGD COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1 916041282 WPGWXTHVKOQGPW-KRWDZBQOSA-N 477.605 0.076 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)Cc2cccc(F)c2)c1 916096427 MINMLUZFAAPCEP-UHFFFAOYSA-N 464.519 0.976 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@]2(N3CCOCC3)CCSC2)c1 916637233 VWFHCWNBGREEGU-IBGZPJMESA-N 471.605 0.089 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)ccc1Cl 917725618 QKIOZDJXNMTFEK-UHFFFAOYSA-N 472.932 0.503 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)cc1 919883984 GYCQUJZWFMWVTG-MRXNPFEDSA-N 480.568 0.951 50 20 JCGD CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c(F)c1 919962127 YKDBDVRBSMMTBF-UHFFFAOYSA-N 455.449 0.871 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)cc1 920285158 LYAUOUUPZRNLEL-HXUWFJFHSA-N 472.567 0.997 50 20 JCGD CC(C)CN1C(=O)/C(=C/NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C(=O)NC1=S 920975935 LGPGTIMFKMEAMJ-SFQUDFHCSA-N 493.611 0.879 50 20 JCGD CCc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 921294912 DJGBSLNFDPYXBL-UHFFFAOYSA-N 498.539 0.801 50 20 JCGD Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1csc(N2CCOCC2)n1 1330236239 HVRCOJBIUZRLAO-AWEZNQCLSA-N 452.562 0.917 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1 1778087949 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C[C@@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2 1783533259 SWEMESAVEHAFOU-PJIJBLCYSA-N 477.400 0.842 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCN3C(=O)c4ccccc4C3=O)CCO2)C1 1783873032 IQFQBUANWSMLGC-HTAPYJJXSA-N 463.918 0.756 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](Cc3cnc[nH]3)NC(=O)OC(C)(C)C)CCO2)C1 1783878832 KDBOCPJIIXBCAU-JLHGSKIFSA-N 499.996 0.929 50 20 JCGD CCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1784695562 MIXSULJXRWQQPE-QHCPKHFHSA-N 461.563 0.589 50 20 JCGD O=C(CCOc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1786411427 YEONEBKFMNBATD-NYVOZVTQSA-N 452.316 0.429 50 20 JCGD N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc(Cl)c1 1786880389 BCZGKGNAFZTTFO-LRGNLBRXSA-N 471.750 0.313 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611321 UONNVNWAIOSSFJ-ALGWMNEGSA-N 466.542 0.779 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ncccc1Br 1788958806 PZAFJZGEVXXHBR-ZVZYQTTQSA-N 488.147 0.431 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C#CC3CC3)C[C@@H]21)NC(=O)NCc1ccccc1 1789725003 WRSSAWPFVPUYEC-FKBYEOEOSA-N 467.570 0.726 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1791019219 HQZAAAFQBZQMGY-KSWRQPAISA-N 471.982 0.823 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1 1791063474 KCQMFQPMXGJQGG-MDLJMBGESA-N 467.364 0.963 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1c(Cl)cncc1Cl 1792408645 JTWVRNSFUHHALO-IVWMJMPLSA-N 464.114 0.585 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)C1CCN(c2ccccc2)CC1 1792905780 MFGNGASHHBSABL-RUMRUAAYSA-N 477.370 0.486 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1CC(=O)N(Cc2cccs2)C1 1793972923 FCUAZPNRLBIXHZ-ARULTKQDSA-N 455.964 0.286 50 20 JCGD CCc1oncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1794945159 PPPPANAOBIXWRO-OPMZPASUSA-N 484.557 0.786 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)C2)c1ccc(B(O)O)cc1 1795732994 WSZLAWMCIZFVTP-OHJZQYHNSA-N 452.291 0.512 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc([N+](=O)[O-])c1)C2)c1ccc(B(O)O)cc1 1795733034 ZPIKFYHGFFFHDW-OPMZPASUSA-N 467.287 0.111 50 20 JCGD O=C(Cn1cncn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1795853904 UBQJOILUUHWSQA-ZMMAXQRCSA-N 462.348 0.874 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC=CO1)NC(=O)NCc1ccccc1 1797720178 HJBOOAPJNSJWKG-XAPVIXHLSA-N 471.558 0.615 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)C1 1797956385 STMVNNBZCUAHCD-OYNZLANYSA-N 485.654 0.655 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC[C@@H](N)C(N)=O)C2 1799218149 YRFXSOLMOFGAJD-UMPJEAMMSA-N 461.475 0.365 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799770505 ZHLLWERYAMZAIL-IVWMJMPLSA-N 454.911 0.327 50 20 JCGD Cc1cc(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1C 1803287218 QGHYWKYZPGLGCT-AUSIDOKSSA-N 461.331 0.366 50 20 JCGD COc1ncc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1F 1804959689 ITHHBWCNUXEPKW-UTKZUKDTSA-N 478.289 0.938 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)C1 1805505355 FWIBALHTPSZSSU-MOPGFXCFSA-N 456.348 0.801 50 20 JCGD Nc1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1 1807273346 AWQOJVKESUXIKB-MAUKXSAKSA-N 451.317 0.434 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C1=O 1807360254 IXOXOXVJAKGRSN-JTSKRJEESA-N 498.304 0.530 50 20 JCGD CN(C)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807361569 GOBRVTZSRKDRLO-CVDCTZTESA-N 473.342 0.856 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362566 MDHJBBLIWZRNLI-GHTZIAJQSA-N 470.298 0.438 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1807373494 BDZFKXZCJHDKCC-XXBNENTESA-N 473.342 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnn3ncccc23)[C@H]1c1cccnc1 1808175502 IBMMKVRTVXTQPR-VGOFRKELSA-N 464.530 0.817 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1 1808414886 OEBHUQBNGBJDTH-LNRKUZHGSA-N 491.508 0.934 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1 1808416247 IXEHESRUINFVGR-MFWRVWTKSA-N 488.570 0.656 50 20 JCGD COCCn1nccc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1808636401 TXYREJNFPGKWKF-UGKGYDQZSA-N 477.330 0.238 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3ccc(N4CCOCC4)cn3)CC2)C1 1809967701 GCJNWMMIJKIXBW-UHFFFAOYSA-N 492.385 0.757 50 20 JCGD C=CCO[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810295714 WICUBNQVJLCXTF-MDYRTPRTSA-N 452.515 0.991 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CNC(=O)c2cccs2)[C@H]1c1cccnc1 1813071927 ZOMYXPJIWYWFLK-VGSWGCGISA-N 486.598 0.952 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(C(N)=O)cc2)[C@@H]1c1cccnc1 1813075135 ZKWRXWUKXRARIP-DENIHFKCSA-N 466.542 0.873 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C2CCC(O)CC2)[C@@H]1c1cccnc1 1813196143 XBJCPFTZVJUEBI-RJYYHGSASA-N 466.542 0.951 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1813334436 GHBBIZXXZAIHIP-AITUJVMLSA-N 462.938 0.158 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347676 JYUFHZFAMQRSNH-RDJZCZTQSA-N 458.349 0.354 50 20 JCGD CC(=O)c1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n[nH]1 1816292512 LMBFWBVONHFOCO-SFHVURJKSA-N 450.264 0.635 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCCC2=O)n[nH]1 1817157695 AQIUHERJYRCIMQ-INIZCTEOSA-N 454.491 0.337 50 20 JCGD C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1 1817816637 JQUNFHJXNASUCV-LDYMZIIASA-N 464.284 0.625 50 20 JCGD CCOC(=O)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1 1824860159 PBUWQHGCURRDLQ-CQSZACIVSA-N 457.317 0.392 50 20 JCGD CC(=O)c1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n[nH]1 1825702752 GVVBBBCLPRVSFX-OAQYLSRUSA-N 452.320 0.839 50 20 JCGD N#Cc1ccccc1OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1828029593 GPJNLBDVHBUMKM-QGZVFWFLSA-N 476.323 0.999 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828521227 WYMRXDWSQVWWFP-QVKFZJNVSA-N 498.374 0.780 50 20 JCGD COC[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1831629775 MDRBTIMOMIUCQB-YADARESESA-N 491.589 0.072 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1831639971 HQCWOUVETIUBLL-DYESRHJHSA-N 452.939 0.675 50 20 JCGD CC(C)(O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549719 ZUOJDFPIEYBTFS-YCRPNKLZSA-N 477.986 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H]3COc4ccccc4O3)CC2)CC1 1833716101 IYDBRVWOLHBEHT-QFIPXVFZSA-N 487.601 0.771 50 20 JCGD COc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1833971983 GYNQDAWXNONRQW-UHFFFAOYSA-N 461.567 0.043 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CSc3ccncc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797493 OOUJDSMKSLMIFK-UHFFFAOYSA-N 482.415 0.739 50 20 JCGD CCCC(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1834884509 ZJLUEYQQWAPJLF-HSZRJFAPSA-N 461.563 0.589 50 20 JCGD CC[C@@H](C)[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737138 OLJMZCOQPSVFHH-FOIQADDNSA-N 460.579 0.277 50 20 JCGD COc1ccc2cc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)[nH]c2c1 1835936741 AYXXAXAEIOYIGA-VWLOTQADSA-N 493.325 0.240 50 20 JCGD O=C(c1ccc(-c2ncc[nH]2)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835941960 UXGGVVGWEWXPCV-RUZDIDTESA-N 490.325 0.140 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836780580 DOLPSQINXLLICJ-UXHICEINSA-N 488.372 0.323 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837634140 XIFGJYDRBOPWAR-ZAHAJLKSSA-N 498.374 0.939 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnn3)CCO2)C1 1837868556 HAHDIQYRFSDXOJ-KKSFZXQISA-N 483.953 0.679 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)CC2)CC1 1837921091 YZHSFICAIQFRRF-SFHVURJKSA-N 480.374 0.507 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C#CC3(O)CCCCC3)CC2)CC1 1838394052 OGOTYNJUHPUUOC-UHFFFAOYSA-N 497.596 0.996 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3)CCO2)C1 1838955470 OJHBRHHPIURUAE-JOCHJYFZSA-N 457.462 0.208 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839040294 CNIRDYACBKEJGN-XMSQKQJNSA-N 480.949 0.578 50 20 JCGD COCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200255 FCDXEQQWHYOANH-CJNGLKHVSA-N 450.261 0.582 50 20 JCGD CCN1CCC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)CC1 1839203721 UGQPKPBZTOMZJM-QAPCUYQASA-N 450.349 0.865 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)c2n1 1839626873 ZVFMLVISYFMWTR-RUZDIDTESA-N 492.341 0.015 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840009263 WLKOCTLKNLZDGX-ZPGKAZOCSA-N 487.981 0.300 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS[C@@H]3CCCCO3)C2)C1 1840153700 YEAPSHCPVDMBPZ-WDYCEAGBSA-N 450.985 0.956 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cnc(N)s2)C1)NC(=O)NCc1ccccc1 1842981224 RCAZTUGZODDLPM-UHFFFAOYSA-N 457.560 0.889 50 20 JCGD CCc1[nH]nc(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)c1I 1843110726 NLQSSIZCGSLXOR-JTQLQIEISA-N 466.707 0.993 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cccc(OC3CCOCC3)n2)C1 1844605690 FQZKIMYTGJZHRQ-UHFFFAOYSA-N 465.315 0.450 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc(Cl)c1 1845018251 WVIRNFXUODPNGK-HXUWFJFHSA-N 469.734 0.714 50 20 JCGD N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 10258926 IEFDKPDMMYBYOR-UHFFFAOYSA-N 479.540 0.550 50 20 JCGD COCCCn1c(S)nc2cc(C(=O)NNC(=O)CNC(=O)c3cccs3)ccc2c1=O 725742053 ZEAQWMLMULHYFS-UHFFFAOYSA-N 475.552 0.974 50 20 JCGD CN1CCN(C[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2ccccc2)CC1 727945861 OWCSGHKDMYPRJC-OAQYLSRUSA-N 488.614 0.870 50 20 JCGD COc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)cc1 728342293 LIWDHOQPSNWARP-OXJNMPFZSA-N 483.477 0.574 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(Br)cc1F 728505827 RAXAWRNBGVGLFJ-SSDOTTSWSA-N 488.313 0.054 50 20 JCGD CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)OCC(=O)NNC(=O)c1cccs1)n2C 754504524 IAJAADCHHNCWFT-UHFFFAOYSA-N 493.567 0.822 50 20 JCGD O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1ccc2c(c1)OCCO2 770391904 NINVORGRHSWJJN-UHFFFAOYSA-N 470.301 0.960 50 20 JCGD O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 802579313 NZOBFZPZOSZXIF-AWEZNQCLSA-N 475.552 0.666 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NNC(=O)c1cc(Br)c[nH]1 807149775 FYXAZELZQJQYKN-UHFFFAOYSA-N 472.325 0.668 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1)C(=O)NC1CC1 822646149 AJQURIJKFNLOIP-SECBINFHSA-N 479.378 0.337 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)N1CC[C@H](B(O)O)C1 864234062 OVVFRNGBQZGHKW-FZMZJTMJSA-N 465.200 0.924 50 20 JCGD O=C(COC(=O)Cn1cccc(C(F)(F)F)c1=O)NNC(=O)[C@@H]1COc2ccccc2O1 899884161 RXQARWPNVWEPGR-AWEZNQCLSA-N 455.345 0.398 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccn(C)c(=O)c1)N(S(C)(=O)=O)CC2 913476706 SAPZZYMKMQZEDJ-INIZCTEOSA-N 478.527 0.113 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCCn1ccnc1)N(S(C)(=O)=O)CC2 915880557 KNZLPZHNCJBAFW-QGZVFWFLSA-N 494.574 0.570 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1S(=O)(=O)N1CCOCC1 916561801 GVENJWMCOBXJRW-UHFFFAOYSA-N 490.538 0.733 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)C(=O)N(C)C)c1 916577609 QLOBGOSIBULFSX-CYBMUJFWSA-N 463.516 0.917 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCc1cc[nH]n1)N(S(C)(=O)=O)CC2 916636083 QRONLFNZCRUDBL-HNNXBMFYSA-N 466.520 0.206 50 20 JCGD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 917289145 IAVLMYPHMHMKLW-KRWDZBQOSA-N 488.844 0.469 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc3c(cc2F)NC(=O)CC3)c1 917719993 PPTBYDGOIFJWSN-UHFFFAOYSA-N 470.504 0.584 50 20 JCGD COc1ccc(Br)cc1C(=O)CCC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886147 QOKNRSGQUYLWNK-NSHDSACASA-N 462.322 0.938 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091334 ASUJWLCSXHPIBX-ORQBEQNPSA-N 457.531 0.673 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2C1 1778372460 AWLXTRHQOHYYOV-VGSWGCGISA-N 497.980 0.677 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1 1779035282 CRWOJTZIHZWLGA-XMMPIXPASA-N 481.509 0.537 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1 1779068262 ICDGSXUECSTCAI-MRAWALMUSA-N 463.325 0.342 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc(C(F)(F)F)n1 1780084568 LQSRDHVKJZBGMQ-NRFANRHFSA-N 493.247 0.546 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1780096835 IJMRVUIIVOCRRX-HSZRJFAPSA-N 490.513 0.686 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1Cc3ccccc3CN1)C2 1782211894 DWEVLDUYFJQSGC-DNRQZRRGSA-N 471.602 0.588 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1cccc3ncccc13)CCO2 1783933557 QBOLUQBOPIGYMT-XMMPIXPASA-N 453.543 0.980 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)CC1 1783966551 GEYNNNUQZDSEMV-UBDQQSCGSA-N 473.412 0.161 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3=CCN(C(=O)OC(C)(C)C)CC3)C2)C1 1785318262 KZUHHBPNJLQWSE-DEOSSOPVSA-N 493.605 0.757 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)CC1 1786406756 AZQDABBYUJDPRU-JYJNAYRXSA-N 480.425 0.423 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 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50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837461394 VMPYXAPKPFMSFG-MZNJEOGPSA-N 482.541 0.029 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1837712489 UZEBHYGUBWWGRB-LJQANCHMSA-N 452.540 0.096 50 20 JCGD COCCn1ccc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1838140028 INKJLRONRSJQCQ-UHFFFAOYSA-N 478.594 0.515 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ncccc1F)CCO2 1838247668 MXHGKVPDAHBNCD-QVGKIPNLSA-N 472.477 0.425 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CSCC(=O)O)CC2)CC1 1838789738 WRLSEAIFPDBVOK-UHFFFAOYSA-N 458.581 0.176 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1838966637 GRFGBXNPIJUMKS-QHCPKHFHSA-N 469.498 0.078 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CCO2 1839083363 RGLPQUZXTLDTKA-GUXCAODWSA-N 472.380 0.629 50 20 JCGD O=C(CN1CCSCC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839197472 XLLVGOFRAUGAOW-HOCLYGCPSA-N 454.362 0.182 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202706 NDYYMQBEZQXAQB-DYVFJYSZSA-N 468.320 0.658 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1839385752 HDDXJSOFVAYBNR-KSSFIOAISA-N 480.356 0.071 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C1)CC2 1839792388 JXKWBWWQVOPWLF-FHJLPGHOSA-N 466.962 0.856 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)CCOC1 1840189294 KFBQAAVJFQHOGD-UXHICEINSA-N 496.388 0.930 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2 1840362293 MQTHARFFERZZEP-IFXJQAMLSA-N 455.353 0.756 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Cn1ccnc1)CCO2 1840430685 MCWGPVBVYLPKLF-KHPKBUAZSA-N 485.545 0.110 50 20 JCGD Cc1ccn(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN(C)NC(=O)NCc2ccccc2)n1 1848234916 ROFXSPXUZJPROL-PMACEKPBSA-N 453.547 0.740 50 20 JCGD CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1 15639619 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VIVVXVFJVBUWRU-HNNXBMFYSA-N 474.539 0.734 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc3c(=O)n4ccccc4nc3n2C)n1 764011965 UEILSZNADOFQNE-UHFFFAOYSA-N 454.468 0.498 50 20 JCGD CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1OCC 798149162 QLWPUQJDKCZMJX-UHFFFAOYSA-N 489.510 0.872 50 20 JCGD CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1 906379996 SAXVKSUKVQXWJP-UHFFFAOYSA-N 479.540 0.509 50 20 JCGD O=C(CC[C@@H]1NC(=O)NC1=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 913129737 VOCUWXLMEJEBAG-HNNXBMFYSA-N 479.902 0.890 50 20 JCGD CC(C)(C)C(=O)N1CCC[C@@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 914711087 ODXXCHCWXAZTAK-LJQANCHMSA-N 494.614 0.825 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 914748196 MLSUBXCMXJFINT-UHFFFAOYSA-N 486.547 0.838 50 20 JCGD COc1ccc2c(c1)C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)CO2 914775655 HTFDWIBXKABXGD-QGZVFWFLSA-N 475.523 0.728 50 20 JCGD CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 915789013 AMRDKSLJKDVPKS-GFCCVEGCSA-N 474.948 0.893 50 20 JCGD CC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(S(=O)(=O)NCC(=O)O)cc1 915907332 ZJUHECRZXBOHOX-UHFFFAOYSA-N 457.472 0.243 50 20 JCGD O=C(NNC(=O)c1sccc1-n1cnnn1)c1cccc(S(=O)(=O)N2CCCCC2)c1 916096030 CGNFIEWNGUSJHS-UHFFFAOYSA-N 461.529 0.973 50 20 JCGD CCN1C(=O)c2ccc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2S1(=O)=O 917664795 BVYFSZMOIJLYJE-UHFFFAOYSA-N 451.482 0.329 50 20 JCGD COc1ccc(C(=O)NCCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1 918220837 BDGMDJQEASOJKH-UHFFFAOYSA-N 491.574 0.082 50 20 JCGD CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1 920385342 YCEGSUMIHPJHFK-DOTOQJQBSA-N 486.572 0.525 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ccncc23)C1 1778684821 DEAONACVUSWRJC-XMSQKQJNSA-N 457.535 0.230 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1 1778930271 KDIWADUITURPNY-UPCLLVRISA-N 480.525 0.392 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2cccnc2n1 1778951986 UNLDXFAIPMMMOK-PXDATVDWSA-N 474.326 0.751 50 20 JCGD CCc1nn(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1Cl 1779029159 SJLGOELQNQXEBB-OAQYLSRUSA-N 475.937 0.392 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1C 1779033731 CNIIJDZUYOPDPP-DEOSSOPVSA-N 467.526 0.688 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3nc4ccccc4o3)CCO2)C1 1779037159 RGJQNELIGHLEKG-QFIPXVFZSA-N 450.455 0.584 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCN(c4cc(NC5CC5)ncn4)C3)C2)C1 1780909272 FDAGBXRKGOEXJY-XAEMIUIASA-N 493.008 0.697 50 20 JCGD CC[C@H](C)[C@@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968219 CGSMHUBSQHSLPQ-VNZMSGEBSA-N 475.590 0.570 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781331681 PQGWSFGWSLGDDX-WBMJQRKESA-N 459.297 0.890 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)C1 1782184784 WIQGMHCMNHTBGS-NRFANRHFSA-N 473.490 0.288 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ncccc13)C2 1782211927 GXLAXYWEDFQLNW-OPAMFIHVSA-N 457.535 0.458 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)C1 1783869263 SQTNDJLBJXFHAA-GSHUGGBRSA-N 452.552 0.169 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C[C@@H]21 1783972044 HWKXAISEMQFREF-XSEXMBABSA-N 478.384 0.840 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)C(=O)c1ccc(Cl)cc1 1784062312 ZAWQZGYFLBGLJV-VDGAXYAQSA-N 470.718 0.496 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccoc3C(F)(F)F)C[C@@H]21)c1cccc(B(O)O)c1 1786983407 RIPQWLVBFTZCEA-JQFCIGGWSA-N 466.221 0.885 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791293028 FVCDLQBWPZJCPX-OYSTVDSJSA-N 464.563 0.095 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)CC1 1792629339 VBTGFKCTDFNCNI-REPLKXPHSA-N 471.363 0.923 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)C2 1792868288 TVQRMYKUAXCUPB-HKLHZYFVSA-N 461.382 0.409 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)[C@@H](O)C1 1793105584 FGFHGGNAUJVYCA-FQMQPWHVSA-N 459.971 0.842 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CNC1=O 1794012746 LKYMLJNHVUZFKV-CRWXNKLISA-N 471.942 0.309 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ccc(O)nn3)cc1)C2)c1cccc(B(O)O)c1 1795740509 CYBMCUAWHYIORJ-BBIADKPPSA-N 488.309 0.046 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc2nc(Br)nn2c1 1795927207 IGEQWJAJRXVCHU-OPDFLTKYSA-N 472.727 0.295 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(C(F)(F)F)cn1 1796067343 DDERUROYGMALGS-HIPFWLKJSA-N 493.446 0.833 50 20 JCGD CN[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2)C(=O)O 1796092421 QOJWTTFBMFAYQI-LOUJCGABSA-N 462.459 0.835 50 20 JCGD CC(=O)O[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C(C)C 1796441887 DEGBVBGEPYHMDQ-DNZWCVMWSA-N 461.519 0.298 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1797900735 XQCRVYQYUOXYSN-YDLHNXBPSA-N 489.353 0.967 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798443033 NMYASFXPHVKJNG-JONQDZQNSA-N 465.514 0.150 50 20 JCGD C[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)Oc1ccccc1 1800340585 GNOOZNQJUUVIHU-YQYRJILISA-N 452.316 0.427 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c1 1801917844 QIGOOWBHXMMNET-OXUXUCFPSA-N 465.355 0.546 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1802160193 ZSJJVASFYXQLST-XLWJZTARSA-N 493.964 0.452 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1F 1805150165 MBHYIVWHTLJTGK-JXFKEZNVSA-N 459.526 0.955 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n[nH]1 1805254038 FQLAESTVPDWSPS-DYESRHJHSA-N 461.287 0.321 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1805304856 JCIPDSSVHDTQOU-HNAYVOBHSA-N 478.513 0.456 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)C1 1805506291 LZKOTMHXZPOKRU-MOPGFXCFSA-N 456.348 0.801 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1807360960 DUTARWQDPFOWOV-XMSQKQJNSA-N 488.309 0.576 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362563 MCTZCZOAOWUPJM-YJBOKZPZSA-N 464.247 0.026 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc(Cl)nc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807366903 VUQPDCCZRSNWCR-LPHOPBHVSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371325 SMJYUIPFKDMMQF-VQIMIIECSA-N 460.137 0.866 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 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0.577 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)c(F)cc3F)C2)C1 1840185701 VPZIOJCSQHRLAT-NRFANRHFSA-N 472.464 0.547 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840726116 YLSLNIHKSDAJDW-HSZRJFAPSA-N 475.546 0.088 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840898424 HKKOTUTWGYWGFU-REXAPNPKSA-N 495.297 0.058 50 20 JCGD CCn1nnc2c1[C@@H](C(=O)N1CC3(CCCN3C(=O)[C@H](O)CCl)C1)CN(C(=O)OC(C)(C)C)C2 1841350132 JJOLYALXZJBHSX-GOEBONIOSA-N 496.996 0.935 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)cc2)C(=O)C1 1844961183 MMUYWFROSIWHAK-UHFFFAOYSA-N 454.531 0.989 50 20 JCGD Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)COc1ccc(OCc3ccccc3)cc1)c(=O)n2C 15886844 QBTCWSRBCMUEEY-UHFFFAOYSA-N 492.492 0.239 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)c2ccccc2c1=O 17190918 GVXCBGCWWQHGIN-MRXNPFEDSA-N 499.549 0.949 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)COc1cccc(C)c1 17198898 ULHZEQHGDKPBMJ-UHFFFAOYSA-N 463.512 0.865 50 20 JCGD O=C(NNS(=O)(=O)c1cccc2nsnc12)c1cccc(S(=O)(=O)N2CCOCC2)c1 19107833 QVUBCHHTVQEKNN-UHFFFAOYSA-N 483.553 0.336 50 20 JCGD CCCCCS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 727982330 MAFQXEYYQYGMEV-UHFFFAOYSA-N 461.562 0.074 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CN3C(=O)NC4(CCCCC4)C3=O)cc2)CC1 728213203 UUGRXLXVTZRCRY-UHFFFAOYSA-N 478.575 0.321 50 20 JCGD N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCO[C@H](C(N)=O)C1 747775607 FOVNTQKNDVEJHN-DZXKJOIRSA-N 456.890 0.699 50 20 JCGD Cn1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1C(=O)O 912979438 UBJIXHWONPHPJC-UHFFFAOYSA-N 470.529 0.521 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](c2ccc(C)o2)N2CCOCC2)cc1 916229788 YSCHQGTZXNLAIS-IBGZPJMESA-N 493.586 0.921 50 20 JCGD CN(C)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cn1 916443712 BFHXJOOSLSYHAT-UHFFFAOYSA-N 462.532 0.313 50 20 JCGD CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1 916646836 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COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(F)c1 1781596598 JXJCCUPDKFNRKO-JOCHJYFZSA-N 457.462 0.590 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214291 PUTZBLPEQOWKKB-NJNPRVFISA-N 453.584 0.178 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2n1 1782578079 HVGSYOTZXLWREW-HSZRJFAPSA-N 456.547 0.768 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1[nH]nc3c(Cl)cccc13)CCO2 1783934538 HYGVYZOKWSFKMM-JOCHJYFZSA-N 476.965 0.962 50 20 JCGD COC(=O)C12CCC(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)(CC1)CC2 1783936301 UAGBGEVKNPHORV-VHYCJAOWSA-N 478.590 0.703 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784094959 WQPNQKPJCZIINM-TXPCXHQGSA-N 471.982 0.823 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCC(C)CC3)[C@H]2C1 1784316491 VBNXGSAXXRIMLY-QYVIPLSYSA-N 472.590 0.832 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnnc3O)C[C@@H]21 1785076585 WOJIFQXLZYXMLR-TUUVXOQKSA-N 483.953 0.908 50 20 JCGD COc1cc(Cl)cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1785138075 YHGITQZKTSCZDF-QFIPXVFZSA-N 458.707 0.786 50 20 JCGD CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786978636 GJFPMCOYZHUMIB-VDGAXYAQSA-N 453.304 0.067 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccccc3=O)[C@H]2C1 1787014003 JBBDNNSAOKLPNP-XSLAGTTESA-N 496.992 0.960 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(n3)OCCO4)[C@H]2C1 1787381072 HTDZRDOGAZOWKX-WNFKGGOLSA-N 496.524 0.580 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)C[C@@H]21 1791253385 AYWMYFNKHGTUHX-SOMFZHDCSA-N 489.997 0.448 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792979100 UKOSIMCGRDAJOQ-MCZKYTFGSA-N 487.981 0.200 50 20 JCGD Cn1nncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1794225644 CQKLAUKFFGZOIZ-XFMPKHEZSA-N 456.931 0.150 50 20 JCGD Cc1ncc(Br)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1794317389 XESWUMGJCRMDNR-CCWDJLKJSA-N 488.147 0.349 50 20 JCGD COc1nccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1794372626 LUPUGXSFKMRCME-OPVJXMOQSA-N 497.556 0.035 50 20 JCGD CC1(C)CCc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)c2O1 1795734405 GLGBGIXNEIHSLS-HATOLVCRSA-N 478.354 0.987 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)CC2=O)c1 1796189757 WLQWWNDWVNTJJH-CMCXCUNFSA-N 491.353 0.680 50 20 JCGD C[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)NC(=O)OC(C)(C)C 1796831800 IASBUWPKALCQCO-DQEVTTJGSA-N 459.352 0.922 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799346898 ILBJENYGFYRVMO-DXUDUQDWSA-N 494.358 0.637 50 20 JCGD Cc1cc2nnc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)c(C)n2n1 1799346963 GKCOTUBIWRJRAH-JLUCKKNBSA-N 455.288 0.635 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1800976950 DRNHLWZOSXZUFC-AJYBTWMASA-N 481.981 0.176 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1)c1ccc(B(O)O)cc1 1801415683 RHNDAYPEJZRKBT-HNKHHVNMSA-N 476.264 0.775 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1802618000 RQGIGZIZQIEANO-RDGPPVDQSA-N 485.346 0.544 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C1 1803130801 LFMVPWPUEOJIMY-XHYAQGIWSA-N 479.342 0.670 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1F 1807369715 SMYXOZPJXLKBIG-PXNSSMCTSA-N 465.294 0.576 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1807372281 DCKMHNXBENHMIY-AZUAARDMSA-N 465.315 0.424 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C2CCC(O)CC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374084 IFOJEFMNTBWDBB-HHKCAYGPSA-N 451.332 0.632 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)C(=O)N(C)C)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807452662 KQPNYYABNNSLRB-IFMALSPDSA-N 495.584 0.522 50 20 JCGD CN1CCC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1 1807540701 JKNMEKZLKPOUPI-ONTIZHBOSA-N 450.348 0.423 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1 1807644839 DPEPNFLBMDYGGP-UHFFFAOYSA-N 499.398 0.465 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807996645 XZBPGMOYIOYZML-VBKZILBWSA-N 477.481 0.520 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc2nonc2c1 1809127142 PVJAPTJVUPTFPI-XMSQKQJNSA-N 471.282 0.931 50 20 JCGD CN(CC(=O)N1CCC2(CCCN(C(=O)Cn3cnnn3)C2)CC1)NC(=O)NCc1ccccc1 1810155495 VTDZLKCJHJNIRJ-UHFFFAOYSA-N 483.577 0.251 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2c3c(nn2C)CCC3)[C@@H]1c1cccnc1 1812226735 CHMSDYFMRKHIPK-JTSKRJEESA-N 467.574 0.996 50 20 JCGD COCc1c[nH]c(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1 1815343842 RSRODSNOLZFEGD-HNNXBMFYSA-N 454.317 0.837 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1COc3ccccc3O1)CC2)c1cccc(B(O)O)c1 1815350283 OAROAQDVVLRFAV-HNAYVOBHSA-N 479.323 0.889 50 20 JCGD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)n1ccccc1=O 1815361119 XZXOPLWFOCUXGE-CJNGLKHVSA-N 466.328 0.472 50 20 JCGD C[C@@](O)(C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(F)(F)F 1815528373 UMIHQZZWVNPFLN-KBXCAEBGSA-N 454.214 0.709 50 20 JCGD N[C@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)c1cccnc1 1817471111 DTEDMWBCGCGPJQ-QUCCMNQESA-N 462.319 0.881 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)N1CCN(C)CC1 1817472740 VRULMZKEZIYRNZ-JXFKEZNVSA-N 468.367 0.031 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)N1CCN(C)CC1 1820784146 AMWVDVFWHYEECS-UZLBHIALSA-N 468.367 0.031 50 20 JCGD NC(=O)c1nccnc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2 1821040846 MNGBGTUIQYVJOG-KBUNVGBDSA-N 457.285 0.948 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@](C)(O)CC(=O)O)n[nH]1 1822414853 USQVOZBMLWWLKF-VLIAUNLRSA-N 452.512 0.391 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)N1CCOCC1)CC2 1825445702 GHOZUGDNTZBICF-GDLVEWKHSA-N 461.382 0.879 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525494 RYJFNHBICGEVEN-XOBRGWDASA-N 484.347 0.533 50 20 JCGD Cn1cccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)c1=O 1828923354 FVGPVOVGCLOENV-HXUWFJFHSA-N 466.542 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCCCC2=O)CC1 1828925127 DRVODIGBACWNTD-FQEVSTJZSA-N 470.574 0.931 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COCCO)CCN2C(=O)OCc2ccccc2)C1 1829231147 ATFLFSNYRNLUAK-AUSIDOKSSA-N 497.976 0.701 50 20 JCGD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)nn1C 1829843477 RZCJTZVWHPYHJJ-HXUWFJFHSA-N 454.336 0.656 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cn1 1830538439 FVBVFJCYBORIII-JLTOFOAXSA-N 484.347 0.969 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cnn3c2OCCC3)CC1 1830879095 IKFFXQDHHZFNMS-OAQYLSRUSA-N 466.347 0.893 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1 1831106503 YDCMHAFTESOUFQ-IBGZPJMESA-N 467.530 0.175 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2 1831705252 VGUADJWROPNPDG-SOAGJPPSSA-N 476.496 0.548 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2 1832386877 DQMAWDKIJAKIOI-DEOSSOPVSA-N 482.317 0.307 50 20 JCGD Cn1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)cn1 1832551513 PUJQEWBXDCABQM-JTSKRJEESA-N 499.996 0.551 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CC(=O)NC3=O)CC2)CC1 1833712895 OITVKGALSSMHGW-OAHLLOKOSA-N 472.384 0.283 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cscn3)CC2)CC1 1834221394 SQTNAQNWRKFPAH-UHFFFAOYSA-N 457.560 0.641 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccnc(Cl)n3)CC2)CC1)c1ccc(B(O)O)cc1 1834798385 OAFOVXHWJSRMAZ-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cncs3)CC2)CC1 1835736924 ALMAYBPHUBMWEV-UHFFFAOYSA-N 457.560 0.641 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3sc(N)nc3c1)CCO2 1835788165 ODMDXWPMVRTNDX-QFIPXVFZSA-N 490.586 0.322 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc[nH]n3)CCO2)C1 1836347371 FVLUXHSLMPGCPN-DJJJIMSYSA-N 472.930 0.007 50 20 JCGD C[C@H](Sc1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837231152 DRXRGJCGXLIXGB-AOMKIAJQSA-N 490.412 0.679 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1 1837456946 QJDHOZIMNIHWAB-LFTXJPJQSA-N 455.471 0.062 50 20 JCGD CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)nn1C 1838274734 FLSPPKFVLTXQHM-AJPHYDNBSA-N 485.545 0.187 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838386306 GBJGHNFNKNYVQT-LJQANCHMSA-N 452.596 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3)CCO2)C1 1838955471 OJHBRHHPIURUAE-QFIPXVFZSA-N 457.462 0.208 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1 1839373469 HXBZGTKDURGWBM-ZMZPIMSZSA-N 459.293 0.657 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1839387601 OYEACZWTEHGNTF-VMDGZTHMSA-N 484.377 0.522 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3nscc13)CCO2 1839577202 FTHHPKYTDGUODV-JOCHJYFZSA-N 475.571 0.739 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2 1839634694 VWEGRTRULZHLFH-RXVVDRJESA-N 479.375 0.994 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1839802242 POBIRWQULYJCNN-GTCCEBARSA-N 496.402 0.974 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1839948697 FBZDLKPIMIRYGW-CYFREDJKSA-N 460.575 0.928 50 20 JCGD Cc1cnc2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)cnn2c1 1840033722 NPHNJIMQPJNYJP-LIRRHRJNSA-N 466.336 0.891 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)c3ccccn3)C2)C1 1840186070 YZOJMCSEHGDTRI-QHCPKHFHSA-N 461.563 0.189 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840726117 YLSLNIHKSDAJDW-QHCPKHFHSA-N 475.546 0.088 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(OCC3CC3)cc1)CCO2 1840749530 FJTIXIKXMUJQRO-RUZDIDTESA-N 488.585 0.918 50 20 JCGD CC1(CC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CN(C(=O)OC(C)(C)C)C1 1843013028 ZXMGMFRIPORCJY-UHFFFAOYSA-N 471.363 0.831 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccc3c2NC(=O)C3=O)C1 1844126642 UVLALHQDLMAVHV-LGJNPRDNSA-N 462.466 0.772 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2nccnc2C(N)=O)C1 1844595147 WHYIRJQDTKXJGW-LBPRGKRZSA-N 466.926 0.525 50 20 JCGD CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)CNC(=O)c2cccs2)CC1 726273063 WJTQOJSFGWDANE-UHFFFAOYSA-N 458.544 0.677 50 20 JCGD COc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(N)c(OC)c1OC 728334214 OMANXHMJYIACEV-OAHLLOKOSA-N 461.427 0.439 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1ccc(NS(=O)(=O)c2cccs2)cc1 729276884 NLMMIKIALXRDDZ-LLVKDONJSA-N 460.559 0.177 50 20 JCGD COC(=O)CN1CCN(c2ccc(NC(=O)NNC(=O)COc3ccccc3O)cc2)CC1 730900397 OFSMOZWDPWHQKQ-UHFFFAOYSA-N 457.487 0.919 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC)c(OC)c2)cc1 825542112 HXEJLXSBDDAFQL-UHFFFAOYSA-N 452.489 0.250 50 20 JCGD O=C(COC(=O)CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1 834572343 UZKVXVQFVLDIAH-BPOBUFBUSA-N 489.506 0.497 50 20 JCGD O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 912643269 NOYNYZIMRJLAAH-HZVDNRATSA-N 486.550 0.429 50 20 JCGD CN(CC(=O)NNC(=O)COc1ccc(Br)cc1)S(=O)(=O)c1cccnc1 915133175 LTMAZAYSDVLLDW-UHFFFAOYSA-N 457.306 0.691 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)CN3CCCNC3=O)cc2)cc1 915259626 GCRMXGHHLCKLJB-UHFFFAOYSA-N 473.555 0.992 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)S(C)(=O)=O)c1 916095458 MBWKRKIMHSPGON-GFCCVEGCSA-N 455.514 0.690 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2F)cc1 916649520 PXLPTCHLCDYECR-UHFFFAOYSA-N 454.480 0.660 50 20 JCGD CSCC[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 919809982 PGTVTBWEXLUQJN-NSHDSACASA-N 498.543 0.794 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccnc2)CC1)C1CCN(c2ncccn2)CC1 1321551824 WIASLQFRQYVWRU-UHFFFAOYSA-N 473.559 0.336 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cccn1)C2 1778091302 WGTRCYVOBWDWFL-IINOVHIQSA-N 455.519 0.531 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nnsc2C2CC2)C1 1778290537 CJWYZZXOXMRQGZ-OPAMFIHVSA-N 485.570 0.855 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3(C)CN(C(=O)OC(C)(C)C)C3)C2)C1 1778318046 XENQVPLWSQTYST-QHCPKHFHSA-N 481.594 0.446 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)ccn1 1778405378 TYWMZCBXCMQKOQ-WZONZLPQSA-N 474.562 0.541 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1778407556 FUKAUZFQIGCHEY-HSZRJFAPSA-N 451.263 0.744 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779030619 DLLYXMOQLRTYPR-QHCPKHFHSA-N 453.499 0.380 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccnc(Br)c3)C2)C1 1779399463 DPIQQCRHLXABAD-HXUWFJFHSA-N 474.120 0.281 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c(C)n1C 1779971349 GZQHHUFQVMWNLW-ZJSXRUAMSA-N 453.348 0.763 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780777064 LVPOSCWYRXEIFN-YKTARERQSA-N 488.358 0.661 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cncnc1)CCO2)NC(=O)NCc1ccccc1 1780968738 DTYVFNQKDVPPNQ-HSZRJFAPSA-N 467.530 0.266 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(Cl)c1)C2 1782209568 ZZGFWHXUTGZLGH-QVKFZJNVSA-N 467.954 0.941 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(C(=O)OC)cc3)CCO2)C1 1783884884 VKZALPVEWPNZIV-UWJYYQICSA-N 454.907 0.936 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnc4ccccn34)[C@H]2C1 1784047243 VPDAAGWJRABZKP-YSSFQJQWSA-N 477.525 0.169 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1 1784370496 HEFTUEFQHLKWBM-CRFBAAHOSA-N 470.368 0.318 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1784633362 DFONAERBDVOZBX-UQBPGWFLSA-N 497.600 0.929 50 20 JCGD C/C(=C/C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C(=O)O 1785412695 YQPNOEQZPDNFRN-MMGHULSSSA-N 459.927 0.979 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)ccc(F)c3F)C[C@@H]21)c1ccc(B(O)O)cc1 1786980137 MNLMIMAIYDZDLA-VHFSOBRXSA-N 476.260 0.620 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1788703303 FJSNNNWXQKQYDL-YXWQFLTLSA-N 468.352 0.360 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)nc3)[C@H]2C1)NC(=O)NCc1ccccc1 1789301078 UCPXSZDARFUBMC-ACRUOGEOSA-N 496.568 0.727 50 20 JCGD COc1cc(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1OC 1790192913 ZILDSTCVWRCSFW-NYDSKATKSA-N 482.342 0.599 50 20 JCGD COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(OC)c1 1790768129 JREOVJKRNIDENF-VCOUNFBDSA-N 490.601 0.989 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790961496 MESYOPKWFULQDC-LLLHUVSDSA-N 453.142 0.133 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1792879433 MYONGAYVZFTFIO-OACYRQNASA-N 494.552 0.116 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1793858937 BXNGZRQZEMJJCI-BCDXTJNWSA-N 459.352 0.922 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1CCOCC1)C2 1793880716 DMOKQFQEYAAXRZ-ZMMAXQRCSA-N 489.013 0.430 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccnc1Cl 1793953721 ZNZDSMSWUYWRSV-ZSBFGKGUSA-N 458.906 0.179 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCn1c(=O)oc2ccccc21 1794255052 INIQUNJPQBGSLU-MUJYYYPQSA-N 478.509 0.935 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc3c1CCCC3)C2)c1ccc(B(O)O)cc1 1795734611 URVGUVHIJATOQW-VPTLXERWSA-N 454.357 0.824 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1n[nH]cc1I 1796188693 JODDYIXCCITRTQ-BTTYYORXSA-N 494.098 0.260 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccnn13)C2 1796443977 STFAFIZSBLXFJD-IHBLFXCCSA-N 463.498 0.672 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nc(CO)[nH]c2c1 1796868597 ZCLOEMOEQQLSJF-LNPMFIPTSA-N 493.524 0.392 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCO3)C2 1797754088 TVDPAZQPMIRSRJ-FAQVEIGNSA-N 465.510 0.066 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(=O)OCCO 1798566388 YDWYTRPHOKAJGC-CWPLJXCYSA-N 464.591 0.890 50 20 JCGD 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CNC(=O)C2)CC1 1827679595 KMDSEZURRQCMPS-ZQXPGIFISA-N 456.547 0.876 50 20 JCGD O=C(CN1CCSCC1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1829714700 CCMGUBQBLIRROS-GOEBONIOSA-N 454.362 0.182 50 20 JCGD O=C(c1ccnc(C(F)(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724592 IJZHIVPSPDYPNA-SUMWQHHRSA-N 451.829 0.770 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)CCO2 1831110657 LZLAZIJQJGWQPR-NMMYMHLASA-N 493.988 0.745 50 20 JCGD CC[C@H](NC)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549654 WILHGBLAJPLVHY-CKJXQJPGSA-N 477.002 0.573 50 20 JCGD CCn1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1834414022 GGNQLKORNYLZBE-LWROZRRASA-N 471.518 0.107 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)COCc3ccccc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797957 PQPOWEQLZLYEOG-UHFFFAOYSA-N 479.386 0.768 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3c(F)ccc(O)c3F)CC2)CC1)c1ccc(B(O)O)cc1 1834799307 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Cc1cc2[nH]c(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc2s1 1839523745 BMRBVDSXQUZHQO-HSZRJFAPSA-N 483.355 0.601 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3C=CS[C@@H]31)CCO2 1839697564 AWEJPXXMALTEMX-RJTOAGSRSA-N 473.555 0.452 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1839987021 JFDRXKVHCVRRRJ-GOSISDBHSA-N 464.357 0.753 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(Br)cnn3C)C2)C1 1840152944 ZATIDQXVTPEFOU-SUMWQHHRSA-N 479.759 0.506 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(=O)Nc3ccc(F)cc3)C2)C1 1840154365 VOOJGZGFUHHONQ-DYESRHJHSA-N 471.913 0.865 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1 1840187390 WZJHSUPKHSYBKP-XMMPIXPASA-N 458.559 0.231 50 20 JCGD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840881197 IAKNJWMZBUBNOX-ULIAPGIUSA-N 489.294 0.964 50 20 JCGD C[S@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841348435 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O=C(Cn1c(=O)[nH]c(=O)c2ccccc21)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 11682861 MWGIHDPRXAZQKN-UHFFFAOYSA-N 496.487 0.853 50 20 JCGD Cn1nc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c2ccccc2c1=O 17192555 XZLCKXGWWNUONE-UHFFFAOYSA-N 499.549 0.348 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br 725739504 HWSNZGDWOYBBFM-UHFFFAOYSA-N 485.316 0.674 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1 729274876 GKIXPLVFCNENOT-LLVKDONJSA-N 458.493 0.325 50 20 JCGD CCN(C1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1)S(C)(=O)=O 731358308 NQQHEYTWLQSZAG-UHFFFAOYSA-N 460.582 0.080 50 20 JCGD Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)C(=O)N3CCCC3)CC2)c(C)c1 748247402 NGSGGMAHLPFUSN-UHFFFAOYSA-N 450.561 0.782 50 20 JCGD CCCc1nnc(S)n1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 750866550 CMSJGTVKCRQWGR-UHFFFAOYSA-N 468.561 0.001 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cn2ccccc2n1 863950443 UDGPSNCFPCKOPW-UHFFFAOYSA-N 457.512 0.749 50 20 JCGD O=C(C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1)N1CC[C@H](B(O)O)C1 864234106 MUBCCJHKVRTUSO-NSHDSACASA-N 451.173 0.987 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1 906470454 AWRWKIANJLMDLU-HNNXBMFYSA-N 490.538 0.434 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1 913154132 JGRCTQFKDUBJAM-UHFFFAOYSA-N 480.304 0.164 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1 913455267 XMHATONXJFYDBP-SFHVURJKSA-N 458.496 0.856 50 20 JCGD CN1CCN([C@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2cccs2)CC1 915901321 HIPIOIWWZYNJPF-MRXNPFEDSA-N 479.632 0.974 50 20 JCGD COc1ccc(OCC(=O)NNC(=O)NCc2ccccc2CS(=O)(=O)N2CCOCC2)cc1 916228470 CFGSEWLKASZYTL-UHFFFAOYSA-N 492.554 0.767 50 20 JCGD O=C1Nc2cc3c(cc2C1=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)OCCO3 916258674 IFWSOGSVUHSGTE-UHFFFAOYSA-N 472.479 0.565 50 20 JCGD Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1 916279008 JDZHTBDXOXXLTQ-UHFFFAOYSA-N 451.461 0.591 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1 916562064 JXGVYPCCSPXUTL-UHFFFAOYSA-N 461.500 0.326 50 20 JCGD O=C(NNC(=O)[C@@H]1COc2ccccc2O1)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 919805952 FBCWNIUKLIJKIJ-LIRRHRJNSA-N 490.494 0.983 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)C[C@H](C)n1ccnc1)N(S(C)(=O)=O)CC2 920596050 DKKZDLTXYROOGM-WMLDXEAASA-N 479.559 0.948 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4cc[nH]n4)n4ccccc34)C2)C1 1778373723 MRNWHHUDTQHQON-AREMUKBSSA-N 499.336 0.767 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029715 XNNBUHMKQWBPPO-HJPURHCSSA-N 467.530 0.134 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2 1779030646 GCVWHDCGLHTHFJ-AVRDEDQJSA-N 472.933 0.482 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3cnccc13)CCO2 1779032391 PZOGMCNNJQSTDJ-XMMPIXPASA-N 460.494 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)CSCC(=O)O)C2)C1 1783952867 MOHSARDBHZNZPD-ORAYPTAESA-N 479.983 0.766 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1783975693 QVJUCZPWTYDAEU-VOAKCMCISA-N 478.434 0.857 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784096616 IVIZMQJJJBNRSV-QMHWVQJVSA-N 491.969 0.022 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)n3cnnn3)C2)C1 1784599691 WRQKUCSIXYCRRS-XCLFUZPHSA-N 473.446 0.211 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1785514124 VHKBYHMVHLYWHN-KDLAUNOPSA-N 487.362 0.113 50 20 JCGD O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCNC4=O)C[C@@H]21 1786406805 GGDAGMMVZHZJFS-XEZPLFJOSA-N 468.352 0.395 50 20 JCGD Cc1cn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c(=O)nc1O 1786408096 HPEWVTASXLSZIQ-IHRRRGAJSA-N 457.325 0.022 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc4ccccc34)[C@H]2C1 1787884224 BAQLXQWLKWJWQI-JBYOLUDKSA-N 475.509 0.535 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607840 NTAZWZSTUWXHAM-ALGWMNEGSA-N 481.557 0.284 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789383168 SIDUWEKFXRNAEF-JLMWRMLUSA-N 468.363 0.613 50 20 JCGD CCn1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724677 KDROWNWUINSHKH-ONTIZHBOSA-N 497.600 0.843 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4[C@H]3O)C[C@@H]21 1791287893 AZNKGEZIEDJAHT-SREQLBMHSA-N 472.586 0.635 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCN1C(=O)c3ccccc3C1=O)C2)[C@@H](O)CCl 1792975779 XLADEMWODQLVHQ-CSHUHZATSA-N 463.918 0.252 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1793299990 WVPPVWYTJUYRAB-MHYJACLRSA-N 464.327 0.382 50 20 JCGD COC(=O)c1ccc(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1 1796189605 HJUSXSUOEAYOIQ-ACDBMABISA-N 466.299 0.484 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1CNc3ccccc3O1)C2 1797751575 ITWQPYPUDGBOCW-CPBBTPEFSA-N 480.525 0.152 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(=O)O)ncn1)C2 1798522576 AATMYJFHEBYNGE-DBWKPXFBSA-N 499.436 0.525 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H](O)CCN1C(=O)OCc1ccccc1)[C@H](O)CCl 1802059218 MRVCPCZIHNXEKX-APNJTCTJSA-N 479.961 0.996 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@H]1CCc2nc(O)nc(O)c2C1 1804563994 SNLVWGCGWXMJAV-KYABYICQSA-N 475.933 0.693 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1F 1805150172 MBHYIVWHTLJTGK-UZLBHIALSA-N 459.526 0.955 50 20 JCGD N=C(N)SCCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807121561 DOKIDEKDGLOBBJ-APWZRJJASA-N 455.349 0.098 50 20 JCGD Nc1ncc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1 1807365303 UIVIFAYHNDUMPR-CRAIPNDOSA-N 451.317 0.434 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnn2ncccc12 1808174216 QKBKKIGZRGTRDV-GCJKJVERSA-N 470.298 0.438 50 20 JCGD COC(OC)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808407611 DGVQTEYIVAPWBE-GMQOBWHFSA-N 456.503 0.840 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)C1 1809968475 YOLYKSCJAFAGAV-RBUKOAKNSA-N 456.348 0.801 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CCN2CCN(C)CC2)[C@@H]1c1cccnc1 1813031994 UFALCPOHDXPFFA-IRFCIJBXSA-N 451.999 0.979 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cn2cccc([N+](=O)[O-])c2=O)[C@@H]1c1cccnc1 1813073571 JSBQOFMHFQMDOL-VGOFRKELSA-N 499.528 0.231 50 20 JCGD O=C(COc1ccc(O)cc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350559 XYSSKNRBURLEGG-HNNXBMFYSA-N 467.312 0.833 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361931 UXQXTLSHSPOEHF-BXKDBHETSA-N 452.139 0.832 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccnnc1O)CC2 1817281857 RQZSLHOFLHBRIX-YBGGJHSQSA-N 468.499 0.999 50 20 JCGD CN1N=C(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)CCC1=O 1817473843 CDRNCSHGZWXKJK-QGZVFWFLSA-N 452.280 0.004 50 20 JCGD Cc1cc2nnc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)[nH]n3)c(C)n2n1 1818589031 ARMPNZMBTZSTSO-GOSISDBHSA-N 488.317 0.764 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc2ncnn2c1 1819214117 UGPURYJWJVKUOJ-SFHVURJKSA-N 459.275 0.752 50 20 JCGD Cc1cc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)on1 1819793898 VALRVINXUJPMII-LLVKDONJSA-N 455.500 0.907 50 20 JCGD O=C(CN1CCCCC1=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822300101 XUMUZIMIYXBGOH-GOSISDBHSA-N 453.308 0.408 50 20 JCGD CC[C@@H](Br)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(O)O)C2)C1 1829316075 SWPRDIUYPYXENA-IERDGZPVSA-N 498.374 0.923 50 20 JCGD O=C(c1cnccc1C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726077 UAASVPYQJXONAI-YOEHRIQHSA-N 451.829 0.770 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1830883221 CJLVXQZFHNNMNJ-LPMFXHHGSA-N 467.922 0.253 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(OC)n3)CCO2)C1 1832826959 ZZXBDXBPSWAOGI-LAUBAEHRSA-N 455.939 0.733 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833599073 BOYYKYBIPDJOMK-RBUKOAKNSA-N 494.397 0.791 50 20 JCGD CCc1noc(C)c1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801021 GSZKCNWPWAMITR-UHFFFAOYSA-N 468.363 0.724 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCC(=O)N1)CCO2 1835312462 ZJMYHJGEOPWERQ-LHMGHXNASA-N 474.464 0.607 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)/C=C3\C(=O)Nc4ccccc43)CC2)CC1 1835688399 AQLQYUQWGORLBF-FXBPSFAMSA-N 496.612 0.967 50 20 JCGD O=C(c1ccc(-c2cc[nH]n2)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932086 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COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1 1839625093 BMQUAILQZMJCSX-IFXJQAMLSA-N 455.874 0.192 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1 1840035506 UKVHHLFNQJVWRH-XERREHJYSA-N 479.375 0.992 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1840896618 IVRKJAXWXKTSPM-SFHVURJKSA-N 475.665 0.155 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CCCN2C(=O)OC(C)(C)C)C1 1846202305 CMFSONGLEBUEOJ-MRXNPFEDSA-N 451.568 0.962 50 20 JCGD CCn1c(=O)n(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2ccccc21 12606364 QLWQHAIOCZCRAL-UHFFFAOYSA-N 487.538 0.305 50 20 JCGD O=C(Cc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1 104740805 JITKZNXKWMYJHA-UHFFFAOYSA-N 469.527 0.841 50 20 JCGD CCCS(=O)(=O)NC1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 728960484 ZYWVIPOAHYUGOU-UHFFFAOYSA-N 453.569 0.228 50 20 JCGD C#CCNC(=O)CN1CCCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1 729257440 DZYIEMCTNYGFJZ-UHFFFAOYSA-N 462.554 0.941 50 20 JCGD C[C@H]1Oc2c(cccc2C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)NC1=O 729295892 QCVWYYPWIAYWTK-CYBMUJFWSA-N 474.495 0.502 50 20 JCGD O=C(NNC(=O)[C@@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1)C(=O)N1CCCC1 748241273 SEINAWXWYBSYOK-IBGZPJMESA-N 474.514 0.711 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1 751205222 ZOZONHSMHCMHDK-UHFFFAOYSA-N 480.407 0.530 50 20 JCGD COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1 751292792 AWSCGSDRUWKDFB-UHFFFAOYSA-N 451.439 0.884 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCN(C(C)=O)CC2)c1 849366497 FDRJYNVZBCXWTJ-UHFFFAOYSA-N 489.554 0.421 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccccc3)CC2)C[C@H](C)O1 912920173 XIGGIWDAXITUJS-IRXDYDNUSA-N 452.577 0.734 50 20 JCGD COc1c(C)cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C 915185641 KHLWJJZWDAPUNE-UHFFFAOYSA-N 483.568 0.956 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(S(=O)(=O)NC[C@@H](C)O)cc1 915474834 DDAXNXFVFSYWGV-GFCCVEGCSA-N 499.929 0.626 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCS(=O)(=O)NCc2ccccc2)nc1 916645168 GYFQCDAZBDOBFC-UHFFFAOYSA-N 484.604 0.858 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)c2cc3c(=O)n(C)c(=O)n(C)c3n2C)c2ccccc2c1=O 919689446 PSPAVHACQSOGIU-UHFFFAOYSA-N 493.524 0.551 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1nc(Cl)ccc1F)CCO2 1779028078 BWMCLVTZPBVVEA-HXUWFJFHSA-N 462.869 0.630 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cccnc1)C2 1779373451 SNTUCDJHUHDMKJ-AUSIDOKSSA-N 452.515 0.450 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ccc1O)C2 1779374623 STDXSSXPTGNCFU-AUSIDOKSSA-N 469.498 0.538 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(O)nn1)C2 1779546199 JMKZEKUJGQCMRT-FOIQADDNSA-N 452.584 0.926 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3c[nH]c(=O)cn3)C2)C1 1780249407 VXXGAIPCWQFWCH-NRFANRHFSA-N 471.426 0.361 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1781054393 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CC(=O)c1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n[nH]1 1805261711 NIPQHVQINOIKQU-HRAATJIYSA-N 455.519 0.700 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1807368531 UXMATBVTHWVZFT-IEBWSBKVSA-N 451.288 0.034 50 20 JCGD CNC(=O)CC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808409544 NXXMQHAISBEUJC-RMFAIBCQSA-N 453.503 0.358 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1 1809763976 FIZGRMHNFCLEFG-IIBYNOLFSA-N 485.508 0.756 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1 1810101197 YCIONPIYHSNCFX-RMRHIDDWSA-N 461.288 0.842 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810293491 FGMWGVDPQSSWFM-QFBILLFUSA-N 467.530 0.314 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1 1812143671 BGZUFAIAKSFPIY-VGOFRKELSA-N 453.547 0.917 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 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C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825642628 TZWWVKHRURATDE-BXKDBHETSA-N 452.139 0.832 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc2ccccc2)C1 1828551643 SNBGMTJWXLVNLN-HFXUHXBXSA-N 494.976 0.563 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCC3)CCO2)C1 1829866699 JPNWLYDOIAOPMM-HTAPYJJXSA-N 489.013 0.671 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CCN(C)CC3)CCO2)C1 1830001568 ZXZUFRKJXXQMNW-FXVMGJAWSA-N 488.589 0.309 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1C1CC1)CCO2)NC(=O)NCc1ccccc1 1830501003 GCNSYDOOUUTYKL-UFPGJGBJSA-N 499.612 0.835 50 20 JCGD COc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1OC 1830725782 MABAPMLDUQDVJU-JTSKRJEESA-N 470.950 0.693 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)C1 1830726574 QUNCBRVHUWWCTK-IIBYNOLFSA-N 473.954 0.220 50 20 JCGD CC#C[C@@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)c1ccc(O)cc1 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C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]cc3[N+](=O)[O-])CCO2)C1 1837797616 XVJQUWAMJGNOIC-JKSUJKDBSA-N 450.279 0.624 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc4cccnn4c3)CC2)CC1 1837920330 ZUSXNLGGLQHUTK-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CSc3ncccn3)CC2)CC1 1837959274 KPQTYAPIFMMWLE-UHFFFAOYSA-N 478.619 0.940 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)CC2)CC1 1838267138 IFOJLFPWVCURFL-LJQANCHMSA-N 494.054 0.910 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)nc4cccnn34)CC2)CC1 1838527183 NXURRJMHYDOAKX-QGZVFWFLSA-N 477.949 0.956 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccno3)C2)C1)NC(=O)NCc1ccccc1 1839054306 SNGVWIQLGOVCDC-HSZRJFAPSA-N 486.529 0.091 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201380 WAMBSDWDNQIZOA-KSSFIOAISA-N 470.299 0.798 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1)n1cnnn1 1839743804 WTXRJYSHAXKVET-CZPMCIAXSA-N 487.467 0.576 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1839804312 PFIBOAFBJTXXHN-AUSIDOKSSA-N 495.960 0.311 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1839967511 OOOZTADRWOBYNG-MLGOLLRUSA-N 462.370 0.527 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ncccn3)C2)C1 1840031959 HUUQHSIJQWDEFZ-GUYCJALGSA-N 459.366 0.809 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)c3ccc(OC)cc3)C2)C1 1840149657 WPCAVOQUWRFCET-WAOWUJCRSA-N 456.923 0.439 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)c(C)n2n1 1840187743 UBAMDWODYHSYSA-GOSISDBHSA-N 457.318 0.615 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840898370 FWJVJRXOGSQEKH-HCXLOTKHSA-N 495.297 0.058 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841353018 ZFJXXGUSZCPHLS-KBPBESRZSA-N 461.943 0.636 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 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O=C(CCNC(=O)c1n[nH]c2ccccc12)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 728064773 HUGQUBQKHIHSPE-UHFFFAOYSA-N 484.538 0.929 50 20 JCGD Cc1nn(CCC#N)c(C)c1CCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728326520 AANVLKCGOOWFGG-LJQANCHMSA-N 455.471 0.877 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)Cc2cccnc2)o1 728851511 HHXZQVQSGPDNIL-CQSZACIVSA-N 450.473 0.395 50 20 JCGD O=C(COc1ccc(CCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1)NC1CC1 728946910 MQXVELHIBWKPPL-UHFFFAOYSA-N 481.557 0.924 50 20 JCGD COc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)ccc1OC(=O)c1cccnc1 730569099 NGAQAEOJIQQJJK-UHFFFAOYSA-N 484.494 0.344 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 745991949 MXZBFMDXAXJYCR-UHFFFAOYSA-N 462.484 0.945 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc([N+](=O)[O-])cc1I 751200488 WCTIPNKBIYCGGP-UHFFFAOYSA-N 458.168 0.983 50 20 JCGD O=C(CN1C(=O)COc2ccc(Cl)cc21)NNC(=O)c1csc(N2CCOCC2)n1 818029379 TWVBUDGDHVBDIL-UHFFFAOYSA-N 451.892 0.820 50 20 JCGD Cc1cc(C)nc(NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C/c2ccccc2)n1 837302328 AWXHLBANPSLPSC-XLNAKTSKSA-N 467.573 0.930 50 20 JCGD C[C@@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1=O 856530504 HURSNAGICCJVFY-VWLOTQADSA-N 478.553 0.813 50 20 JCGD O=C(c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1)N1CC[C@@H](B(O)O)C1 864233186 HUSOPEZPOWWQTB-MRXNPFEDSA-N 451.354 0.387 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)cc2)C[C@@H](C)O1 912921113 LTYBKWYJJZRFPQ-USTZCAOPSA-N 482.603 0.745 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)[C@H]1COc2ccccc2O1 913416790 SZUWMCXQGSZYKC-OAHLLOKOSA-N 475.401 0.851 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(C)[nH]c1C)c(=O)n2Cc1ccccc1 914755795 YPGABDJOAXCECZ-UHFFFAOYSA-N 463.498 0.834 50 20 JCGD CCc1ccccc1OCC(=O)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916515943 AXMYFHWQUPJTLK-UHFFFAOYSA-N 490.586 0.505 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2nncn2-c2ccccc2)cc1 916580776 VHICEQNKZHITER-UHFFFAOYSA-N 457.516 0.727 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(C(=O)C(=O)NC2CC2)CC1 918777493 MJCZOPWEFKHOHL-GFCCVEGCSA-N 482.335 0.380 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1 1778030300 VYRZLDGRTNTOKX-IMFGXOCKSA-N 468.950 0.731 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncccn1)C2 1778091209 LGWALNBLDCCGMP-WPXOGLPSSA-N 453.503 0.738 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1778091532 JIVWTRQIWRWCGJ-KNHSPJGASA-N 453.927 0.234 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1 1779116429 RBBRTPWSWALCGT-JOCHJYFZSA-N 456.503 0.553 50 20 JCGD COCCOCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097190 SAEYUUJTLYLFBV-NRFANRHFSA-N 465.459 0.627 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)CCOC1 1780760853 ACOCXCRVOMOMNS-AJAKECSLSA-N 489.997 0.784 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1cccc(Cl)c1 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O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1c[nH]c2nccc-2c1Cl 1796221594 KVTACHJKSLAOBB-HBCWATKFSA-N 468.706 0.365 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc(C)c1O 1797753975 GQSCZHONNAVEST-HGKCTWBKSA-N 453.499 0.525 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1800801361 AFBUCXYVVXUULZ-GFQSEFKGSA-N 482.361 0.836 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1800917519 VYQQCOUBWJABKC-NNXHMXCWSA-N 461.987 0.973 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc3ncccc13)C2 1801010639 NWQOZYLVNUCONX-MRSFGVLCSA-N 453.543 0.740 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c(Cl)c1 1801012270 RQJRICWASRJAHW-VTEUUUEMSA-N 452.939 0.925 50 20 JCGD C=C1C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)N(C(=O)OC(C)(C)C)C1 1801103789 CRKFPMYZNPGOQJ-YHELAOLJSA-N 499.373 0.135 50 20 JCGD COc1ccc(F)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801722409 BGROKGNDYXVMIF-DBWKPXFBSA-N 457.462 0.350 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)ccc1[N+](=O)[O-] 1801837280 DNSDUQDZMVHGCR-GSBKIRKESA-N 498.496 0.941 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)C2 1802339819 NKCANNSZBAFVJB-ILOCAZANSA-N 481.594 0.368 50 20 JCGD Cc1cc(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1C 1803287498 TZBPZQUNXPHOSX-AUSIDOKSSA-N 461.331 0.366 50 20 JCGD CCCNC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803442316 RQSJWCKBUNICLJ-VGSWGCGISA-N 481.557 0.706 50 20 JCGD COc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c(F)c1 1807369647 RDICOAJPGKFTDC-JTSKRJEESA-N 478.289 0.938 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374586 LKAIXZSJJBXAQL-FDQGKXFDSA-N 460.137 0.864 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377210 ZLKDQTNLHNAMAA-PGRDOPGGSA-N 488.309 0.561 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)Cn2cnnn2)[C@H]1c1cccnc1 1807611491 SRYMCAUDTHVFKL-IIBYNOLFSA-N 494.468 0.921 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1807950558 UVEVRTOFOCYFHZ-JVLSTEMRSA-N 475.307 0.311 50 20 JCGD CC[C@H](NC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808228798 HTHNVAHKYSWPAM-RZZYGGHASA-N 482.545 0.668 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1 1810301805 CMOVAJSAJUSNLG-YYUNUBRSSA-N 477.525 0.235 50 20 JCGD COC(=O)C12CC(C(=O)NC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)[C@H]3c3cccnc3)(C1)C2 1812835939 JMKALNSENPKTIQ-OJSLEEMHSA-N 492.536 0.743 50 20 JCGD CCCNC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813068250 KGOPWOPDZHXHOB-FDDCHVKYSA-N 460.579 0.767 50 20 JCGD Cc1cnn([C@H](C)C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1 1813380321 STJMOZGXMAKHHP-NQSCKRDGSA-N 461.331 0.847 50 20 JCGD O=C1Cc2cccc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)c2N1 1815360093 LYIJUTUJVACUNJ-OAHLLOKOSA-N 476.323 0.857 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)n1ccccc1=O 1817472036 DLRRZTFIMZUHJW-BEFAXECRSA-N 463.303 0.818 50 20 JCGD COCCOCCOCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822255331 RZJFQOWYNAJGHK-HXUWFJFHSA-N 488.350 0.465 50 20 JCGD CN(C)C(=O)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1823880084 NFYCRXWKCNPHIB-GOSISDBHSA-N 459.551 0.190 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CC(=O)NC1=O)CC2 1825440824 GNAZOLDPMXHZQQ-BDAKNGLRSA-N 458.338 0.780 50 20 JCGD O=C(O)C#CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551531 QOJVRXWKVWRMGL-HTAPYJJXSA-N 477.901 0.126 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CCC(=O)NC2)CC1 1828922180 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Cc1c(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cn2[nH]cnc(=O)c12 1834823773 JYTKIUHXAXYLFC-IBGZPJMESA-N 482.335 0.186 50 20 JCGD O=C(Cc1ccc2ccccc2c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1834891045 CFCKYJIQVYHLLB-MHZLTWQESA-N 488.349 0.832 50 20 JCGD O=C(/C=C/c1ccccc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835107742 WEBFZPAJZNMPBS-KPZSNFNVSA-N 450.300 0.150 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](N)c1ccccn1)CCO2 1835695566 MRSBBEJZARKCLE-SIXWZSSISA-N 455.353 0.569 50 20 JCGD COc1c(C)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1C 1835932223 UUSQIFASVRUTOD-VWLOTQADSA-N 482.342 0.376 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C(F)(F)F)o1 1835935027 CFUBTTFTMGDXPY-NRFANRHFSA-N 496.247 0.670 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3nc[nH]n3)CCO2)C1 1836351599 FVJQEVKNUBHXHY-HXUWFJFHSA-N 474.430 0.022 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1836727795 ULBGXXJGQBONGF-ONGXBYRLSA-N 493.960 0.392 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1 1837440654 RIGNDIKXCYOBNB-CNZVFRIRSA-N 459.385 0.946 50 20 JCGD Cc1nc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)s1 1837456378 HBXGGYYGGYAHDO-NRFANRHFSA-N 474.543 0.142 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)ccc(O)c3F)C2)C1 1837459530 HYOMFPUAHAYMQT-QFIPXVFZSA-N 491.451 0.053 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)[nH]1)CCO2 1837763513 PEELOQMCFLQHCJ-HXUWFJFHSA-N 481.236 0.097 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919151 KCEOKQAPLRAGGK-OAQYLSRUSA-N 458.364 0.552 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1837921634 SXCZYADJKBSIIU-KRWDZBQOSA-N 471.132 0.669 50 20 JCGD COCCn1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1838140537 QVKNAWZKRJBGGJ-UHFFFAOYSA-N 499.572 0.454 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)nn1 1838346190 LZDHJZWIAXNSLB-FZKQIMNGSA-N 457.325 0.586 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3nccnc3C(N)=O)CC2)CC1 1838509552 HAZAQOVXRXJMLO-LBPRGKRZSA-N 468.352 0.971 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3CCC4(CC3)OCCO4)CCO2)C1 1839774867 WEQWSUJWKIVVCK-XLIONFOSSA-N 460.955 0.630 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnn3CCOC)C2)C1 1839964194 JTVCHMQWNIOKRB-DNVCBOLYSA-N 473.368 0.773 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840017892 KLVIZHJXKLXVRX-OCHXJIAHSA-N 487.981 0.155 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cccc(N(C)C)c3)C2)C1 1840151038 VARJILTZHPWIKT-SIKLNZKXSA-N 469.966 0.842 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4cc(C)ccn4c3=O)C2)C1 1840152931 YWZOSOZGSORSCX-VGOFRKELSA-N 478.933 0.327 50 20 JCGD COc1ccc(F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840691028 PXNPQTVKIGCXHO-JOCHJYFZSA-N 466.510 0.277 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)C1CC1 1843360567 ZOLWQURZZNQIHC-KRWDZBQOSA-N 472.546 0.805 50 20 JCGD COCCC(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C1 1843428579 BWQRSVYMJJRUSF-IBGZPJMESA-N 489.378 0.042 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263436 FUMYESQDWQYTTP-MRXNPFEDSA-N 458.519 0.512 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847568682 IJFWFHVSIYTIMY-AJNGGQMLSA-N 475.974 0.130 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NN(C)C(=S)NCCCOC)CC2=O)cc1 726077263 TZZAJIBYIMWJTA-MRXNPFEDSA-N 499.659 0.944 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c1 728528590 HXLRSIZIOKIGQW-UHFFFAOYSA-N 455.290 0.716 50 20 JCGD COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1 751211135 MODXIBWVYOHGCA-UHFFFAOYSA-N 480.568 0.735 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)c1 873787623 NPNUDUQEMJWZLO-UHFFFAOYSA-N 472.520 0.401 50 20 JCGD O=C(Cn1cc(I)c(=O)c(I)c1)NNC(=O)C1CC1 913415830 RQKQNGVZFTUXSS-UHFFFAOYSA-N 487.035 0.615 50 20 JCGD CN(C)C1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCCC1 915898501 YIEJFGJFNYVYCK-UHFFFAOYSA-N 453.565 0.526 50 20 JCGD O=C(Cc1csc(NC(=O)c2ccc(Br)o2)n1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 916114189 UMIGXHDIPIEQIR-MRVPVSSYSA-N 491.345 0.876 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 916559512 JIKFLAVRIHPLPR-UHFFFAOYSA-N 478.527 0.292 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)NCc3ccco3)CC2)cc1 920856388 DKEPPSSOYHJUPJ-UHFFFAOYSA-N 477.543 0.732 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)CC1 1778025877 IKKODLHIBCKPIW-IIDMSEBBSA-N 453.964 0.706 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1 1778287165 IMOUKIAPMONHKI-HSZRJFAPSA-N 464.538 0.970 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3c1OCCO3)CCO2 1779030950 ZSVNBCYNUKHRMA-QHCPKHFHSA-N 467.482 0.214 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@@H]4Sc5ccccc5[C@H]43)C2)C1 1779045507 FZJLAVVARLHDHF-JCUDRXCFSA-N 464.352 0.698 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1779182114 UHYGMRCDJTWBIK-VBHSOAQHSA-N 454.325 0.208 50 20 JCGD CC(C)(C)OC(=O)N1CCn2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cnc2C1 1779950233 ZCHWPDNWKQBBJX-KSFYIVLOSA-N 497.980 0.677 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780774761 LLURUCLGCSEKQR-QQHRNGFRSA-N 454.293 0.255 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780777071 MGMOSQGVOFCMIH-QQDQCYIDSA-N 453.305 0.807 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)cnn1C 1780970464 WKBBEDQZQXBCBB-XMMPIXPASA-N 483.573 0.518 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cc[nH]n2)C1 1781562612 LTCWTDSMYAIARM-GULKHOJOSA-N 455.519 0.600 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CCC3(CC2)OCCO3)C1 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CC(C)(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)NC(=O)OC(C)(C)C 1793012658 JIFOSYOKQCWWFK-XEMDLRDOSA-N 489.378 0.263 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc3n[nH]cc13)C2 1796440209 INHHWZDWXKYCBM-IHZDQNCMSA-N 498.931 0.949 50 20 JCGD Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(C(F)(F)F)c1 1796677295 ULXMJFODNHTLDU-DPIQGUFMSA-N 480.447 0.559 50 20 JCGD COC(=O)C12CCC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)(CC1)CC2 1797265224 ZKPOOYTUEZMWHP-QJSFUDEASA-N 484.358 0.083 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccn(C(F)F)c1=O)C2 1798440003 SCEQHVAIDDEHOU-CLLJXQQHSA-N 460.441 0.808 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)C[C@H]2C1 1800696100 HOKKKDFDJBGFCN-UNPPPGBBSA-N 471.982 0.823 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CN(C(=O)c3ccccc3OC)C1)C2 1800971318 VVJDPPGVZZZZGF-YNVMFWSZSA-N 479.961 0.611 50 20 JCGD 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O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)c1ccccc1)CC2)c1cccc(B(O)O)c1 1815354714 QUZNJJKNJRIJJC-LPHOPBHVSA-N 451.313 0.782 50 20 JCGD O=C(/C=N/N1CCCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1819774673 RTFHNENHSLKXIU-OHHQFBAHSA-N 455.349 0.520 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3nn[nH]c3C(F)(F)F)sc2C1 1821646804 XNDSXSWWVWDLNS-ZETCQYMHSA-N 495.447 0.818 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830364395 IOIVEKWNDRUBKB-BTYIYWSLSA-N 467.954 0.316 50 20 JCGD CN(CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1)C(=O)C(=O)O 1830382854 MYAHUJBBTLZZCN-GXTWGEPZSA-N 450.305 0.840 50 20 JCGD O=C(c1ccc(CCN2CCCC2)nc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728958 ZITHGLFQRJJYQF-NZQKXSOJSA-N 480.993 0.390 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1 1830742369 ALSSOTHTLHEGNL-GCKMJXCFSA-N 477.986 0.857 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2 1832051852 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NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2 1835471730 MLAMAESZSWWIKY-IBGZPJMESA-N 485.463 0.488 50 20 JCGD Cc1nn(C)c(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1F 1835737012 HCJRPACRHWSZRM-UHFFFAOYSA-N 486.552 0.365 50 20 JCGD COc1cc(C)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835931662 WRNOXHQZDVSHHC-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cc(Cl)ncn3)CC2)CC1 1836027894 XMYQMVKXNRXYKR-UHFFFAOYSA-N 465.986 0.688 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1c[nH]c3cccc(Cl)c13)CCO2 1837180976 ZTULGDNUKXIDIA-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837460297 ABDZUGAIMNHNQV-XMMPIXPASA-N 496.524 0.027 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)N1CSCSC1 1837569550 MARJGZVCUVQDCS-CKEIUWERSA-N 454.014 0.086 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1837921037 UHKYHDYVDZLELM-SFHVURJKSA-N 468.363 0.745 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(=O)Nc3ccc(F)cc3)CCO2)C1 1839030403 MJMXWFQIRQNMGK-DYESRHJHSA-N 471.913 0.865 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCOCCOCCOCCOC)C2)C1 1839147487 RYQUJMGDPYJUDT-KNQAVFIVSA-N 495.013 0.547 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)o1 1839201065 VKJWESANYOEGKK-WMLDXEAASA-N 462.272 0.999 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)ccc1C 1839402611 XHMIGHINIVNABO-RXVVDRJESA-N 453.923 0.623 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c([N+](=O)[O-])c1 1839462167 FKYYCUBJHLNJFH-JXFKEZNVSA-N 485.877 0.051 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1839478016 XMJCMJLFAQQAMR-NQIIRXRSSA-N 463.922 0.245 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ccsc3[nH]1)CCO2 1839520849 TXEYQHCVGQYCAK-JOCHJYFZSA-N 469.328 0.293 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3ccc(C)cc3)CCO2)C1 1840098009 BAOCXSHLKMTWQX-RPUKTSEFSA-N 495.536 0.768 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840106526 PGIWLUKZZHUNOA-KXBFYZLASA-N 460.369 0.629 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3OCCO4)C2)C1 1840152812 UPFZETWXQFLVRL-KKSFZXQISA-N 454.907 0.782 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C2)C1 1840156161 JKYOAOAERPLLAP-JPYJTQIMSA-N 491.928 0.440 50 20 JCGD CCC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)n1cccc1 1840183868 FQBQUWDGIFPBPA-AUSIDOKSSA-N 463.579 0.659 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185886 VBXUZIGSBFEHMO-OAQYLSRUSA-N 483.953 0.187 50 20 JCGD O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2 1840364906 SRWJNXAWCZGZRD-HNJNHCNJSA-N 459.316 0.662 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CC1Cc3ccccc3C1)CCO2 1840932457 CKMZEDUTUUTJPV-RUZDIDTESA-N 472.586 0.621 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2n[nH]c3c2CCc2ncccc2-3)C1 1844662897 AYBSDSGNVXFIDE-UHFFFAOYSA-N 457.299 0.381 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)N(Cc3cccs3)C1)C2 1846384142 JSROMUKDZAIOHP-MRXNPFEDSA-N 461.588 0.673 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847565415 PMHXOLPDSWIURT-QPSCCSFWSA-N 461.943 0.634 50 20 JCGD CSc1nc2nc(C)c(CC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c(C)n2n1 15721172 JYKWLCCTWMZNHQ-UHFFFAOYSA-N 452.500 0.714 50 20 JCGD Cc1oc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1S(=O)(=O)N1CCCC1 107910364 WWQYLTOTLSBIRX-UHFFFAOYSA-N 484.556 0.698 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CN3C(=O)CN(C)C3=O)c2)c(C)c1 725898536 JJEFLJWCFKNDAZ-UHFFFAOYSA-N 473.511 0.759 50 20 JCGD CC(C)OCCCn1c(NNC(=O)CN(C)[C@H]2CCS(=O)(=O)C2)nc2ccccc2c1=O 729279458 GBUHMGQHDYETFN-INIZCTEOSA-N 465.576 0.774 50 20 JCGD CC(=NNC(=O)Cc1cc(O)nc(S)n1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 729816203 HLSTUMPBBOUJRK-UHFFFAOYSA-N 473.558 0.279 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)Cc1ccccc1F 731344640 XUSKWYORQKNDTQ-KWRJMZDGSA-N 497.570 0.909 50 20 JCGD CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)C(=O)N2CCCC2)c1 748247839 YMUYWUONVUUQER-UHFFFAOYSA-N 475.365 0.767 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC(=O)Nc3ccc(F)c(F)c3)nc2)CC1 915894379 LPGROWUWRGCVEL-UHFFFAOYSA-N 483.501 0.561 50 20 JCGD C[C@H]1CN(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C[C@@H](C)O1 916250199 WNQCRBVCOFUKTK-CALCHBBNSA-N 467.592 0.914 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N(C)C)cc2)cc1 916646934 WQJWBJMDQJGERE-UHFFFAOYSA-N 497.599 0.396 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CCc1cnn(C)c1)N(S(C)(=O)=O)CC2 917521921 AIMZLIZDUILXTH-QGZVFWFLSA-N 479.559 0.466 50 20 JCGD Cc1cc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C(=O)O 917717682 JOYZEVTUTSONMM-UHFFFAOYSA-N 497.551 0.646 50 20 JCGD CNC(=O)COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1OC 919678229 XHHYYBBLCQWUGI-UHFFFAOYSA-N 490.538 0.679 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1778784901 AFIDGBYZHRHVLY-DYESRHJHSA-N 494.457 0.028 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnc3c(O)cccc13)CCO2 1779036635 CBQYRODHEGGWOI-DEOSSOPVSA-N 476.493 0.696 50 20 JCGD C[C@H]1CCc2c(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)c4cnccc4C(=O)NN)C3)n[nH]c21 1779372641 QVAYQTDXBPRKRU-NDGOPHNLSA-N 481.557 0.899 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1 1779663887 QUUJMVCVBZYRGL-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD O=C(O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)ncn1 1780770894 IJHIYUANYOMNNC-PBFPGSCMSA-N 459.272 0.993 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968060 AAHOJPGKBVAPCA-CYFREDJKSA-N 471.558 0.201 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccccn1)CCO2)NC(=O)NCc1ccccc1 1780970275 TYLZFOYTCOQAQG-DEOSSOPVSA-N 466.542 0.871 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1 1781332146 UMDTUJMASQPYET-KBXCAEBGSA-N 459.316 0.807 50 20 JCGD CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(N)=O)C1)NC(=O)NCc1ccccc1 1781771134 ZTVGPWJIYJIYKR-NTKDMRAZSA-N 488.589 0.112 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(OC)c1 1782992864 VSYKZTVXXFRQOM-RUZDIDTESA-N 497.552 0.779 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2 1783348339 YWWJIAOBQPSMNJ-NJSLBKSFSA-N 478.384 0.875 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)CCO2 1783527538 CVDFMPJGEFOWOK-JCGVRSQUSA-N 464.357 0.485 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)CCO2 1783876855 XTWDXBKBYQNJJY-OSAWLIQMSA-N 475.970 0.440 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1784081791 QJRGVMRVHMOUFM-QHCPKHFHSA-N 456.279 0.200 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C[C@@H]21)[C@@H](O)CCl 1784093699 DRXOBMLETVRFDN-XATXGBNCSA-N 464.872 0.723 50 20 JCGD COc1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784264592 FKTOLBCDJOQLMC-RRPUWOKSSA-N 466.343 0.601 50 20 JCGD CN(CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)C(=O)OC(C)(C)C 1785586229 PTLFERGIJKGPMM-XMMPIXPASA-N 489.378 0.457 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1nccn(Cc2ccc(F)cc2)c1=O 1785685496 PERIQJRMTYSVCW-KANFNMMFSA-N 492.935 0.624 50 20 JCGD COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)n1 1785809688 GJPHSVZLEJNNIO-TVHLAIKQSA-N 468.514 0.818 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@H]43)C[C@@H]21)c1ccc(B(O)O)cc1 1786979591 BATABQNJQZMFFV-YIDIZNGVSA-N 478.379 0.848 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1n[nH]c2c1CS(=O)(=O)C2 1787151623 PZDCTKKDBUGXLB-MJVIPROJSA-N 475.365 0.216 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787507244 MEAZYWAVTHBJDB-HMEDOYGISA-N 474.547 0.307 50 20 JCGD CN1CCc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)ccc21 1787998469 SOKFJARPTNXCHX-RRPUWOKSSA-N 463.343 0.266 50 20 JCGD Cn1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)ccc1C(F)(F)F 1788610090 CRNLAECNNBMPJX-NUTKFTJISA-N 494.474 0.950 50 20 JCGD CC(C)(C)OC(=O)CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793022808 YBFJYYJCVZCTRU-UPHUGPLXSA-N 460.336 0.082 50 20 JCGD Cc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n1 1793114022 AGLFGXHQSKENMR-GQEURGSBSA-N 494.596 0.868 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1797155036 PLPSGEAANVWSIU-AICCOOGYSA-N 481.924 0.820 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCNC2=O 1797325285 PCMDUCHYFBLGRK-MCYUEQNJSA-N 454.325 0.003 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748574 JRTSCGRFOCVYRN-ZXFNITATSA-N 490.561 0.049 50 20 JCGD CC(C)c1nn2ccccc2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797750435 CKTHJIZZUKWWBE-MFKICJERSA-N 491.552 0.973 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)c2C1 1797956034 SVULDTBYCBSUQM-FQLMCAECSA-N 482.969 0.880 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])[nH]1 1798746503 JOYNGLYYELRBEY-CNKKGNCFSA-N 457.447 0.260 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)c1ccccc1)C2)NC(=O)NCc1ccccc1 1799094765 JMVCYCJLPWGRAC-DVKRWUGUSA-N 495.580 0.656 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@@H]2CCC(=O)N2C1 1799146095 LOGRRHLQTOSFOY-NEWFRUHNSA-N 484.557 0.111 50 20 JCGD CC(=O)NCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799869732 ZLBJQTHJBUKZGI-ACDBMABISA-N 458.563 0.497 50 20 JCGD NC(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800436975 PCKAJSWNHCHPSQ-JYYAWHABSA-N 453.337 0.251 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(N)=O 1802164224 ILGKHIRNXJRRBW-INHOUBOVSA-N 476.331 0.614 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1802246495 ZEQALZZDSVZQSZ-CRCOGDFISA-N 455.515 0.692 50 20 JCGD COc1ccc([C@H](O)C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1 1802799950 ZHJCFWCGCBWJNE-OYDLWJJNSA-N 489.337 0.823 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2 1804222430 SJJGZGVYLBRZCR-WOZUAGRISA-N 475.565 0.884 50 20 JCGD Cc1nc(O)c(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1C 1804878190 JBONHNWOBYUBHL-WIYYLYMNSA-N 475.314 0.507 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n[nH]1 1805261714 NIPQHVQINOIKQU-KKSFZXQISA-N 455.519 0.700 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCN2CCCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362920 KRHISKFDJKRILB-QPPBQGQZSA-N 464.375 0.957 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365722 MAOQTHOGQGOOJC-PGRDOPGGSA-N 470.298 0.666 50 20 JCGD CCc1[nH]nc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1F 1807369489 LOXSIHADICDYTH-KKSFZXQISA-N 465.294 0.819 50 20 JCGD Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)s1 1807539744 ZDHAJISXLKVCPJ-KKSFZXQISA-N 459.576 0.863 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ncn(C)n2)[C@@H]1c1cccnc1 1808414864 NDDQEFQIXBISST-AENKRZKSSA-N 463.502 0.664 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cn2cccnc2n1 1809776554 FVKHWWGBGPXGBV-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)n1 1809972597 SFIZSDIZSQKSAJ-UHFFFAOYSA-N 482.302 0.837 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)Cn3ccccc3=O)C2)CC1 1810029813 XRPYGOOLGIQNNE-UHFFFAOYSA-N 452.515 0.392 50 20 JCGD COc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1 1810303785 YHDRBBQGDIWMOE-YWZLYKJASA-N 476.497 0.512 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NC(=O)c2cnccn2)[C@H]1c1cccnc1 1810441682 SFQYKYMDQBZDPN-LKCYJCQHSA-N 474.949 0.950 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812714031 YXUIKCZXOBDSOE-SZVBFZGTSA-N 471.396 0.405 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)s1 1813071074 MIUCDRZTXWFDCH-IIBYNOLFSA-N 459.576 0.863 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H](C)n2cnnn2)[C@H]1c1cccnc1 1813468704 JFGABGIMCDCFQZ-IGAHHFSDSA-N 478.517 0.469 50 20 JCGD N[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)c1ccccn1 1815354437 BJFMNIHZBZZDJU-KBXCAEBGSA-N 451.317 0.144 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2 1817271281 XLGMEBFEASEZOZ-CMPLNLGQSA-N 450.970 0.080 50 20 JCGD COc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1 1817471398 YJQHYNPWBLHLQT-KRWDZBQOSA-N 450.264 0.508 50 20 JCGD CN1CCCn2nc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)c4ccc(B(O)O)cc4)n[nH]3)cc2C1 1817474258 CATRWXWCSWSNGE-NRFANRHFSA-N 491.361 0.741 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1819829015 UXVBTPMQYLTGCM-IUODEOHRSA-N 466.332 0.339 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3ccc(Cl)nn3)sc2C1)c1cccc(B(O)O)c1 1820354041 DUCLXZFTGJCHDG-LBPRGKRZSA-N 457.708 0.806 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc(-n2cccn2)nc1 1820735204 NYOBSWKFYGVCAN-QGZVFWFLSA-N 488.338 0.943 50 20 JCGD COCc1c[nH]c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1 1821284747 PNGKXRBAADYTLK-OAHLLOKOSA-N 454.317 0.837 50 20 JCGD Cc1cnn([C@@H](C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1 1826746354 YNJKLWVMZZAVHM-BBRMVZONSA-N 453.333 0.815 50 20 JCGD COC(OC)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548279 HOLALTOLSITTMO-HTAPYJJXSA-N 483.949 0.657 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1c(Cl)cncc1Cl)CCO2 1829599453 URPHZDANIOCISG-OAQYLSRUSA-N 494.140 0.452 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830363713 KOGGCOURPCIUJX-AOMKIAJQSA-N 492.013 0.984 50 20 JCGD Cc1csc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1832981983 MCGOKEORALJYBJ-QHCPKHFHSA-N 487.582 0.758 50 20 JCGD CCOc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833019313 JQYGLIIUZZVXKF-UHFFFAOYSA-N 480.374 0.659 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)ccnc1Cl)CCO2 1833252082 OOOIUWSPROKRJC-OAQYLSRUSA-N 492.895 0.256 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1833272059 SRIOLOLJYZWDOQ-IRXDYDNUSA-N 477.002 0.043 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1833924371 YGGPKNZCCDMVIK-UHFFFAOYSA-N 493.373 0.219 50 20 JCGD Cc1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1834061204 YVADQBSJQBHYEI-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cocn3)CCO2)C1 1834503762 BEUDAODHBXHIND-VBKZILBWSA-N 472.926 0.877 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](N)c3ccccn3)CC2)CC1 1835118312 NMIYGHSPAHNPTO-MMQHPSSSSA-N 494.600 0.787 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCC=CO3)CC2)CC1 1835721613 WWEPOQWFDFTOHA-HXUWFJFHSA-N 456.547 0.563 50 20 JCGD C[C@@H](Sc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927154 JDIYZHVKIXXPEP-KOSHJBKYSA-N 484.383 0.617 50 20 JCGD O=C(c1cc(F)c(F)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933924 IWVBKEQDEAWXIA-QFIPXVFZSA-N 494.687 0.682 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836121418 FYUSLSYGEJARLF-KUHUBIRLSA-N 472.336 0.497 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCN3CCOCC3)CC2)CC1)[C@@H](F)Br 1836412623 OLTKPMQUFLKPOX-GOSISDBHSA-N 463.392 0.971 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1 1836413765 OTWQUTLICAVXAO-WFASDCNBSA-N 470.405 0.929 50 20 JCGD CCOc1cnc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1837274394 QFBFSRULFNZTPZ-UHFFFAOYSA-N 482.346 0.481 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1837835440 INJVVGQFHSELKF-OAHLLOKOSA-N 484.328 0.883 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1 1837903310 NZUUTJGUEGMTHF-UHFFFAOYSA-N 457.491 0.040 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)nn3)CCO2)C1 1838352813 STLFLQNBZGBWMA-SCLBCKFNSA-N 457.325 0.729 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200348 GHGVGEPTETXKLG-JMDDRLEFSA-N 488.314 0.267 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C#N)cc1Cl)CCO2 1839424874 GVJJYJHBYKIQFX-JOCHJYFZSA-N 477.949 0.655 50 20 JCGD CCCCC[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839903993 OTSCRMRGBCOBIJ-UZUQRXQVSA-N 461.563 0.972 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](C)Br)CCO3)C2)cc1 1840030250 GUMFCGNXLQTQKJ-GZRFBZBPSA-N 471.348 0.968 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1840034477 NENBBFBPGSDQIG-ZFCANOHDSA-N 472.380 0.627 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2 1840113561 HOUPXCHSZCFSAQ-RUZDIDTESA-N 478.354 0.558 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3OCC3CC3)C2)C1 1840183700 UYNLCGCJVLYUMD-DEOSSOPVSA-N 489.573 0.313 50 20 JCGD CN1CC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)C1 1840569082 FZEPLSSDGONSHJ-HRAATJIYSA-N 474.986 0.137 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840945567 VATCIUKIIWJPMV-LIRRHRJNSA-N 479.933 0.002 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1sc3nccnc3c1N)C2 1844263888 GRXIEEINLPPFBC-UHFFFAOYSA-N 452.500 0.403 50 20 JCGD CN1CCC[C@H](C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)C1 1845055360 BYJBYDWLTUTNRB-FQEVSTJZSA-N 456.591 0.878 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O)C2 1846383503 HCAMNFCQSNRJCK-DLBZAZTESA-N 481.594 0.181 50 20 JCGD O=C(CCc1nc2ccccc2[nH]1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 28028094 XSULJPDTTKBHGU-UHFFFAOYSA-N 457.512 0.978 50 20 JCGD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 728377221 DVPFMAUUGYSTTM-TZMCWYRMSA-N 458.518 0.028 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)COc1ccc(OCc2ccccc2)cc1 728456143 DQESLAOSMLRWRO-NRFANRHFSA-N 468.510 0.919 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)c2cccc(C#N)c2)c1 728827100 HUXCQCBUOQPLNS-UHFFFAOYSA-N 457.512 0.720 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1sccc1S(=O)(=O)NCc1cccs1 750716441 QBKOWWFBUSNDAF-SNVBAGLBSA-N 463.584 0.484 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NN=C(C)c1cc(C(N)=O)n(C)c1)N(S(C)(=O)=O)CC2 767167086 WIVBOAIABBARKG-KRWDZBQOSA-N 491.570 0.931 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCn1nc(C)cc1C)c(=O)n2Cc1ccccc1 836708253 MBCYCAQNFMTAPP-UHFFFAOYSA-N 492.540 0.479 50 20 JCGD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 915872275 AUIAXNPHPICTPZ-SFHVURJKSA-N 486.616 0.826 50 20 JCGD COc1cccc(C[C@@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n2nnnc2C)c1 916124765 IBSQZVFLWKKPSX-SFHVURJKSA-N 462.470 0.482 50 20 JCGD Cc1oc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1S(=O)(=O)N1CCCC1 916134222 HLGDZJZGZKIWHD-UHFFFAOYSA-N 469.545 0.740 50 20 JCGD CC(C)[C@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCN(C)CC1 916257909 FZBCLKGTPPRRSU-FQEVSTJZSA-N 480.635 0.687 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C\C(=O)NC1CC1)C2 1778090833 BDUJBLXGMYQBIP-HTPNWQBFSA-N 484.557 0.469 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1778788503 GORJDOFUBVGAMK-RTBCXJIMSA-N 478.452 0.766 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1 1779029174 UHMZFXHEUPZUIT-HSZRJFAPSA-N 484.582 0.248 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030363 OYFQCLRTGZLPPG-ZUOKHONESA-N 459.532 0.086 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2 1779543619 MFGSSKQEHGUESN-FOIQADDNSA-N 462.583 0.397 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nc1Br 1779922524 NRQBGMOCQKLVLL-SJKOYZFVSA-N 462.728 0.896 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)C1 1780609678 BUSFWIUXQSMUTP-NRAIQUKZSA-N 477.606 0.274 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCOCC1)C2)[C@@H](F)Br 1780771060 AYTVLMXVFDMJAT-QGPMSJSTSA-N 450.349 0.913 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)CCO2)C1 1781224013 RVVOIVRWEZUJKN-CKNLXJGOSA-N 460.959 0.602 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ccc(F)cn3n2)C1 1781432874 XXVCRTSSWFVXEI-UZUQRXQVSA-N 496.503 0.308 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1781561542 LWPDZZPXUICUJB-DDUZABMNSA-N 489.298 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C2)C1 1785716787 WNEMXXBVXZBIMZ-OAQYLSRUSA-N 467.567 0.247 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3noc4ccccc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786979988 XALPUYIFSBKJGX-BPXKWBHBSA-N 463.299 0.344 50 20 JCGD COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1C 1786986466 DDSLCFAHXRKKIK-RRPUWOKSSA-N 466.343 0.519 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)N3CCN(C)CC3)C[C@@H]21 1790962877 FIOCQGCWSDMKII-FPSMNIFISA-N 459.429 0.776 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)C[C@@H]21 1791055363 UQILCODEUDUULG-PQENSZJKSA-N 496.402 0.929 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(F)cccc4n3)C[C@@H]21 1791293927 PCHQXKXEAOTSAN-ZOBUZTSGSA-N 460.510 0.440 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(-c3ccccc3)c3c1COC3)C2)[C@H](O)CCl 1792977135 RHYWMNPYFQHRCY-GTYSZEQSSA-N 460.918 0.705 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793116281 JQXBNUUEZKRXRL-VLMUSUEPSA-N 459.971 0.985 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1CCCN(Cc2ccccc2)C1 1793756527 SDBCYWWYJVELCD-UCKMRUJXSA-N 491.397 0.482 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1793865379 ZFHDERGKGDWSBW-RDGPPVDQSA-N 457.336 0.628 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccco3)no1)C2)c1ccc(B(O)O)cc1 1795734826 VRZFLTQDURALOG-YVWYUNDQSA-N 451.244 0.131 50 20 JCGD Cc1ccc(OCCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795737768 QXNFBCPQKJSNJO-BBIADKPPSA-N 452.316 0.347 50 20 JCGD CCOC(=O)c1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)ccn1 1796191989 XXLVRISIIOQOQO-REPLKXPHSA-N 451.288 0.504 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]cc3c1CCC3)C2 1796441688 QEPSJZSNYPHGOD-GRTWCBPGSA-N 452.515 0.841 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2snnc2c1 1798504627 YTBNEMNSLJDDRU-WKOABOCDSA-N 482.526 0.424 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1C[C@H](F)CN1C(=O)OCc1ccccc1 1799385618 OMLORWRGWCMNID-APNJTCTJSA-N 497.951 0.925 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)C(C)C 1799385749 TVGLSTZKZSTLPR-FHULIHMCSA-N 490.960 0.482 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br 1800762492 SVPBEZZTSATUSN-YMSVYLFOSA-N 453.337 0.573 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](N)c1cccc(Cl)c1)C2 1801013308 MQGUNRSZNAQGQK-HRYATBACSA-N 451.955 0.302 50 20 JCGD CC(C)Oc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1C#N 1801848928 NSPASKSHGKOWCE-JHDGKUDLSA-N 477.326 0.542 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C3)C2 1802154357 GHAAEWVFLICSIJ-FUZWODELSA-N 471.982 0.964 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802332395 BFCGQKBRBLIDOT-YYIAUSFCSA-N 469.583 0.537 50 20 JCGD CCOC(=O)/C=C/C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1806293211 MJBPBMTZDBBLOS-LNRPMLKFSA-N 451.288 0.200 50 20 JCGD CC(C)(NCCC#N)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807144773 ANVCPFNUYJCZTN-TZIWHRDSSA-N 463.347 0.363 50 20 JCGD Nc1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cs1 1807233777 ZNOGFINJNLBVOI-MAUKXSAKSA-N 451.317 0.434 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1 1807361090 OSDMINPRUQTFAE-WIYYLYMNSA-N 476.346 0.741 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807367616 TYEPNAYIASMJPE-UGKGYDQZSA-N 465.315 0.590 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807376150 WQOVGLCEHFJWTB-SIKLNZKXSA-N 496.373 0.996 50 20 JCGD CN1CC(C(=O)N2CC[C@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2c2cccnc2)C1 1807451863 GSVHZHRIPIRXCG-ZJSXRUAMSA-N 493.612 0.995 50 20 JCGD CCNC(=S)NCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808416606 OVFQXDXNRRURQK-RBESNOOPSA-N 498.613 0.705 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1808416649 PRNLFFGFWYVZTC-ZZXHSXFOSA-N 496.572 0.594 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809967078 RGYHBIHPZKPSRB-IBGZPJMESA-N 489.378 0.097 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@H]1c1cccnc1 1810294747 MZLOPGLAPCTBLL-SBUREZEXSA-N 499.535 0.845 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc(-n2cccn2)nc1 1810994348 LURPTWDHXOFSAI-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1cccc(B(O)O)c1 1815360131 NQSYPWCOKFOLCC-ZWNOBZJWSA-N 456.102 0.739 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361955 WFACXHLAUJIOPJ-CZUORRHYSA-N 453.333 0.582 50 20 JCGD CC(=O)c1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n[nH]1 1816293933 PMXZSSBDNJYAKJ-QGZVFWFLSA-N 465.474 0.954 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3c1CCC3)CC2 1819799488 DBDFQNQGSLMNHX-LLVKDONJSA-N 466.527 0.824 50 20 JCGD CCOC(=O)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CC1 1819800819 RRSOWNCPBHVFPG-LLVKDONJSA-N 472.527 0.711 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822413775 AXDNQNFEUCHQAZ-NFXIUMSZSA-N 485.549 0.909 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ccccn3n1)CC2 1826085309 LMQHFIYBUIUZKJ-GFCCVEGCSA-N 456.532 0.785 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CC1 1827544366 DOCHJDVPKISMCI-OALUTQOASA-N 497.637 0.865 50 20 JCGD Cc1cc2nnc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)c(C)n2n1 1828148516 KXPNZJBTDOFVEP-NRFANRHFSA-N 490.373 0.968 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccc(C#N)cc1)CCO2 1829635439 HWCHPYSTEHQKSQ-DEOSSOPVSA-N 471.558 0.320 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3cccn3C)C2)C1 1830545875 NUDIVZZXYHNGJK-AUUYWEPGSA-N 456.337 0.695 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1 1830546270 RCFAITMOKHQFRK-VLIAUNLRSA-N 468.348 0.887 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)C(C)(C)C 1830728390 SRFBEJHPUGXSQL-XCGNWRKASA-N 492.013 0.982 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831245873 PQXIOLJJRGIARZ-OZXSUGGESA-N 494.353 0.141 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1832296885 WXLBNWBHBVRXRG-HXUWFJFHSA-N 451.332 0.821 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)nc2N1 1833310850 VULHERFGFXVKGG-SFHVURJKSA-N 463.966 0.751 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3C(N)=O)CCO2)C1 1833316441 PIRNSMAJMLKISG-AUUYWEPGSA-N 469.336 0.424 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(O)c1 1834798279 BJIGUOTWSOXUQL-UHFFFAOYSA-N 481.358 0.580 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc(-n2c(O)nnc2O)cc1 1836131527 QOPCDISBKYCOBE-SFHVURJKSA-N 492.964 0.463 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cnnc(Cl)c3)CC2)CC1 1837223998 HXKAQPFASNUTEW-UHFFFAOYSA-N 472.738 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCc3ccncc3)C2)C1 1837456841 OGFPQIFANBUIPW-XMMPIXPASA-N 482.541 0.173 50 20 JCGD COc1ccccc1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461119 OKSDCMRXAHYACD-DEOSSOPVSA-N 483.525 0.006 50 20 JCGD CN(C)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1837919129 HTGVPCLFXMEXRO-UHFFFAOYSA-N 480.374 0.753 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)CC2)CC1 1837920072 IZUOPVUFKCDRLM-HBMCJLEFSA-N 456.373 0.854 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838110709 DQHLYZCNGVOCOI-BEFAXECRSA-N 462.330 0.803 50 20 JCGD Cn1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1Cl 1838310290 CCDUENHHRZWWTP-XHDPSFHLSA-N 453.696 0.834 50 20 JCGD C/C(=C/C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(=O)O 1838395463 UIMUOBVBNABPNA-OWBHPGMISA-N 459.503 0.328 50 20 JCGD COc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1OC 1838841030 FQRRXLJNGWAGGC-QAPCUYQASA-N 476.299 0.859 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839106115 BGDGZSJIUCURGK-YLJYHZDGSA-N 487.439 0.254 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839154392 MRIQSFXQIHFBDX-ZNOIYHFQSA-N 484.377 0.522 50 20 JCGD NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802008 JTMADZIFQIQWEJ-UTKZUKDTSA-N 482.375 0.715 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1 1840153241 IJWXQBGELIGJAX-AUSIDOKSSA-N 479.961 0.743 50 20 JCGD C[C@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)N1CCN(C)CC1 1841925177 UOEMFWZOBZDODY-SJORKVTESA-N 472.030 0.958 50 20 JCGD Cn1ncc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1C(F)(F)F 1842161766 BVFQXIYUNIYYNM-UHFFFAOYSA-N 451.409 0.568 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1842184874 LKSAPZVGVOPBPD-UHFFFAOYSA-N 451.288 0.457 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@H](N)c2ccccn2)C1)NC(=O)NCc1ccccc1 1842931119 STERQRUSHCWGHU-OAQYLSRUSA-N 465.558 0.631 50 20 JCGD CC(C)(C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ncc(Br)cn1 1843010537 ZLNPBQZZIOLOBV-UHFFFAOYSA-N 487.163 0.714 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c([N+](=O)[O-])cc1O 1843014563 ZNEQVSMGBISOID-UHFFFAOYSA-N 455.232 0.120 50 20 JCGD Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)cc1 9931191 XHFQPPHHBHEKQK-HNNXBMFYSA-N 451.526 0.992 50 20 JCGD CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 726278003 UKGXTKWJFWCSQB-LJQANCHMSA-N 494.618 0.358 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2C[C@@H](O)CN2C(=O)c2ccc(F)cc2)n1 728730626 SRRXPWOXJGYANP-HUUCEWRRSA-N 464.475 0.099 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1 732307504 HYLOQNVOEGKHQG-OAHLLOKOSA-N 486.616 0.513 50 20 JCGD C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C1=O 748569434 SSFNDXACXUHOGC-FQEVSTJZSA-N 475.505 0.738 50 20 JCGD COc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)cc1OC 767299594 FBCUXWINGPFSLK-UHFFFAOYSA-N 465.532 0.906 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 856531754 DVWSPPBXNXCOTN-KLDKWKSESA-N 451.527 0.153 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCc1cn2ccccc2n1 915907510 TXQJYNTZPJCAEQ-UHFFFAOYSA-N 486.554 0.818 50 20 JCGD O=C(NCCC(=O)N1CCOCC1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 916251520 YUNPHJXKICTWGO-UHFFFAOYSA-N 478.513 0.581 50 20 JCGD CC(=NNC(=O)Cc1csc(N2CCOCC2)n1)c1ccc(S(=O)(=O)NCC(=O)O)cc1 917566243 FTSPACVEDFYCDZ-UHFFFAOYSA-N 481.556 0.426 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O)c1ccc(-n2cnnn2)cc1 918552240 ZEMRSRSDQUUKSH-INIZCTEOSA-N 497.493 0.061 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(C)cc3)cc2S1(=O)=O 919542481 VDMIFXSCXHOWLS-UHFFFAOYSA-N 475.479 0.404 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919885829 RXINDEQKRYXGSV-LSDHHAIUSA-N 472.589 0.689 50 20 JCGD CCOc1ccc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)[C@H]3CCS(=O)(=O)C3)CC2)cc1 919987517 XYLGVKVXLDMUDX-UMEYKSNOSA-N 467.569 0.653 50 20 JCGD Cn1c(O)nc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)ccc21 920287019 COPXXNJVJMWIIG-UHFFFAOYSA-N 459.484 0.375 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cnccc4n3)C2)C1 1777733756 QQDBWZSEXOCWAK-HSZRJFAPSA-N 461.482 0.386 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nc3ccncc23)C1 1777908252 MVTOHZZZHXKSSY-VGOFRKELSA-N 457.535 0.458 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc4c(c3)CCCO4)C2)C1 1778269668 DUSGTQNIFWBJKL-XMMPIXPASA-N 458.559 0.757 50 20 JCGD COc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028730 KGFRWKGJNVFXRA-QHCPKHFHSA-N 469.498 0.216 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnnc3ccccc13)CCO2 1779030167 HKWAUZVRVQXFQN-QHCPKHFHSA-N 461.482 0.386 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1780286890 KVUHTEOJIXABMW-DEOSSOPVSA-N 460.299 0.514 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2ccoc2cn1 1781198662 OKNDWYCQSXYAPX-ZJSXRUAMSA-N 463.299 0.949 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ccncc13)C2 1782211985 MJDXXZWWHHCAMU-VGOFRKELSA-N 457.535 0.458 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1782900106 WNSMBKGRMJFZSB-HSZRJFAPSA-N 472.734 0.715 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1)CCO2 1783871240 OEOJWZNCGZPASM-IIBYNOLFSA-N 489.997 0.832 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783937065 FGBSHONAISNMQH-JOCHJYFZSA-N 450.511 0.580 50 20 JCGD COc1cc(Cl)cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1785137935 VNRYHOLAKKSTQS-QFIPXVFZSA-N 458.707 0.786 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3OCC3CC3)[C@H]2C1 1785735889 OFKVQFVWZBUTQG-IHPCNDPISA-N 473.574 0.837 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CNc4ccccc43)[C@H]2C1 1786877877 LHYADRMKFGKCIU-VJARNRFFSA-N 464.526 0.488 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3F)C[C@@H]21)c1ccc(B(O)O)cc1 1786982115 NDFDIOGGMHVVBZ-ZRCAFCQKSA-N 458.270 0.481 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cc(O)ccc4n3)C[C@@H]21)c1cccc(B(O)O)c1 1786982786 BFPVBUFFCOVJSI-NYDSKATKSA-N 475.310 0.527 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C)COC3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724830 PEKODPRQDAKOKR-UFYCRDLUSA-N 473.574 0.349 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790381410 WUSVLASWHCIUQN-VDGAXYAQSA-N 480.305 0.369 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1F 1791286832 MEFLHHBDWAMRQV-BXWFABGCSA-N 450.511 0.801 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cccc(Cl)c1 1792749396 QHVIEKVQZUJEBP-USGNIVHTSA-N 452.939 0.681 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCOC1=O)NC(=O)NCc1ccccc1 1793351166 RLHGPUQOUFJHGI-REPLKXPHSA-N 472.546 0.423 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc(O)nc(O)c2C1 1794111372 MQHJVEIVANLTAW-VNUHZKFNSA-N 469.336 0.366 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H]1NC(=O)NC1=O)C2 1794141011 CRXFNBDQUREOSM-NDKCEZKHSA-N 471.942 0.355 50 20 JCGD CC(C)(C)n1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1Cl 1795737291 PNLPYAIMZINPMD-JLVBRIDZSA-N 474.754 0.488 50 20 JCGD N#Cc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1Cl 1795740384 ZXQUCEPDCWMCOW-CWPLJXCYSA-N 453.691 0.408 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796190655 VLKVHCFHCUHEDJ-FCGDIQPGSA-N 459.352 0.922 50 20 JCGD O=C(CCN1Cc2ccccc2C1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796191478 PVPHFYVXLGYOEU-WKCHPHFGSA-N 461.327 0.664 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)nc1)C2 1796441523 MUAZRHWHYBOWHZ-MXXHGQMLSA-N 490.524 0.605 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(=O)OCCO)C2 1797957302 FQXSXKRJRFXGSD-CWPLJXCYSA-N 464.591 0.890 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC(=O)NC1)C2 1798521404 GPVROTYLZYACOX-CJXDPKRBSA-N 474.470 0.250 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(C)=O)c1ccc(F)cc1 1799051698 AFTXEEGJVPBKOE-CGHHPOIWSA-N 455.914 0.846 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1c(F)ccc(Cl)c1F 1801824523 LMAQFDKHTXPUBX-DBWKPXFBSA-N 464.661 0.815 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1 1804580489 JRFXSPKFZGSZPB-CVDCTZTESA-N 455.563 0.974 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n[nH]1 1805253816 CLXBMEGCJPKJGK-UWJYYQICSA-N 461.287 0.321 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366868 HUOXGCTWUXURMD-PIPMEXSNSA-N 461.331 0.614 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CNC(=O)c2ccco2)[C@@H]1c1cccnc1 1807597640 VFTJCEHDZHFXOV-VGSWGCGISA-N 470.530 0.483 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2c(n1)OCCO2 1808189118 VOCPVVCLGFHMRM-PGRDOPGGSA-N 488.309 0.561 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)C1 1809980527 UYWYTFYYVZXGNA-GOSISDBHSA-N 450.348 0.739 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1 1810187151 HBUVNUDHZBFMIB-KSSFIOAISA-N 473.452 0.566 50 20 JCGD Cc1noc(N)c1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810301817 CPBOEHPPBHXKRG-KSSFIOAISA-N 464.486 0.592 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)no2)[C@@H]1c1cccnc1 1810303538 UVPCBZONGNSBOO-FZKQIMNGSA-N 451.443 0.407 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1 1813072197 BJPNAFRNDGATDQ-HTAPYJJXSA-N 464.530 0.817 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)[C@@H]1c1cccnc1 1813338072 ONLIXDDRAGFWEH-FFGOWVMKSA-N 476.965 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)cco2)n[nH]1 1816649692 GDIABNRKGRWVHJ-MRXNPFEDSA-N 451.443 0.981 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2 1816976268 MDAVZMRSWJHGLN-ADEWGFFLSA-N 462.956 0.540 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCNC(=O)C3)sc2C1 1826218652 DAYHIRLDUUGXMG-RQPXNKNVSA-N 471.543 0.715 50 20 JCGD O=C(CCBr)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1827396355 DZYRDIVYDRLDNR-AWEZNQCLSA-N 466.340 0.831 50 20 JCGD O=C(COCCO)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1829227638 JWSKRGFJJGTLEN-GHTZIAJQSA-N 471.913 0.982 50 20 JCGD C[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830728613 WFPYGVYDLQZXAI-SXGZJXTBSA-N 463.959 0.346 50 20 JCGD COc1ccc(COCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1830738007 KZIQCMQTMSRJQV-WIYYLYMNSA-N 456.923 0.268 50 20 JCGD CCNC(=S)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1831093807 PJYOVDJGALGENR-KRWDZBQOSA-N 454.641 0.463 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1831202152 NSRVTOAEAKFRMI-RBUKOAKNSA-N 452.379 0.986 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1 1833033217 SWZAVLZIDIOUHU-LIRRHRJNSA-N 459.952 0.188 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835117629 GJOIFCLKOQMTMI-AKBIMGJMSA-N 487.605 0.559 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)C2)C1 1835934032 KQMPTPPYVATWJN-SGIRGMQISA-N 482.317 0.379 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934152 NDKWXSTXWKTZDH-SBUREZEXSA-N 485.371 0.012 50 20 JCGD CSc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836035252 XZHLMQYNXJYYOE-UHFFFAOYSA-N 482.415 0.982 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836718352 VVQITYHTEGLWQA-QGZVFWFLSA-N 466.000 0.010 50 20 JCGD O=C(c1cc(C(F)(F)F)ccn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838081384 FYQRPUDQLPYXFY-YOEHRIQHSA-N 451.829 0.770 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839044920 FUHONGDFTJFVOX-OXQOHEQNSA-N 471.341 0.815 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)nn3-c3cccc(=O)n3C)C2)C1 1839143714 GHJKZPOPZNOBES-GAJHUEQPSA-N 491.976 0.967 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1839148123 NESYGEBJQJLXCQ-QYWGDWMGSA-N 452.939 0.674 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1839151924 IIGFAIBCQKFXID-DBVUQKKJSA-N 459.374 0.644 50 20 JCGD COc1cc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(F)c1 1839332901 CKEOWYDSDQWJLY-HSZRJFAPSA-N 490.268 0.037 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ccsc4[nH]3)CCO2)C1 1839521113 JMVCNBHMNQUFJA-JOCHJYFZSA-N 484.538 0.612 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1839879398 ONSNLRUWIUDIBN-RCDICMHDSA-N 492.485 0.115 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccnn3)C2)C1 1839967565 QJBPUSOMNJBFAL-KSSFIOAISA-N 457.325 0.485 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840897749 UUZAFRFZCGPTNS-YWFTZVROSA-N 453.879 0.664 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)C1 1841249268 NPLZDWMCJLRCOL-UHFFFAOYSA-N 471.558 0.344 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C1)C(=O)NC[C@H]2C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841354750 UFDODZNVVULSPY-KIMHZCHSSA-N 484.981 0.163 50 20 JCGD CCN(CC)S(=O)(=O)N1CCN(CC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1 11673461 KMAMHRNNJVPJRH-UHFFFAOYSA-N 461.972 0.314 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CNC2=NS(=O)(=O)c3ccccc32)c2ccccc2c1=O 17161813 SPQJLJOZLJAROT-UHFFFAOYSA-N 468.495 0.306 50 20 JCGD CCS(=O)(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)CC1 19427298 HUFZVTQTSZDWFJ-UHFFFAOYSA-N 461.924 0.715 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1 726710534 FGVVKKSMYDXWEX-UHFFFAOYSA-N 492.554 0.925 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 789076673 GFAVKWCVRFLRJC-IBGZPJMESA-N 491.522 0.861 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)c1 903901806 QOFFJAXXBVABQO-UHFFFAOYSA-N 454.486 0.005 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 913155953 KCIVEGCLDAHGMV-GOSISDBHSA-N 489.583 0.832 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cccc(C(N)=O)c1)N(S(C)(=O)=O)CC2 913476749 URWHTOFTSKXYEV-KRWDZBQOSA-N 490.538 0.513 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(-n2cncn2)cc1 915923715 WQLZNOQNIFWBIW-MRXNPFEDSA-N 499.553 0.993 50 20 JCGD COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1 917718206 ZHOBXVGOJULYAI-UHFFFAOYSA-N 467.500 0.980 50 20 JCGD Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 919886492 UIEFBYDJHRNXNQ-OAHLLOKOSA-N 466.541 0.927 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(Br)c1 919961133 UGVSANOKUYCSMA-JTQLQIEISA-N 484.350 0.305 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)nc2N1 1777816094 KLYBGIJJGZPIKA-GCKMJXCFSA-N 450.923 0.694 50 20 JCGD C[Si](C)(C)c1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)co1 1778994077 HIUSJCZVBWQYCH-QFIPXVFZSA-N 456.380 0.262 50 20 JCGD Cc1cccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1779028959 PXSXSAGIXYGAHL-QHCPKHFHSA-N 452.515 0.465 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)CS[C@@H]3CCCCO3)C2)C1 1779084717 RYSYJTSMVJJLSM-WIYYLYMNSA-N 463.560 0.388 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2)N1C[C@H]2C[C@H]2C1 1779251849 RYEIAZIQEOCVKF-DYDIVKPRSA-N 470.574 0.153 50 20 JCGD Cc1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn2[nH]cnc(=O)c12 1780021725 NDEWHPGMJYPHKZ-SGTLLEGYSA-N 452.309 0.558 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3csc4c3c(=O)n(C)c(=O)n4C)C2)C1 1780924409 KYDJRDWVEHJPED-SZNDQCEHSA-N 482.990 0.689 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2 1782209425 ONDRLMPETXSUHX-SJKOYZFVSA-N 484.447 0.229 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCCn2ccnc2)C1 1782485098 BKEKADJGPWYHID-AUSIDOKSSA-N 469.546 0.490 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC[C@@]3(C1)CN(C(=O)[C@H](Cl)COC)CCO3)C2 1782856361 RMDGEDDVYIKCPU-WJONJSRFSA-N 482.965 0.706 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784094776 RMORPLJPIUFDAR-GAMODTGLSA-N 471.982 0.965 50 20 JCGD CN1Cc2ccccc2C[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785022539 FCSKGMBIPDLKKF-XGAJZPNHSA-N 477.370 0.016 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1785108314 COLGTRKVTRJIBW-HSZRJFAPSA-N 451.288 0.082 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785347118 ZGOLUQLPNXSFDK-JPYJTQIMSA-N 475.351 0.113 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1nc(-c2ccccc2)ns1 1787144372 ZNBGDRFLJDZGCT-IHPCNDPISA-N 492.366 0.792 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c[nH]nc34)[C@H]2C1 1787322245 QNJGOMVUOBVTKX-JVPBZIDWSA-N 463.498 0.469 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)ccc1C 1788610221 QWGZUUZLBRAXNC-LRQRDZAKSA-N 467.526 0.909 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccnc3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724630 DSAVFXKSHAJMSS-ACRUOGEOSA-N 483.573 0.209 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)c(C#N)c3)[C@H]2C1 1789907896 ZGCXJDWEOAOSET-QRFRQXIXSA-N 459.522 0.593 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)C1 1791240963 HUTDXGGVTXPZDT-ZGMAETJZSA-N 487.557 0.258 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)C(C)(C)CCl)csc2n(C)c1=O 1792784356 FPGUADBSZYHURQ-XOIINTDNSA-N 497.017 0.696 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C(=O)NCc1ccccc1 1793074667 TWPHIOJCDFEIFU-SDRBGGSMSA-N 455.559 0.870 50 20 JCGD Cn1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc2c[nH]c3nccc-3c21 1795740289 OIJRGJAKXMPNHX-UPHUGPLXSA-N 487.325 0.203 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nc(Br)nn2c1 1795928323 LTFVTUAZHPKCNB-XFMPKHEZSA-N 486.754 0.949 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncc(S(C)(=O)=O)c1)C2 1796889980 RENXYJWUCQESGZ-FWKYCFCSSA-N 486.554 0.871 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)c1n[nH]cc1I 1798115527 IZKXNIFULGIWJP-NJANEAIBSA-N 456.643 0.752 50 20 JCGD C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1803009685 BVXITBDGGKOBGJ-MRRJBJDNSA-N 466.336 0.670 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1803162138 ZUMUAVSJRXDINQ-FCEUIQTBSA-N 450.348 0.565 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1 1804817930 YVUPBHVUCOJWBW-IERDGZPVSA-N 467.530 0.268 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H](O)CN2)[C@H]1c1cccnc1 1807704817 KYCSEZRKOHQRSF-DCZASFAJSA-N 497.508 0.958 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1 1807937856 UANDTZVHMMRIPD-DYESRHJHSA-N 464.530 0.817 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1[nH]nc2ccncc12 1808099827 OLYLCGYHSTTZQG-HTAPYJJXSA-N 470.298 0.666 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC2)C1 1809974999 MTIJEEPFCRRAIR-UHFFFAOYSA-N 474.216 0.566 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1 1810303572 VTGZGSRWGJHCIC-WZONZLPQSA-N 499.535 0.685 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1 1810303823 YSFHXLAPJPHIJO-GUYCJALGSA-N 494.430 0.505 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc(Cl)nn1 1810681864 WVWLIBKEHTZVRL-OXJNMPFZSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnn2c1CCC2 1812141046 UCZDWPDMWWGQBK-GCJKJVERSA-N 459.315 0.538 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813072320 FRVFYLPDZLMKJC-GCJKJVERSA-N 459.547 0.970 50 20 JCGD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1814184671 CKOVSHPGSQEBNS-XEZPLFJOSA-N 456.977 0.547 50 20 JCGD CN(C)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336999 ITEJSINNSDPTSH-HNNXBMFYSA-N 465.344 0.824 50 20 JCGD Cc1noc(C)c1CC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337954 XXVKMEPJWMFMPK-OAHLLOKOSA-N 454.317 0.896 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)N1C[C@@H]2C[C@H]2C1 1815344335 UIOVURXGHIKCMB-VWNJHIHFSA-N 454.361 0.389 50 20 JCGD O=C(CN1CCCCC1=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348796 YULSYYLSAILAOT-OAHLLOKOSA-N 456.333 0.061 50 20 JCGD CN1CCCn2nc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)c4cccc(B(O)O)c4)n[nH]3)cc2C1 1817477115 MKXYDVUKOKFHDZ-NRFANRHFSA-N 491.361 0.741 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1cncn1)CC2 1819801941 VPKNZSLQRAIBJU-NSHDSACASA-N 455.504 0.049 50 20 JCGD C[C@@H](NC=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)[nH]n1 1820882848 GSKMZUSMRGHKBV-VQIMIIECSA-N 484.561 0.883 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822416081 NESAFVBCTZHYJS-IRXDYDNUSA-N 480.522 0.270 50 20 JCGD CCOC(=O)C1(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)CC1 1826089605 HKRSRJSCUNCUHT-LBPRGKRZSA-N 451.549 0.771 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2nccnc2C(N)=O)CC1 1829510307 MPSPXQZXEZQQEA-KRWDZBQOSA-N 480.529 0.121 50 20 JCGD C=C1CC(C(=O)N2CCO[C@@]3(COCCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)C1 1829670639 HDJVPDJDMDZKEC-RUZDIDTESA-N 485.585 0.755 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CS(C)(=O)=O)CCO2)C1 1831466700 SYWVIJGHYYGJPX-JKIFEVAISA-N 469.398 0.297 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3=NN(C)C(=O)CC3)CCO2)C1 1832380361 JSZSPCPEUQAFSR-SCLBCKFNSA-N 459.341 0.225 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1 1833292812 KSFWVEJQYWRCAB-VGOFRKELSA-N 475.933 0.862 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cccn(C)c3=O)CC2)CC1 1833584310 BAYYJMMRQYCDAK-OGLMXYFKSA-N 495.584 0.705 50 20 JCGD O=C(CCNC(=O)c1ccc[nH]1)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1833798381 XQDBCKZVHMSIEJ-GOSISDBHSA-N 453.971 0.306 50 20 JCGD Nc1n[nH]c(CCC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)n1 1834423827 LJZDABVZGDXJQF-UHFFFAOYSA-N 456.389 0.676 50 20 JCGD O=C(Cc1ccc2c(c1)OCO2)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834538180 SYCHAHJTAQNUSK-UHFFFAOYSA-N 493.369 0.523 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)COc3ccccc3)CC2)CC1)c1ccc(B(O)O)cc1 1834798012 UZOVCNRTCRNQLM-UHFFFAOYSA-N 465.359 0.631 50 20 JCGD COc1cccc(CCC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834799870 KFGORZRXDPGNKL-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD O=C(Cc1ccsc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834858961 FCSNPXVPCARNBF-UHFFFAOYSA-N 455.389 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnn4ncccc34)CC2)CC1 1835040730 WJPFIWMWVRMYTP-UHFFFAOYSA-N 470.578 0.288 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(N2CCC(NC(=O)C3(C(F)(F)F)CC3)CC2)CC1 1835494243 HAJUAGPPDWLZTB-UHFFFAOYSA-N 467.297 0.894 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835933820 GIEDBTSAZKSNLX-IQGLISFBSA-N 477.326 0.377 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cn3)CCO2)C1 1836031903 FOIKKIFJSGORPL-PVPASAESSA-N 486.504 0.354 50 20 JCGD COCC1(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1836855015 KWBKUJLYRQMXCR-UHFFFAOYSA-N 459.547 0.724 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456453 MWSZSLCKDRGXAT-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD Cc1csc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837456610 OUBKPPHVZSOWHO-OAQYLSRUSA-N 459.528 0.439 50 20 JCGD CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc(C)n1 1837457467 DBSOQDQROJFXEK-XMMPIXPASA-N 482.541 0.335 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cn4ncccc4n3)CC2)CC1 1837920114 BSBIXONDEFPYRQ-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921437 JVTHJRSFPFNSGB-DHIUTWEWSA-N 498.385 0.734 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H](O)Cc3ccccc3)CC2)CC1 1837921672 UYZCNVCBQPTZSW-XMMPIXPASA-N 480.370 0.582 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cn2[nH]cnc(=O)c12 1838471083 HGGROFNOOZWEOL-KBXCAEBGSA-N 486.298 0.092 50 20 JCGD COC[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838526720 AAOHVIUJFGQQGE-OYHNWAKOSA-N 479.486 0.873 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3ccnn3)C2)C1 1839743423 PVXASHIJDBMKTK-IXNCKXOBSA-N 472.452 0.620 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccccc1)CCO2 1840118327 VAWOXCYDOXARNQ-HWBMXIPRSA-N 464.327 0.240 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1 1840155479 DCVMYTSFYWAUML-FXAWDEMLSA-N 460.955 0.630 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@]3(F)CCCCC3(F)F)C2)C1 1840184563 VMNXPSRMEYCKMO-VQTJNVASSA-N 478.512 0.733 50 20 JCGD C=C1C[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)N(C(=O)OC(C)(C)C)C1 1840252564 XVWYSQRDQIZVJI-GSHUGGBRSA-N 487.981 0.608 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(Cl)c1 1840694740 YDKHYMXQRKDVMC-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccccc2C(=O)OCCO)C1 1844719001 QEUVOUXIEADQHS-WGOQTCKBSA-N 481.509 0.787 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846200963 CAQNRNZWWWYBCO-QGZVFWFLSA-N 472.546 0.902 50 20 JCGD O=C(COC(=O)COc1ccc2ccc(=O)oc2c1)NNC(=O)[C@@H]1COc2ccccc2O1 10987053 CEWGFVLIOLLDOZ-SFHVURJKSA-N 454.391 0.702 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)n(C)c1 18396380 MEPGOSNLKGGGTL-UHFFFAOYSA-N 481.487 0.582 50 20 JCGD CC(C)NC(=O)C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@H](C)C2)cc1 728261346 QLHKZYCPVBWHLC-KBPBESRZSA-N 460.578 0.187 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 729275263 MXJNOQQGQCPILP-NSHDSACASA-N 458.493 0.325 50 20 JCGD COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2cccc(C(C)=O)c2)cn1 729692047 IQIZFMZLPHQTIT-UHFFFAOYSA-N 451.530 0.979 50 20 JCGD O=C(COC(=O)Cn1cnc2c(oc3ccccc32)c1=O)NNC(=O)[C@@H]1COc2ccccc2O1 742378542 WRNIFCJUZZSFBW-KRWDZBQOSA-N 478.417 0.673 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c2ccccc2c1=O 749160318 KTLVSKCLQHBYPD-AWEZNQCLSA-N 461.525 0.609 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cc([N+](=O)[O-])c[nH]1 750842451 RROLORXGDNLJTO-UHFFFAOYSA-N 451.461 0.338 50 20 JCGD COc1cc(I)c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OC 751360347 CQJGDIIJGWXFQO-QMMMGPOBSA-N 483.284 0.440 50 20 JCGD CCn1nc(C(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)c2ccccc2c1=O 786262826 NCCCCQSJDBZWRN-INIZCTEOSA-N 484.900 0.505 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 831705848 HCOKSNVDJCOGNW-UHFFFAOYSA-N 482.902 0.581 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C\c1ccco1)c(=O)n2Cc1ccccc1 901413382 IBWKXJPSLBTZIS-KTKRTIGZSA-N 492.492 0.508 50 20 JCGD NC(=O)[C@H]1CC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)=NN1c1ccccc1 913081318 IEOWEVBNQDJVCX-HXUWFJFHSA-N 498.565 0.742 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2cccs2)c2ccccc2c1=O 916123883 KEEPQYXWSZOCIC-HNNXBMFYSA-N 475.552 0.999 50 20 JCGD CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919886507 UMNMFUITKZJNMN-GECXOHMQSA-N 490.629 0.216 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)c(C)n2n1 1777784505 NFDJWEJIOXPECE-KZULUSFZSA-N 451.325 0.968 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032791 YPMZSWGPTRYKRC-DEOSSOPVSA-N 475.509 0.694 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1 1779033687 BMOQRLUEDMNTNG-QHCPKHFHSA-N 463.498 0.179 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779216322 LDBPMODHSFHCAL-CKJXQJPGSA-N 484.985 0.876 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1779251582 MYPLHCFPMKNGBR-YREFKLKQSA-N 460.535 0.255 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779300021 KPBRCEXGOSMVDK-KKSFZXQISA-N 473.643 0.944 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)cn1)C2 1779371206 ROCWIAAEKXASLV-XMSQKQJNSA-N 456.478 0.661 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc(N4CCCC4)c(F)c3)C2)C1 1780144012 MSORBJUXNFCBFT-VWLOTQADSA-N 481.333 0.863 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1780402076 AGHBJXDKEXWGFI-QHCPKHFHSA-N 469.546 0.782 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc(Br)ccc3O)C2)C1 1780557663 SNBLPVJKNWNYAX-NRFANRHFSA-N 489.131 0.592 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780774560 DGVGUYZLMJQZHW-LUXYFRNMSA-N 481.315 0.686 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)C1 1784084493 VFQBXAKWPRTZFV-QAETUUGQSA-N 457.955 0.743 50 20 JCGD CN(C)c1cccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1785059948 UVUVIJRQFOFZNU-SSKFGXFMSA-N 496.568 0.423 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1786381192 JAXMLRGKBCBTGD-HNNXBMFYSA-N 458.345 0.795 50 20 JCGD O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21 1786405847 FYMBBOBUMDKLIM-KKUMJFAQSA-N 466.398 0.177 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)c(O)cc3O)[C@H]2C1 1789995598 YMKINNCWQACBJZ-YEWDVWPNSA-N 468.938 0.718 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cccc([N+](=O)[O-])c3=O)[C@H]2C1 1790654804 ATQMHLCQGGRJMT-NGOJXBLDSA-N 475.329 0.973 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4sccn34)C[C@@H]21 1791255578 VNCVFEUXVBQHEY-ABHRYQDASA-N 454.936 0.603 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cnc[nH]3)[C@H]2C1 1791502445 AMWZGVDZEOBLPM-VATSFWKFSA-N 453.503 0.537 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CCCO4)[C@H]2C1 1791914526 QJFOHHFOJFBJCC-ZJOUEHCJSA-N 458.559 0.978 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)C2)c1cccc(B(O)O)c1 1795737757 QFIWQGQLXXEATP-OHJZQYHNSA-N 452.291 0.512 50 20 JCGD COc1cc(F)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797756370 GFGMAMMSJYXQHV-USGNIVHTSA-N 471.489 0.279 50 20 JCGD Cn1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(C(F)(F)F)n1 1798787374 CIQSUERVLMUHKQ-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-c2cnco2)c1 1799645811 YUWSQJUAZHMLOO-UPHUGPLXSA-N 476.493 0.857 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2 1800978653 YLYHWWYOOLXFOI-KRXQYRFLSA-N 450.923 0.334 50 20 JCGD C/C(=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C(=O)O 1802011687 AJZKXABYCQBLHP-REVMDSIMSA-N 459.927 0.739 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2 1802337810 ARISIBZPXMXXTD-YYIAUSFCSA-N 469.583 0.273 50 20 JCGD Cc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803821913 FYPJEFTYXAUFCK-JXFKEZNVSA-N 462.514 0.755 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@@H](CNC(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1 1804007043 OLJRAZRMLVMFBS-HOCLYGCPSA-N 453.201 0.981 50 20 JCGD COc1nccnc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804970988 KEJHQKAMTBRIAK-YLJYHZDGSA-N 461.287 0.193 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc1 1805094971 URNJCKMZEIVBTR-AUSIDOKSSA-N 473.342 0.856 50 20 JCGD Cc1nc(N)sc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807244474 TUJNZIXRLXJMOP-SJLPKXTDSA-N 465.344 0.742 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807359620 BMRKCJZLAFBRJQ-GTCCEBARSA-N 466.347 0.386 50 20 JCGD CN1CCC(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1807360189 OYAADBQQMWBUKG-URXFXBBRSA-N 464.375 0.813 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807363192 CGLFFVKRBYQTOW-QUCCMNQESA-N 467.331 0.670 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365421 JSGDQPLLTKXPQZ-PZJWPPBQSA-N 496.373 0.994 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810542608 UQASIEMDYKYJSR-WIYYLYMNSA-N 455.396 0.933 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1813028793 WEGJXSUXCYVKFJ-JENIJYKNSA-N 472.995 0.072 50 20 JCGD O=C(CCN1CCCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1814265298 OECPPBYVGAMYGC-NFBKMPQASA-N 450.348 0.567 50 20 JCGD O=C(CCc1cncnc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1815528842 DBVWYAXCSBBASH-MRXNPFEDSA-N 451.317 0.472 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472456 SWIPHZGGGFDVNQ-GOSISDBHSA-N 462.275 0.429 50 20 JCGD CCCNC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474433 RGXRJFPEPPEISU-GOSISDBHSA-N 455.324 0.702 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476337 QHWZDVMFRVUTMS-RDTXWAMCSA-N 455.324 0.700 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)c2ccco2)n[nH]1 1817605398 AEUFIZSHSYCDBB-OAHLLOKOSA-N 459.507 0.798 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797483 WDQLMSFFXIBWDL-CMPLNLGQSA-N 459.532 0.234 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(-n2cccn2)nc1 1820735439 UEQCEXIHLATNGR-KRWDZBQOSA-N 488.338 0.943 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1821684468 HXEGKGUXCAXDQZ-DYVFJYSZSA-N 458.280 0.957 50 20 JCGD COCCOCCOCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1822257363 BQXOYLRZULZDHS-GOSISDBHSA-N 482.582 0.845 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)c2cccnc2)[nH]n1 1822410562 MATUKZARKOWWLA-QGZVFWFLSA-N 470.534 0.600 50 20 JCGD CN(C)C(=O)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828921794 AVINTQHCUAOUFZ-SFHVURJKSA-N 459.551 0.190 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@H]1O)CCO2 1830827018 CVFLUUZNQVNUAN-XFGYDDDFSA-N 466.962 0.993 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832071876 MIZJDHMZVRFALV-DNVCBOLYSA-N 450.841 0.703 50 20 JCGD CN(C)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549471 QHUAKZFRFJLKDI-YWZLYKJASA-N 462.975 0.137 50 20 JCGD O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1 1834421777 LFRASWALQCJMIR-UHFFFAOYSA-N 456.341 0.858 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C#Cc3ccccc3)CC2)CC1 1834518593 OIYIATDCEYKZGR-UHFFFAOYSA-N 453.587 0.983 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3[nH]nc4ncccc34)CC2)CC1)c1ccc(B(O)O)cc1 1834798494 BXBIJQQGXRGZFS-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD Cc1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798502 DBYXUGJFDSEODV-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD Cc1ccncc1CCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834799797 BJPOQNLNRWHTBI-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD CN1CCc2cc(C(=O)NC3CCN(C4CCN(C(=O)c5ccc(B(O)O)cc5)CC4)CC3)ccc21 1835381035 LNKJLPDDWNCCEG-UHFFFAOYSA-N 490.413 0.858 50 20 JCGD CC(C)[C@H](S)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835734675 PANVZVXRKGHBRH-IBGZPJMESA-N 462.620 0.825 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCO4)CC2)CC1 1835737797 BAFOVRDOWWVKOM-UHFFFAOYSA-N 496.572 0.163 50 20 JCGD CC[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1 1835939616 BTANXTVTGIEURR-JXQFQVJHSA-N 458.364 0.653 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn3cccnc13)CCO2 1836844813 MHBJZJNRGCGPLE-GOSISDBHSA-N 452.309 0.584 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3cc(Cl)ccc13)CCO2 1837085215 IHTXCKHLMGSTCN-HSZRJFAPSA-N 498.732 0.280 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3cc(Cl)ccc13)CCO2 1837085373 PAUYQACDJJDCSY-QHCPKHFHSA-N 498.732 0.280 50 20 JCGD Cc1cc2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)[nH]c2cc1C 1837345153 LCFXRFVAVBKXBO-RUZDIDTESA-N 492.341 0.243 50 20 JCGD CC#CC[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1837612867 OGQFDDUCJOBLSA-SHQCIBLASA-N 490.365 0.634 50 20 JCGD CN(CC(=O)N1CCC(OC2CCN(C(=O)CN)CC2)CC1)NC(=O)NCc1ccccc1 1837839134 OZBRJGCSIVNRTO-UHFFFAOYSA-N 460.579 0.290 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920415 WJLAIAXWGVBYFB-UHFFFAOYSA-N 491.357 0.644 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837943289 AIWDULVUPDABSQ-XIKOKIGWSA-N 471.308 0.276 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cocn3)C2)C1 1838528071 CWGCOLAWXMILRI-OAQYLSRUSA-N 474.426 0.892 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)ccc1F)CCO2 1838860540 LOUHCALYXDIJDC-NRFANRHFSA-N 454.474 0.408 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1 1839035258 GNDIZKIAHGYRQM-MGPUTAFESA-N 474.963 0.787 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)C1 1839144831 LMMUTVJKZYMSIQ-SIFCLUCFSA-N 463.959 0.346 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CCO2 1839388393 PPFCEIBPXXJEOW-IQUTYRLHSA-N 494.383 0.459 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622547 JUWPAHHPBWULEB-LAUBAEHRSA-N 469.970 0.042 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3nn[nH]c3c1)CCO2 1839628978 UPFFOZDLFGBEOP-SFHVURJKSA-N 452.309 0.813 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1839692486 ZTUQTMHVPQMUKB-KSFYIVLOSA-N 495.418 0.871 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1840155489 DFIUAJWEEXXDQW-SPKLELGKSA-N 494.898 0.854 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1 1840156660 RZFJAAOUZNHIGL-MGPUTAFESA-N 463.959 0.611 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840183528 JZHRNBCWZAOKTI-NRFANRHFSA-N 467.954 0.486 50 20 JCGD CC(C)c1csc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)n1 1840183546 LQGGYUWRXWCSLW-NRFANRHFSA-N 467.592 0.710 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)CCO2 1840747075 HKXIOAJTJDMLBF-VWLOTQADSA-N 490.325 0.140 50 20 JCGD O=C([C@H]1CN(Cc2ccccc2)CCO1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011430 CMQQGNHJXYUGRX-JOCHJYFZSA-N 463.343 0.084 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1cccc(Cl)c1 1843011849 ARBYVGFFRMMUCF-HXUWFJFHSA-N 469.734 0.714 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)C(C)(C)S 1846301387 BQSYDAPOSWKYNR-QGZVFWFLSA-N 491.419 0.785 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1847151185 OPSNBVSVLWUQOS-QGZVFWFLSA-N 488.545 0.138 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2nc(C)cc(C)n2)c1OC 21127231 RKTOLAXNWUSLMD-UHFFFAOYSA-N 451.505 0.888 50 20 JCGD C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1=O 25438953 VFQMWPRROGDDNQ-HXUWFJFHSA-N 452.406 0.030 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)Cn3ccc4ccccc43)cnc21 303271020 RCTHTNXSKYZPHB-UHFFFAOYSA-N 458.276 0.695 50 20 JCGD C[C@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1ccc(S(=O)(=O)N(C)C)cc1 726102438 LVWYCICFNVMXFV-LBPRGKRZSA-N 453.546 0.820 50 20 JCGD Cc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1N1CCNC1=O 728335808 QGQSIEATPKIDRS-SFHVURJKSA-N 454.439 0.669 50 20 JCGD COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728890279 KFJVJCIXPKSNOS-UHFFFAOYSA-N 468.514 0.628 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)COc1ccccc1O 730778391 NRRZLVVFAIHBHB-UHFFFAOYSA-N 490.538 0.232 50 20 JCGD Cc1cc(S(N)(=O)=O)sc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 746396247 HGYJUAFVQOUWQF-UHFFFAOYSA-N 472.570 0.563 50 20 JCGD O=C(NNC(=O)N1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1ccc(-n2cnnn2)cc1 807135985 UZIBIMIIWKKZLI-UHFFFAOYSA-N 488.505 0.552 50 20 JCGD C[C@@H]1Oc2ccccc2N(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1=O 811880889 PZCFZOMUSWECGQ-HNNXBMFYSA-N 488.522 0.283 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1OC(F)F 912852214 RMKBDNZYQZWDIR-UHFFFAOYSA-N 485.469 0.781 50 20 JCGD COC(=O)NNC(=O)C1CCN(S(=O)(=O)c2sc(C(=O)OC)c(C)c2C(=O)OC)CC1 913176741 ONVHBUHEEMFGGC-UHFFFAOYSA-N 477.517 0.418 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCC(=O)N(C)C)c1 916623921 DSEZZDYFQJJRSF-UHFFFAOYSA-N 463.516 0.918 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCS(=O)(=O)NCc2ccccc2)cc1 916645293 OVRRRLIEEROXMC-UHFFFAOYSA-N 497.599 0.066 50 20 JCGD O=C(COC(=O)c1cccc(S(=O)(=O)NC2CC2)c1)NNC(=O)[C@H]1COc2ccccc2O1 916655266 YEZYDCHWSTWCGD-GOSISDBHSA-N 475.479 0.272 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@H](NS(C)(=O)=O)C1 918777412 ITTXUFOYYCTMAP-AAEUAGOBSA-N 463.354 0.971 50 20 JCGD CC(C)(C)NS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 919690830 UZRBPJOWZIHYMJ-UHFFFAOYSA-N 482.584 0.644 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc1 919903072 MCPMAQGZWCGYQC-UHFFFAOYSA-N 453.499 0.730 50 20 JCGD O=C(NNS(=O)(=O)c1cc(Br)ccc1Br)N[C@H]1CCS(=O)(=O)C1 919961077 QKWUTVZIUKSLLX-QMMMGPOBSA-N 491.183 0.891 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]32)c1 921301608 GIGSNVOHVGBEIX-HLLBOEOZSA-N 469.589 0.424 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)[C@@H]1SC(=N)NC1=O 1778085860 WQRQYYATEGRVMI-NTJNJQCLSA-N 479.372 0.993 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C)cn1)C2 1778091126 HMUQXVXQWZTGJA-GULKHOJOSA-N 455.519 0.682 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1F 1779036220 YDCUKDHCMNANJJ-JOCHJYFZSA-N 457.462 0.590 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCO3)C2 1779372707 YPPIPEMHLKKUKK-WZONZLPQSA-N 483.529 0.105 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(CO)o3)C2)C1)NC(=O)NCc1ccccc1 1779549011 HALSTMFOKZFPEE-XMMPIXPASA-N 485.541 0.562 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1 1779593683 HGCUFKAMJKSHRN-QHCPKHFHSA-N 476.497 0.228 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1nccnc1C(N)=O)CCO2 1780097621 ATZPTZAWJNSDFQ-QFIPXVFZSA-N 498.452 0.166 50 20 JCGD CCOc1ccccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1780546350 ZVROAUBGUMYDGY-HSZRJFAPSA-N 453.499 0.841 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)NC(=O)c2ccccn2)C1 1781490521 JRELXOJXSDMEIC-FWTHMSADSA-N 466.966 0.968 50 20 JCGD Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc(C)c1C(=O)O 1782171463 ACQFDQPEBUAHKS-DEOSSOPVSA-N 466.299 0.439 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1782424260 OSXXIHBRAWBVDH-BFUOFWGJSA-N 454.936 0.823 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CC[C@@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)O[C@H]2C1 1783494782 NGMUJYFJBWQTDA-YGRDSASPSA-N 487.981 0.440 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CC[C@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)[C@H]2C1 1783506589 XQFDAPBFKMFMPV-HGLZMYDXSA-N 487.981 0.298 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)CCO2 1783529780 MSJDXPQISWAINQ-KSMMKXTCSA-N 478.384 0.875 50 20 JCGD Cc1cc2nnc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](C)Br)C4)C3)c(C)n2n1 1783534049 DGNKWSXCTGTTRH-SGTLLEGYSA-N 451.325 0.968 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1 1783538128 UCBYYRBBEHRJNG-PXNSSMCTSA-N 495.411 0.686 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1cc(Br)ccc1O)CCO2 1783935207 RDLGYADPMIAFRM-NRFANRHFSA-N 497.390 0.900 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783940672 YMEUPDFFWGRKFO-UOKFIYJESA-N 493.605 0.659 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1785488922 RBKAPCVWCGRGEW-DEOSSOPVSA-N 462.315 0.319 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786986490 GMLMVMBQWGSVRD-LEAZDLGRSA-N 489.378 0.263 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1nc2ccc(C(F)(F)F)cn2n1 1787178577 NGQUPMXFIUPUNC-PYJNHQTQSA-N 475.855 0.941 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc2cccnc12 1787826011 BEIFVGHMKHCALE-NYVOZVTQSA-N 459.311 0.822 50 20 JCGD Cn1cc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cnccc5C(=O)NN)C[C@@H]43)ccc2n1 1790351740 YKXGBWNYUUEROT-ZRCAFCQKSA-N 477.525 0.479 50 20 JCGD COc1cc(Cl)ccc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790710683 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0.579 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@H](O)CCl)C3)C2 1802150497 GHAAEWVFLICSIJ-HRELVALDSA-N 471.982 0.964 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)on1 1804260261 XSBCZYXVJOZGAP-KKSFZXQISA-N 463.498 0.939 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cc(=O)n2[nH]cnc2n1 1807352330 FDUPANCAARIDFU-CXAGYDPISA-N 474.319 0.917 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C1(O)CCC1 1807359140 FJKLCKOPZMNYKD-OZOXKJRCSA-N 451.332 0.632 50 20 JCGD COCCOCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808413922 CLBIVWRZKCAYHS-ZNPGGGMWSA-N 470.530 0.884 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CNC(=O)C2)[C@H]1c1cccnc1 1808416245 IQTXDWOXQXZRKC-LFXNOJAGSA-N 465.514 0.358 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCNC(=O)C2)[C@@H]1c1cccnc1 1808417451 ZCWALNGTMFRTDW-NPWMIDDZSA-N 479.541 0.748 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)Cc2cscn2)[C@H]1c1cccnc1 1810301920 DVUPFWHJGYZBBY-YSSFQJQWSA-N 494.581 0.426 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1810303288 PQSAUKWLMIDSCS-VLIAUNLRSA-N 477.481 0.520 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1 1810789423 PPGINZHSGFECLY-IBGZPJMESA-N 489.378 0.097 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1CC(c2ccccc2)=NN1 1812305914 DYGKRKKFRNXCSX-GVXSCFBNSA-N 497.364 0.847 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812715629 UVQJRIVYOJXWAL-GHTZIAJQSA-N 452.628 0.226 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1 1813073334 IRYRCTWDTDTISG-AOMKIAJQSA-N 471.518 0.035 50 20 JCGD Cc1noc(C)c1CC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337949 XXVKMEPJWMFMPK-HNNXBMFYSA-N 454.317 0.896 50 20 JCGD O=C(Nc1cccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344257 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CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3nc4ccc(F)cn4n3)sc2C1 1824395790 JLEPNUDDPLFWJI-LBPRGKRZSA-N 474.522 0.924 50 20 JCGD Cc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c(=O)[nH]c1C 1825442479 ALVYZBQHSSABMX-FQEVSTJZSA-N 466.347 0.614 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(C(N)=O)cc1)CC2 1826092247 VYQRHHJOXQHLCO-CQSZACIVSA-N 458.544 0.841 50 20 JCGD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn2[nH]cnc(=O)c12 1827052674 WWEZMYUIHZDSPF-OAQYLSRUSA-N 491.357 0.558 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)N1CCN(C)CC1 1827056044 AFSNPPWKJYNFEY-AUSIDOKSSA-N 470.423 0.236 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCc2nc(N)n[nH]2)CC1 1828806840 JTMUKDZRFXLXJU-KRWDZBQOSA-N 469.550 0.252 50 20 JCGD Cc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)c(=O)[nH]c1C 1828923399 ITTLKRQHTKXUPD-IBGZPJMESA-N 481.557 0.932 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924441 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C[C@@H](Sc1cccs1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837231159 DRXRGJCGXLIXGB-OPAMFIHVSA-N 490.412 0.679 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1837710257 RJFTVXVZBIYJRD-FQEVSTJZSA-N 485.635 0.407 50 20 JCGD CCN1CCC(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1837920796 GKHLWFJBCVCFIK-UHFFFAOYSA-N 471.407 0.711 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837943286 AIWDULVUPDABSQ-KPZWWZAWSA-N 471.308 0.276 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cn2[nH]cnc(=O)c12 1838472479 MKBZJYDRZKDZOH-SFHVURJKSA-N 458.302 0.205 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1838553135 NEMWPSKGAVSUBB-QHCPKHFHSA-N 496.536 0.286 50 20 JCGD CCc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838837770 NDPYEFPWKYHAQK-OAQYLSRUSA-N 474.543 0.088 50 20 JCGD CN1CCN(C2(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@](C)(Cl)CCl)CCO4)CC2)CC1 1839154319 KIXVVMGAHJVSFW-UXHICEINSA-N 477.433 0.459 50 20 JCGD O=C(c1cc2ncccn2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201502 ZIIYPKQHBIBPJO-PBHICJAKSA-N 456.272 0.490 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c([N+](=O)[O-])c1 1839462169 FKYYCUBJHLNJFH-OXQOHEQNSA-N 485.877 0.051 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1 1839686667 TZBNRXYRWNLHQO-PBFPGSCMSA-N 451.314 0.788 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1840148805 VKGOXKLMWBSPDM-CVDCTZTESA-N 498.960 0.723 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(Cl)n3)C2)C1 1840183687 UHVXNNQPNOLZCT-OAQYLSRUSA-N 467.954 0.107 50 20 JCGD COc1ccc2nc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)ccc2c1 1840184172 BALFLMADYQTQRJ-VWLOTQADSA-N 499.568 0.686 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1840379129 YVVJQNIMYGKDSQ-LRDDRELGSA-N 462.370 0.384 50 20 JCGD C[C@H](Cc1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840473315 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CSCC[C@@H](NS(=O)(=O)c1ccc(Cl)c(Cl)c1)C(=O)NNC(=O)c1cnn[nH]1 729455950 IEYOIBLFMYETCF-LLVKDONJSA-N 467.360 0.973 50 20 JCGD CCN1CCN(C(=O)CC2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)CC1 731214331 DGAWFFXVSCCFFG-UHFFFAOYSA-N 460.535 0.622 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c2ccccc2c1=O 749560795 KPJHCAGRKIAYFA-MRXNPFEDSA-N 463.450 0.728 50 20 JCGD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)CNC(=O)c3cccs3)C2=O)cc1 751208604 GOCHMKYNRCXQSU-FQEVSTJZSA-N 459.484 0.101 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)n1 760083907 XWMGMXIFSWNKLV-UHFFFAOYSA-N 460.921 0.317 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)cc1 913445844 YMJIWYSDTGBZQH-UHFFFAOYSA-N 499.640 0.884 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)nc1 916390720 VSNYYQCMQGRRMK-UHFFFAOYSA-N 462.580 0.741 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@@H]3CCCO3)c2)cc1 916830559 HANKPCPNOAXJAF-KRWDZBQOSA-N 460.512 0.852 50 20 JCGD O=C(NNS(=O)(=O)c1csc(C(=O)O)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1 917722182 SDNUFUHQWHKNIZ-UHFFFAOYSA-N 459.527 0.854 50 20 JCGD Cc1[nH]nc2ncc(C(=O)NNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)cc12 918211912 FTLJYMOPVIFMEF-UHFFFAOYSA-N 472.527 0.681 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)CC2)cc1C 919885661 QASHZJPCBPNGEF-INIZCTEOSA-N 472.589 0.222 50 20 JCGD CCOc1ccc(NC(=O)CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 920343410 XPHAVFWNPRDXQO-UHFFFAOYSA-N 477.543 0.983 50 20 JCGD Cn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c2c1CCC2 1778669737 ZHMONWBWDLISGP-HYBUGGRVSA-N 466.347 0.030 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1 1779029153 SFKWBWGQRZYSIG-XMMPIXPASA-N 488.508 0.294 50 20 JCGD Cn1c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1C(F)(F)F 1779030015 DLCRHFPAHXNRAC-HXUWFJFHSA-N 480.447 0.800 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1c(Cl)ccc3c1OCO3)CCO2 1779030509 RFQCHXYAKACWEN-QFIPXVFZSA-N 487.900 0.825 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(CO)o1)C2 1779372472 JKNVOYAFGYIQMY-XMSQKQJNSA-N 457.487 0.212 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC13CCCN1CCC3)C2 1779374173 HJVILDIJYPPBKB-HYBUGGRVSA-N 484.601 0.831 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1 1782171743 CWDXZZWCFKEFHJ-ATNYBXOESA-N 453.989 0.082 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1782921738 JRLDVNADPROIRK-OSPHWJPCSA-N 454.307 0.828 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1783555201 LKUVDDSYNTTXRS-ZYKLXPEUSA-N 499.373 0.209 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1783890875 GPNZZMDJYICIGA-DEYWJSPQSA-N 479.961 0.347 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1 1783966279 CIKRCUYGRCTPTF-VHNVRGPLSA-N 477.352 0.492 50 20 JCGD 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CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)C2)C1 1831657627 PICCTVFWOFZQIC-WAOWUJCRSA-N 469.970 0.321 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833025606 DQOBRKQMGBEVSI-XCLFUZPHSA-N 499.362 0.234 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)ccn1 1833310756 ZVBZQIKQBJWPCM-GOSISDBHSA-N 451.955 0.825 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1833713802 DAXDIOPDSFFRID-FQEVSTJZSA-N 497.489 0.525 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3)CCO2)C1 1834995422 ZAHOTBDDLCVCBK-FXVMGJAWSA-N 467.526 0.820 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc4c(c3)CC(=O)N4)CC2)CC1 1835517896 BDVMZRFQSSYKHL-UHFFFAOYSA-N 484.601 0.739 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnc4[nH]ncc4c3)CC2)CC1 1835526439 CRNBUYVIAWVABT-UHFFFAOYSA-N 470.578 0.516 50 20 JCGD CC(C)[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835926146 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CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccoc4c3)C2)C1 1840184141 VKMCGIAZQLXFRJ-JOCHJYFZSA-N 459.503 0.271 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cnccc4n3)C2)C1 1840184348 HPJONMMGJVPXGC-QHCPKHFHSA-N 470.530 0.073 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)c3ccccn3)C2)C1 1840186069 YZOJMCSEHGDTRI-HSZRJFAPSA-N 461.563 0.189 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C)n1 1840337705 KOAINDILIPOHAA-RUZDIDTESA-N 481.358 0.081 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840887177 YMEPWYUPHFFJJZ-QFBILLFUSA-N 459.858 0.333 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)CO2)C1 1841353893 WPHSJGFJHKQAEC-LSDHHAIUSA-N 457.955 0.816 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCN2CCN(C)CC2)C1 1842828531 WCSRGBKLUZPGBW-UHFFFAOYSA-N 473.530 0.975 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1842881267 HZNLZEXAGZYTBA-HOTGVXAUSA-N 451.365 0.789 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c([N+](=O)[O-])c1 1843014639 JCQLFXZHWIXFIX-UHFFFAOYSA-N 467.243 0.192 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264471 WJNKGDRSZWFHHG-PBHICJAKSA-N 490.536 0.850 50 20 JCGD C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)C1=O 25436431 PFEDWOMPCBYAQM-OAQYLSRUSA-N 452.402 0.290 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=S)NCCc1cccnc1 727692707 QZMGZCPSEMECTB-UHFFFAOYSA-N 477.612 0.773 50 20 JCGD O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 745868045 VWAJNHCESIGYJU-JXFKEZNVSA-N 499.549 0.017 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1 749475101 AIUUBPYVJWKSRW-TZMCWYRMSA-N 458.334 0.636 50 20 JCGD CCOC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 818780226 MKZIYTJOGHOGBP-UHFFFAOYSA-N 485.544 0.384 50 20 JCGD COc1ccc(-n2nnc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c2C)cc1 915188638 HIDYGCLXKSQOHN-UHFFFAOYSA-N 464.891 0.960 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNS(=O)(=O)c1ccc2c(c1)CCO2 918062426 SPWYIPJCQNDOIG-UHFFFAOYSA-N 495.579 0.585 50 20 JCGD Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(F)(F)F 1317877923 BWIISLFYRQUGAH-INIZCTEOSA-N 477.469 0.497 50 20 JCGD CN1CCN(Cc2cccc(CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)c2)CC1 1326130584 RPKALAMIZOYNMR-UHFFFAOYSA-N 459.572 0.982 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(=O)n3[nH]nnc3n2)C1 1777821853 NJLWZAAYRDWYTL-OCBCSQNSSA-N 472.333 0.176 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCCN3C(=O)OC(C)(C)C)C2)C1 1779016434 VJKBQDJWLCWCLI-MHECFPHRSA-N 495.621 0.979 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cccc1C=O 1779030753 HPLXPXBUJMAULD-NYHFZMIOSA-N 454.487 0.004 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2 1779374530 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NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3cccnc3)C[C@@H]21 1788611415 AIZWNNNFBWHPOY-NBFPQWMBSA-N 450.499 0.387 50 20 JCGD COc1cccnc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611501 GICIBUDQRPVCHG-XERREHJYSA-N 482.541 0.315 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(=C/c3ccco3)NC(C)=O)C[C@@H]21 1791257251 UNZDBRQOIUDGFI-XYQPEQFWSA-N 453.923 0.990 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(-c3ccccc3)c3c1COC3)C2)[C@@H](O)CCl 1792977133 RHYWMNPYFQHRCY-FTUNRGFVSA-N 460.918 0.705 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)[C@H]1CCc2nc(O)nc(O)c2C1 1794112380 SNOVLSYQGIHDOM-IJPSMNBWSA-N 473.299 0.273 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(F)(F)F)CCC1 1795481275 PLPKFCYXCDBOJK-JJLQDPRZSA-N 455.437 0.621 50 20 JCGD COc1cccnc1CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798440757 OMPDPISQPXNXNN-MUJYYYPQSA-N 452.515 0.973 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(O)nnc2O)cc1 1798598704 AOVNXJCKNOJKPT-JLVBRIDZSA-N 475.578 0.733 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)ccc1O 1798951438 AFGBKXMQIPENSE-GSBKIRKESA-N 469.498 0.738 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1799249972 WWUXFPNZYCPNMI-SVZOTFJBSA-N 491.969 0.022 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F 1800332627 VQLYEUBBJQXERL-PASOZIPMSA-N 496.536 0.789 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2F)[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800766007 KDPAOZBQBLLIMK-IFPOKBMLSA-N 489.972 0.912 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c1 1801917842 QIGOOWBHXMMNET-OJXGSEEGSA-N 465.355 0.546 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccnc(Cl)n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361857 UIQZAUFMOBILHJ-QFBILLFUSA-N 465.706 0.838 50 20 JCGD Cc1cnc2c(C(=O)N3CC[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)cnn2c1 1807362407 LPIVTEZCZSOLEJ-SIKLNZKXSA-N 484.325 0.746 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)n1cccc1C=O 1807371329 SRLGAWDQFSBTSS-HCLVMJGWSA-N 474.326 0.956 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375925 QWHDVTCFLVLDST-RXVVDRJESA-N 470.298 0.438 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)CNC(N)=O)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807460421 BTBASXMUNXYJPV-SIKLNZKXSA-N 496.572 0.102 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809974849 BDBBUUSEEIZVBX-UHFFFAOYSA-N 499.398 0.465 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C(=O)Nc2cccnc2)[C@H]1c1cccnc1 1810461120 GKXQHXGTPIOVIQ-OXJNMPFZSA-N 488.508 0.433 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1 1813029928 BKFIBAAEWYGPQD-GRDNDAEWSA-N 459.894 0.386 50 20 JCGD O=C(CSc1ncccn1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354742 REMHMKVOWXLAED-CQSZACIVSA-N 469.357 0.631 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCO4)sc2C1 1819119093 KGVYEEQZYLFFSJ-NSHDSACASA-N 482.526 0.660 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)[nH]n1 1822414945 OQDCZJOZLHZKSC-HNNXBMFYSA-N 481.517 0.492 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1823127770 BXXDWSYWLHGDKT-LBPRGKRZSA-N 468.543 0.950 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(O)nn2)CC1 1825711055 DILJQBNBFVCNEK-GOSISDBHSA-N 453.503 0.728 50 20 JCGD COCCOCCOCCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825773824 XKSVBWCKTYCKFU-QGZVFWFLSA-N 491.375 0.118 50 20 JCGD C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)n1ccccc1=O 1826087696 JMWCUMUSXVXVGO-KBPBESRZSA-N 460.560 0.851 50 20 JCGD O=C(NCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1cccnc1 1827056018 OGJHFUPUDIQIGY-JOCHJYFZSA-N 478.358 0.425 50 20 JCGD CC(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1828795900 VBCGQNSUTKNXSJ-XMMPIXPASA-N 487.557 0.401 50 20 JCGD COc1nn(C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828925480 MUKHMTZDKCPPTA-IBGZPJMESA-N 469.546 0.974 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830353906 MGULXUQRBAPSER-AOMKIAJQSA-N 492.013 0.984 50 20 JCGD CCn1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c2ccccc21 1830723924 UVWKHQXWVVYJTM-UWJYYQICSA-N 450.923 0.726 50 20 JCGD O=C(c1scnc1C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725761 RNISUGQFGRTHFM-MEBBXXQBSA-N 457.858 0.832 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n1 1832768920 FIONLFNZBLVRMY-LIRRHRJNSA-N 456.337 0.873 50 20 JCGD O=C(/C=C/c1ccco1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833850106 ZEJUMPIVLHRCON-VOTSOKGWSA-N 451.332 0.858 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4cnccc4n3)CC2)CC1)c1ccc(B(O)O)cc1 1834798700 YYXRYBXWCUJJEZ-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Cl)CC3)CC2)CC1 1835080387 KRMWKLUTCNXGIO-KRWDZBQOSA-N 467.007 0.764 50 20 JCGD CC[S@](=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737997 PRKXEQZNDRNUIE-XIFFEERXSA-N 478.619 0.029 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccccc3N)CCO2)C1 1835777723 ZOCIIMFBIQKXPR-ZFTMLNQLSA-N 480.525 0.051 50 20 JCGD Cc1cccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835927559 SSKLEKAHPQOSBK-RUZDIDTESA-N 466.343 0.378 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnoc3)CCO2)C1 1836535206 ZSVSUQNHECUHGW-NRFANRHFSA-N 474.426 0.892 50 20 JCGD CN1CCN(C2(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)CC2)CC1 1836717781 JMTPHMJQXNCQQX-IBGZPJMESA-N 457.015 0.365 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cnc1C 1837456215 FPQTYAXYUWPHCH-QHCPKHFHSA-N 468.514 0.081 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)OC(C)C)CCO2 1837597727 IWRQKOVRPHMWAK-HRJSYZDASA-N 463.535 0.390 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)OC(C)C)CCO2 1837597730 IWRQKOVRPHMWAK-TUGUMKMLSA-N 463.535 0.390 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837630206 JIIJIWWNKCBLFL-OALUTQOASA-N 459.330 0.713 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccnc3)C2)C1 1838528264 NBUUUTWRAQAFQT-JOCHJYFZSA-N 487.469 0.487 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccc(F)cc1 1839037250 DQBZUYHJWYVVKE-BBTUJRGHSA-N 471.913 0.059 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1839150852 ZNDBDYCZWCURPY-PMACEKPBSA-N 475.373 0.827 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn2[nH]cnc(=O)c12 1839200640 NQJMUMNOHDKGEO-KSSFIOAISA-N 486.298 0.092 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](C)Br)CCO3)C2)n1 1840033310 ADTXTSPNEKMYQJ-YWZLYKJASA-N 485.379 0.527 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1840141018 SLOOXXFYQXBJMJ-YRNRMSPPSA-N 473.364 0.983 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3COc4ccccc4O3)C2)C1 1840150481 LRUIZSUWOSJGDE-KLHJMIIUSA-N 454.907 0.537 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(N4CCOCC4)n3)C2)C1 1840152818 VDXTUZHHLCLOPL-JTSKRJEESA-N 482.965 0.242 50 20 JCGD CCn1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c2ccccc21 1840184157 VUJIJDJRVDUFIL-XMMPIXPASA-N 486.573 0.499 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(C)CC1(F)F)CCO2 1840825385 DTFVSAKUCGBXAM-VMTUJZNWSA-N 467.473 0.622 50 20 JCGD O=C([C@H]1CN(Cc2ccccc2)CCO1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014097 XDBLQDTWOAYWCW-JOCHJYFZSA-N 463.343 0.084 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846154958 PVLWETGXUCSQQC-BWTSREIZSA-N 469.347 0.296 50 20 JCGD CO[C@H](C)[C@@H](C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1)N(C)C(=O)OC(C)(C)C 1846385546 RVPFPUSXCKTYFG-APWZRJJASA-N 483.610 0.833 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847568684 IJFWFHVSIYTIMY-CBBWQLFWSA-N 475.974 0.130 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN)C(=O)c1ccccc1 1847728917 ZUQLDIOVOVUEOC-OALUTQOASA-N 450.499 0.273 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)NC2CC2)cc1S(=O)(=O)N(C)Cc1ccccc1 9889548 NNYVJXKDQXVUNE-UHFFFAOYSA-N 460.512 0.556 50 20 JCGD Cc1sc2nc(CS[C@H](C)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)[nH]c(=O)c2c1C 17642325 YZOMOIFVODKOCO-GHMZBOCLSA-N 458.587 0.805 50 20 JCGD C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1 725871014 AUENQJTXAYLWNQ-HNNXBMFYSA-N 450.565 0.237 50 20 JCGD O=C(COC(=O)CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)[C@@H]1COc2ccccc2O1 728340633 KWJNXTDNOKFJRK-IBGZPJMESA-N 480.433 0.602 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)NCCS(=O)(=O)N2CCOCC2)c1 728746701 BCQIRJXEWUBCPC-UHFFFAOYSA-N 465.326 0.064 50 20 JCGD CC(C)(C)OC(=O)[C@H]1CC(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)=NN1c1ccccc1 729341805 TTWKBKYSNIPYQL-CZUORRHYSA-N 465.532 0.481 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc(C#N)cn1)c(=O)n2Cc1ccccc1 730771069 QAEKMUICGKEYFG-UHFFFAOYSA-N 472.465 0.156 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)n1 759926369 KDBJAVXWHPYJDW-UHFFFAOYSA-N 463.472 0.743 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1 831711314 MGXJGAOYQRGBAR-UHFFFAOYSA-N 462.484 0.236 50 20 JCGD O=C(NNC(=O)c1cn(CCO)nc1C1CCOCC1)c1ccc(S(=O)(=O)N2CCCC2)cc1 856582493 HCAJWSYEZBXMNQ-UHFFFAOYSA-N 491.570 0.629 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Br)cc1 913446105 MDWGYVLTHTTYCV-UHFFFAOYSA-N 472.317 0.962 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 915789217 YNDSUMBGHUXKGH-UHFFFAOYSA-N 488.975 0.734 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)ccc1Cl 916133538 WQQMOPJZSWFNGM-ZDUSSCGKSA-N 457.940 0.676 50 20 JCGD CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916580106 DPMQHCKOUQOWNE-UHFFFAOYSA-N 475.593 0.087 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(Cl)nc1 917253397 IROUTTQASAVLDH-AWEZNQCLSA-N 474.948 0.278 50 20 JCGD CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)n[nH]c1C 917716965 GRRYDJGNHULMCC-UHFFFAOYSA-N 479.544 0.939 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1scnc1Cl)c(=O)n2Cc1ccccc1 919703211 NOXAZVWZRCKDPS-UHFFFAOYSA-N 487.929 0.999 50 20 JCGD O=C(NNC(=O)N1CCC(C(=O)NCC(F)(F)F)CC1)c1csc(N2CCOCC2)n1 1251193576 PDZRXRVQSKZZDS-UHFFFAOYSA-N 464.470 0.725 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1 1780341720 PBNGMMHSKMEWMN-DEOSSOPVSA-N 460.299 0.309 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCOC1)CCO2)NC(=O)NCc1ccccc1 1780968597 FJGYPGKBHRTNPF-XXBNENTESA-N 459.547 0.199 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1781188682 SWWKPDJBKXVWKW-ZSDSOXJFSA-N 491.969 0.263 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1783500504 ILHNQSGHWLLTFM-BQXPFJCYSA-N 457.955 0.529 50 20 JCGD O=C(/C=C/c1ccc(O)cc1Cl)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1783775046 KMPWIVNLEPIYKC-BVBLWJPBSA-N 470.718 0.882 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1783934690 KILMMFHVSWCVBN-QFIPXVFZSA-N 461.519 0.681 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1 1783936293 SYPYKVBDADKJSC-LQFJEPQRSA-N 455.515 0.225 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)[C@H]2C1 1783992251 BKWXMHXWLPCRFQ-QTVXIADOSA-N 478.384 0.635 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785347120 ZGOLUQLPNXSFDK-MBSDFSHPSA-N 475.351 0.113 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1nc(Cl)ccc1F 1785473816 XEJLEFBOUDRCCV-QRTARXTBSA-N 461.686 0.461 50 20 JCGD CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1Cl 1787132197 QMSJKSAQXLKTME-QRTARXTBSA-N 460.727 0.212 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c[nH]nc4c3)[C@H]2C1 1787319562 LNOZGXOCAIJNRG-QSFXBCCZSA-N 463.498 0.469 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccsc4n3)C[C@@H]21 1788611207 OTPDFKZUBVVKMF-NUTKFTJISA-N 469.527 0.301 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCCn3cccc3)C[C@@H]21 1788611373 WYUYVHBYNVOURT-YYWHXJBOSA-N 468.558 0.950 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)COc3ccc(Cl)cc31)C2)[C@@H](O)CCl 1792974736 AJXQNPIKAGWIIE-RHQBZFHZSA-N 472.325 0.255 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1C(=O)C=CC1=O 1793610310 CONHIOMMQZYYKP-YGTYGHESSA-N 498.964 0.023 50 20 JCGD CCC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1793679580 NEZCHPRJFNLKFA-LXTVHRRPSA-N 464.954 0.479 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccccn1)NC(=O)NCc1ccccc1 1794201467 DSYWVVOBUNYHQT-GQEURGSBSA-N 494.596 0.950 50 20 JCGD Cn1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1 1794587852 QQFMTQSEMDEVID-CRWXNKLISA-N 456.931 0.150 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795737632 DSNZHKNHBCDGMU-MHYJACLRSA-N 464.327 0.382 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2scnc2c1 1797492180 XWCFLSLFBKBGNC-CWPLJXCYSA-N 451.313 0.493 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1797728694 AKQGZTNCXOPECY-HATOLVCRSA-N 456.424 0.621 50 20 JCGD Cn1c(=O)n(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c2ccccc21 1797749018 CBRPBFGCOCZHCK-MUJYYYPQSA-N 477.525 0.291 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl 1799276337 JHDHKTMHWOEWEL-DTFBLWLJSA-N 453.319 0.307 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1799382681 GCQATTFTZRPLKT-SCAQPMJSSA-N 471.378 0.466 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)c(F)c1)C2 1801009082 OQTNZYKWDAORRL-MFKICJERSA-N 452.502 0.860 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1802160186 ZSJJVASFYXQLST-AICCOOGYSA-N 493.964 0.452 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2cn3c(nc2=O)SCC3)[C@H]1c1cccnc1)[C@@H](O)CCl 1803140345 CTZPHNRDSPLRII-ZVZYQTTQSA-N 477.974 0.592 50 20 JCGD Cn1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1=O 1803832107 BZZCXMKFFJUPMK-JXFKEZNVSA-N 475.509 0.412 50 20 JCGD O=C(COc1cccnc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804332901 HQCKFQYCPVCYDC-XXBNENTESA-N 460.299 0.555 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)n(C)n2)[C@@H]1c1cccnc1 1808413379 AGOLICAOVZBYDJ-CUVSIRLISA-N 478.513 0.974 50 20 JCGD CC(=O)NCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808416840 SCJAEZTVTANYPX-LCSGYEPOSA-N 453.503 0.358 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc2nonc2c1 1809127136 PVJAPTJVUPTFPI-AVRDEDQJSA-N 471.282 0.931 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1F 1810300118 XCODELBETGWOBI-KXBFYZLASA-N 480.504 0.895 50 20 JCGD CCc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n[nH]1 1810301835 CWIAPXJHYGEPIL-YWZLYKJASA-N 462.514 0.999 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@@H]1c1cccnc1 1810302786 NAGXZEGWUNRFMJ-IIBYNOLFSA-N 490.524 0.693 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813068696 PZPULNUXZPVHRD-AZKGVKDRSA-N 456.547 0.319 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@H]1c1cccnc1 1813072228 CFNVARACJNEKHS-UXTKMKBZSA-N 457.579 0.932 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1814170439 SOMCTCBIAHCKDW-UYAOXDASSA-N 467.331 0.670 50 20 JCGD CNc1nsnc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1814431320 FBWMYNXFABIOQJ-AWEZNQCLSA-N 455.309 0.602 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350009 DGHIBNSGBBDHAJ-SWLSCSKDSA-N 488.375 0.962 50 20 JCGD O=C(/C=C/C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)NCc1ccco1 1815357062 XPMTYVXFAROVAW-ROJDOSBLSA-N 494.338 0.514 50 20 JCGD O=C(CCBr)Nc1cc([C@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1 1816781885 MTMAYSWOTHWGCB-CQSZACIVSA-N 476.397 0.917 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822416566 IEDHKKKIGVGVIP-MSOLQXFVSA-N 487.565 0.245 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1824525138 TVIAKRTUOZUNGU-JXFKEZNVSA-N 464.393 0.280 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1824598908 OGCTVZJNFKCXCY-SMDDNHRTSA-N 461.305 0.610 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1824613597 YBMKVZOQPZSPAC-NEPJUHHUSA-N 455.537 0.990 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1828263308 ZKTBNMOAFYSPMZ-KDOFPFPSSA-N 492.366 0.867 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(C(=O)O)ncn2)CC1 1828925070 DEJAUWGICUMRQH-IBGZPJMESA-N 481.513 0.720 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2CCOCC2)CC1 1828926074 ZMBRTKJIBHLRQO-NRFANRHFSA-N 472.590 0.641 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C#CC(=O)O)C2)C1 1829339741 ASEDRMJYPHZDKW-FDDCHVKYSA-N 491.928 0.780 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)NCCC#N)C2)C1 1830537309 DDFUNJUZJHWEAL-HNAYVOBHSA-N 459.385 0.756 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)CC1 1831829936 DMMXLXUTUBWVLJ-GDBMZVCRSA-N 450.927 0.905 50 20 JCGD O=C(CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)N1CCCC1 1832424897 SHWYWGDDCCLVOV-SJLPKXTDSA-N 464.332 0.536 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C)cn3)CCO2)C1 1832991061 JYPPFDRGNMXWTP-GQUZIAHASA-N 496.568 0.913 50 20 JCGD O=C(C1CCN(Cc2ccccn2)CC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833108897 PTHMWDSEDYLFKV-OFNKIYASSA-N 480.993 0.350 50 20 JCGD Cc1cncc(CCC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834797294 BUBIVJVPJOLSGI-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801247 VRWWWDUSPCVOCT-GOSISDBHSA-N 479.390 0.447 50 20 JCGD O=C(Cc1ccccc1Cl)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835011375 LJRRUKOGQWRCMI-HSZRJFAPSA-N 472.734 0.333 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ccon3)CC2)CC1 1835118345 RWJAEWNOSPEYRV-MFKUBSTISA-N 455.519 0.994 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc(O)ccc1O 1836469788 PAWLXWFAKWEGOD-UHFFFAOYSA-N 467.331 0.277 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837458882 FWZCEUKUSWAAGU-VLSFKVKESA-N 483.525 0.760 50 20 JCGD Cc1ccc(SCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837458887 FZSZLTULKHYIPD-XMMPIXPASA-N 499.593 0.856 50 20 JCGD COC[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054018 CBGRVFHPSIONJR-CYFREDJKSA-N 491.589 0.072 50 20 JCGD Cc1cccc(Cl)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839338957 HUOXOALBGJIUDC-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)COc1ccccc1F)CCO2 1839970283 NXSIBFGBSBAZPG-QFIPXVFZSA-N 466.510 0.034 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840033078 SGRSHKBINJNOOS-RDTXWAMCSA-N 459.341 0.383 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1840033349 AYGQEBWHRVDIJR-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OC)c(NC(C)=O)c3)C2)C1 1840154172 NXMYQBFPEDGJFX-VGSWGCGISA-N 483.949 0.977 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c2cc(O)ccc2n1 1840184555 VCAWFXSLOSHCTC-RUZDIDTESA-N 499.568 0.692 50 20 JCGD O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1 1840188361 FYQWRLNCQYAXGO-RBUKOAKNSA-N 458.298 0.981 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)C1 1841509293 FGPTWYLFEBSMOB-UHFFFAOYSA-N 462.271 0.747 50 20 JCGD COC(=O)N(CC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)Cc1ccccc1 1844265198 FNZSGZBDPVMJHN-UHFFFAOYSA-N 480.525 0.771 50 20 JCGD COc1cc(/C=C/C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc(OC)c1OC 1845949391 BWGBKZAEYBCGAN-CMDGGOBGSA-N 480.326 0.923 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 9930753 FVUVILWWHFYTLG-SFHVURJKSA-N 479.580 0.823 50 20 JCGD O=C(NNC(=O)c1cccnc1N1CCOCC1)c1ccc(S(=O)(=O)N2CCCC2)cc1 14347808 HUSHSOSAIHMSFB-UHFFFAOYSA-N 459.528 0.778 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CCc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 17163029 AQXGMGBDULAMSE-UHFFFAOYSA-N 457.512 0.848 50 20 JCGD CS(=O)(=O)Nc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 23239095 LHQYESLLAGFICC-UHFFFAOYSA-N 482.540 0.154 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2cccs2)C1 760982208 NXYDYLMSNQSUNC-ZDUSSCGKSA-N 470.529 0.758 50 20 JCGD O=C(COC(=O)CCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 792900598 SWLSYDHRKDHZTN-UHFFFAOYSA-N 454.395 0.975 50 20 JCGD COc1ccccc1N1C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1=O 849206012 XLQFEZYIPJLWSL-KUHUBIRLSA-N 469.450 0.579 50 20 JCGD Cc1nn(CCC#N)c(C)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 906448243 JAXJHWMSYBVZSZ-UHFFFAOYSA-N 488.570 0.828 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)S(C)(=O)=O)c1 916095691 MBWKRKIMHSPGON-LBPRGKRZSA-N 455.514 0.690 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1n[nH]c3c1CCC3)N(S(C)(=O)=O)CC2 916159426 SWYSNPMSDHQKOK-INIZCTEOSA-N 477.543 0.626 50 20 JCGD COc1cc(CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1O 916369955 UHOHSUFACWGWKH-UHFFFAOYSA-N 492.554 0.885 50 20 JCGD NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1 916624120 PYTOONCRZLAFAX-UHFFFAOYSA-N 460.560 0.377 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NC3CCCCC3)cc2)CC1 920221062 FOKCAOQZVSVWGT-UHFFFAOYSA-N 451.549 0.816 50 20 JCGD O=C(NCc1cccc(NC(=O)[C@H]2CCCO2)c1)NNC(=O)c1ccc(-n2cnnn2)cc1 920237518 KHYXFYNQIVWWCW-GOSISDBHSA-N 450.459 0.924 50 20 JCGD COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)CN4CCCC4=O)cnc32)c(OC)c1 920435623 LRTYXZFDCMROGB-UHFFFAOYSA-N 452.471 0.880 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H](C)n1ccnc1)c(=O)n2Cc1ccccc1 1324412826 ALMVJLPFGVYZOZ-QGZVFWFLSA-N 492.540 0.669 50 20 JCGD Cc1nc2ccccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030005 DGKYBDBYXDVUDJ-QHCPKHFHSA-N 463.498 0.399 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)n1 1779298931 QETIOUKRZSBPGW-OAQYLSRUSA-N 450.612 0.968 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1C(=O)C=CC1=O)C2)[C@@H](F)Br 1780770474 PADBOLOMJSYZPP-XHBKTUGNSA-N 460.300 0.506 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1cccc(Cl)c1 1780929276 AVXGXSLURTXIQY-QPPBQGQZSA-N 499.760 0.341 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334108 VJSWAWURZKYNRO-HKUYNNGSSA-N 499.374 0.593 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782788711 IKYIQZSSZQHQBA-UGSOOPFHSA-N 471.308 0.760 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(c4ccc(F)cn4)CC3)C2)C1 1782800530 YGDKUSLSHRTVPZ-DEOSSOPVSA-N 490.580 0.640 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1783355140 LEYDZYIBGAOBLR-PXNSSMCTSA-N 495.411 0.686 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)c1cccc(Br)c1)CCO2 1783935173 QHZVODKWMOHDRX-CTNGQTDRSA-N 497.390 0.685 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCc3cccnc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786982134 OSLDRFUZZYILKG-BVSLBCMMSA-N 451.332 0.378 50 20 JCGD O=C(CCN1CCOC1=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788145755 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COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2cc(C)c(O)nc2=O)[C@@H]1c1cccnc1 1813038374 YNGVKUFQVOQGRF-SOLBZPMBSA-N 463.922 0.612 50 20 JCGD CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nn1C 1815360659 LQGHCXNBOLCVDU-CQSZACIVSA-N 453.333 0.658 50 20 JCGD Cn1cc(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cn1 1815431253 LFRYMSBSHHXLAO-MRXNPFEDSA-N 453.333 0.415 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccccc3=O)sc2C1 1815447444 CDHHJQBXUNECLU-GFCCVEGCSA-N 467.511 0.229 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cccn4c(O)nnc34)sc2C1 1816968746 UCOBLZXARJBVFR-NSHDSACASA-N 472.531 0.490 50 20 JCGD COCCn1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)n1 1818262055 QQQDVITYMMPMAS-QGZVFWFLSA-N 460.539 0.932 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793398 MLMRTPNWEYWXTF-QWHCGFSZSA-N 468.543 0.900 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nc3ncccc13)CC2 1819797734 YWQBRZFOWHJPIJ-SNVBAGLBSA-N 477.510 0.953 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)[nH]n1 1822410210 BWCXNFYDSWUYKY-HNNXBMFYSA-N 459.507 0.090 50 20 JCGD O=C(c1cc(O)nc(O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055410 YYNMMZLGBQZBGA-IBGZPJMESA-N 453.304 0.720 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1830540246 PGYBVVSELVYUNY-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1830698353 AFNXCBQWIFXUER-DLRJPAPCSA-N 460.955 0.412 50 20 JCGD O=C(CCCN1C(=O)c2ccccc2C1=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724746 BJUHWWVWJVBWGG-JPYJTQIMSA-N 493.944 0.119 50 20 JCGD CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830737666 HTOGLRGGLMNXQX-JLHGSKIFSA-N 492.013 0.982 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1831659176 NVPAMWLEWPZNFL-UGSOOPFHSA-N 464.009 0.711 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn(C)c3=O)CCO2)C1 1831892940 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O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@@H](O)c2cccc(Br)c2)C1 1845040764 WNAZBGUBWYBYCC-SFHVURJKSA-N 473.132 0.680 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C)C2 1846364715 GHCKVLDVTCXYKW-HUUCEWRRSA-N 496.026 0.772 50 20 JCGD CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)ccc21 15248309 YNVDKKCCDHGHNQ-UHFFFAOYSA-N 465.557 0.820 50 20 JCGD O=C(CN1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1)NCc1ccccc1 21434638 PNMXECCXHWQAOD-UHFFFAOYSA-N 454.487 0.290 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(CN3C(=O)CNC3=O)c2)c1 26745988 WUIRNYJVCQPEES-UHFFFAOYSA-N 459.484 0.064 50 20 JCGD Cc1sc2nc(CC(=O)NNC(=S)NCc3ccc(S(N)(=O)=O)cc3)nc(O)c2c1C 726438526 AHUGLDUNNCTRGQ-UHFFFAOYSA-N 480.597 0.899 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)Cn1ccc2ccccc21 729450192 OSUCRABDVKBZTI-SFHVURJKSA-N 492.579 0.571 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 730821706 ZYBYUJUYDVZPDW-MRXNPFEDSA-N 478.527 0.759 50 20 JCGD Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1C 913606513 ZUBRWKFIOQEVQR-UHFFFAOYSA-N 494.595 0.827 50 20 JCGD Cc1oc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1S(=O)(=O)N1CCCC1 916133536 WQDBOEYCBPABSW-UHFFFAOYSA-N 490.947 0.748 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCCN1CCCCC1 916195988 JIGBHHYHUILUJX-UHFFFAOYSA-N 481.619 0.847 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCNC(=O)c3ccccc3Cl)nc2)CC1 916263553 JTKXUHKYJIJWOH-UHFFFAOYSA-N 495.993 0.727 50 20 JCGD O=C(NCCN1CCN(c2ccc(F)cc2)CC1)NNC(=O)c1csc(N2CCOCC2)n1 916513777 RRVOLOKPKIMUNY-UHFFFAOYSA-N 477.566 0.885 50 20 JCGD Cc1nn([C@@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)Cc1csc(N2CCOCC2)n1 1321405518 ZJPMUCHKQIFESJ-MRXNPFEDSA-N 466.589 0.845 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSCC(=O)O)C2 1778094141 BJFWQUMAUPPIOZ-LXPZDEJYSA-N 479.559 0.452 50 20 JCGD CO[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1779031247 OYRFAXCCOKEZOG-XXBNENTESA-N 453.499 0.516 50 20 JCGD CC(C)n1nccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372195 ACGXSXAUUXMYQF-AUSIDOKSSA-N 469.546 0.904 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)nn1 1779374605 RNGZPIMQQYLNEQ-WZONZLPQSA-N 483.529 0.315 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CS(C)(=O)=O)CCO2 1780095174 IKKGCHNZRIGIEF-SZNDQCEHSA-N 497.526 0.644 50 20 JCGD COC(=O)C1(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cc([N+](=O)[O-])ccc4OC(C)=O)C3)C2)CC1 1780098138 CWRGXPCLYHRYTC-OAQYLSRUSA-N 475.454 0.917 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780770606 VDLUIIYMRKOYQY-RSUWNVLCSA-N 472.377 0.519 50 20 JCGD CCN(C)[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1781452404 LBFPJMLDRLUQFJ-JETUKDQUSA-N 460.579 0.975 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C1\C(=O)Nc3ccccc31)C2 1782215120 UAMRULBWKOVFBU-GGHGQZRTSA-N 483.569 0.909 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccc(Cl)cc3)C[C@@H]21 1788607796 IVUREKPOOLRQNK-JVPBZIDWSA-N 485.928 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)cc3F)C[C@@H]21 1788610268 VGJBQLBLDJNNDR-KHDYIWLOSA-N 459.453 0.870 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791292432 QQLFALRDJTXJIC-VJANTYMQSA-N 493.605 0.256 50 20 JCGD COc1ccc(F)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1791954725 HVESBANNFADAHZ-FNHZYXHNSA-N 450.511 0.801 50 20 JCGD CCN1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)CC1 1792292797 JPOBWYCLGWMNFH-HDHADGOUSA-N 472.590 0.832 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792975216 MCUDXNWJDMDBCC-YFUQURRKSA-N 497.980 0.364 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793595138 LQPWMHOWRAUEDT-PIKOESSRSA-N 487.362 0.039 50 20 JCGD CCOc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796439852 IDQNYBMTTLCEOY-SIQZSBGDSA-N 468.514 0.818 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCOCC2)cc1)c1cccc(B(O)O)c1 1796944758 CGNXEUQTVJAJIV-UADZTWIMSA-N 463.343 0.769 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(=O)OCCO 1798568102 WFQFPGFGGXLNPO-LTCOOKNTSA-N 454.907 0.293 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCNC(=O)OC(C)(C)C 1799353445 DERCYSXBIOOJRZ-NPJQDHAYSA-N 463.959 0.106 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cn1)C2 1800757659 HXQFLFPBGZJVNP-ZXFNITATSA-N 467.364 0.905 50 20 JCGD CC(C)C(=O)Nc1nc(O)c2ncn(CC(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)c2n1 1801458750 WMOXEODMVKCYED-CRWXNKLISA-N 493.952 0.364 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc([N+](=O)[O-])o1 1802258346 DOYZSXUBAWRBSR-JXFKEZNVSA-N 464.243 0.896 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1803791581 PEULOSOLSCDJRG-KNQAVFIVSA-N 461.331 0.745 50 20 JCGD CN(C)CC(=O)NC[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1806458209 AMYZRVYWVDILEU-XUZZJYLKSA-N 481.601 0.995 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)CC1 1807087070 OUSUZADLQSDFPP-KRWDZBQOSA-N 494.357 0.218 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2[nH]nc3ccncc23)[C@@H]1c1cccnc1 1808101830 HHTSWMSKUFBFPY-BTYIYWSLSA-N 485.508 0.985 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(C(=O)Cn2cnnn2)[C@@H]1c1cccnc1 1811358474 GYJUMNCLNFELBA-HRAATJIYSA-N 494.468 0.921 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnc2c(c1)CCNCC2 1812378815 DYVOTOKIPCDASC-PXDATVDWSA-N 499.380 0.478 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817471096 RNWJHCQPQFTIOG-HNAYVOBHSA-N 450.308 0.928 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1)c1cccc(B(O)O)c1 1817477124 MRVRVXDSQNFMKL-KRWDZBQOSA-N 494.273 0.166 50 20 JCGD CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1819515334 YUIIBODTFHMZQV-PCQWEPPDSA-N 464.573 0.526 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)Cc1cscn1)CC2 1819796952 JXUDSMNAPBESDL-HZMBPMFUSA-N 486.583 0.394 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1819899244 SNWKFLRJJBUAEA-MGJNZBDHSA-N 472.332 0.578 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(CCO)CCO)n[nH]1 1822023496 RDEJYPFNQNWOGO-UKRRQHHQSA-N 460.373 0.719 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)[C@@H]1SC(=N)NC1=O 1822414252 ORBBGLTUDPYRCJ-PPHDSNJXSA-N 478.579 0.577 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)C3(Br)CC3)sc2C1)c1ccc(B(O)O)cc1 1823024227 QKQKEYBYXFBRHG-LBPRGKRZSA-N 464.150 0.976 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1825127828 WQVDPPXIYRQGGI-HXUWFJFHSA-N 469.307 0.405 50 20 JCGD Cn1cccc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1=O 1827050659 STIZNVXPESTAHT-NRFANRHFSA-N 451.332 0.612 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827058243 UQTKJYZCGVRECX-OAQYLSRUSA-N 451.332 0.612 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCOC2=O)CC1 1828384272 QRLQGKRYCQHPCT-LJQANCHMSA-N 472.546 0.761 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C3CC3)C2)C1 1829000325 GOSPNNXWYHCXEM-AREMUKBSSA-N 491.353 0.842 50 20 JCGD O=C(COCCO)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829055766 BJZVNEPHZVUVKN-NQIIRXRSSA-N 471.913 0.982 50 20 JCGD C[C@H](O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829321364 DNPDQIJHVTVEBI-WJPUGNRLSA-N 453.923 0.419 50 20 JCGD CNC(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1831279428 IYBGHSAXVRSQND-UWJYYQICSA-N 482.375 0.585 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(N4CCOCC4)cn3)CC2)CC1)[C@H](O)CCl 1833308552 VDXNFZIHIYERRR-OAQYLSRUSA-N 480.009 0.703 50 20 JCGD CN(C)c1cncc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834800126 WYEKLTHJHCAZTJ-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD C=CCO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835734431 HCHOACJQSDGDJN-INIZCTEOSA-N 458.563 0.461 50 20 JCGD O=C(/C=C/c1cc2ccccc2o1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937445 XGMUMIAMGMTPIT-MXINKLCTSA-N 490.321 0.896 50 20 JCGD O=C(c1ccc(F)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939745 ZQTZJGYIRQFENZ-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837319926 NNLPRGFBTCZQDN-IAQYHMDHSA-N 475.258 0.722 50 20 JCGD CC(=O)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802322 SNZRYBGEEFQELN-GHTZIAJQSA-N 482.375 0.585 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1839995354 LXCFFBVTODSGNL-DRUWVYPFSA-N 480.326 0.158 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1 1840033413 CMGVLVPKLALBHO-SGTLLEGYSA-N 452.309 0.811 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1 1840155339 YPXJFAQGHXSAIB-HRAATJIYSA-N 461.906 0.758 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4sccc4[nH]3)C2)C1 1840184457 NWHQDRJGUXWUTB-NRFANRHFSA-N 463.560 0.672 50 20 JCGD C#CCCCCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1840293006 BCRGXCORIAONEF-DMUURETOSA-N 457.531 0.770 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(O)c1 1840669092 YWNIXXOCNKGSMD-HSZRJFAPSA-N 469.498 0.083 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1847965792 RHHFVOMWYCAVOU-JXQFQVJHSA-N 471.363 0.971 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CNCP(=O)(O)O 1848099145 HCLPJGZKMRLOIS-AVGNSLFASA-N 468.875 0.045 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)[C@@H](C)O)cc1C 9084207 SEUXSOZDACVBSM-AUUYWEPGSA-N 497.957 0.989 50 20 JCGD CN(C)N(C(=O)CS(=O)(=O)Cc1cccc(Br)c1)[C@@H]1CCS(=O)(=O)C1 728162291 VGSUTKPKZLQWBQ-CQSZACIVSA-N 453.380 0.856 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1 728381565 OPXXWWUNCQMLGD-RDJZCZTQSA-N 471.557 0.015 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(CCNS(C)(=O)=O)s2)n1 753850645 GPGKFSMJALWCQB-UHFFFAOYSA-N 460.559 0.152 50 20 JCGD O=C(COC(=O)CNC(=O)c1cccc(Br)c1)NNC(=O)[C@@H]1COc2ccccc2O1 802067643 YAQXEIWTVYDTOW-INIZCTEOSA-N 492.282 0.710 50 20 JCGD COc1cc(C(=O)NNC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)ccc1OC(C)C 912953177 TYEJGWYYEYGNQH-LSDHHAIUSA-N 453.517 0.279 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)c1cccc(S(N)(=O)=O)c1 916197195 OJFVZMGUVDJACF-AWEZNQCLSA-N 495.583 0.824 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@@H]1CCN2CCCC[C@@H]12 916639688 WYWCEECMGASDJH-UXHICEINSA-N 479.603 0.597 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(O)c(C(=O)OC)c2)c1 917718302 REVQHPFPACEZBV-UHFFFAOYSA-N 485.540 0.833 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC1CCOCC1)N(S(C)(=O)=O)CC2 918233217 HKVBSHABDRHILC-INIZCTEOSA-N 470.548 0.462 50 20 JCGD Cc1cc(N2C[C@@H](C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)CC2=O)ccc1Br 919884062 DPTPEHAKGNHVSH-RYUDHWBXSA-N 473.349 0.628 50 20 JCGD C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919887078 XKEBBDDFPXMGQD-HTQZYQBOSA-N 453.340 0.146 50 20 JCGD Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(F)(F)F 1318268234 XODTXDGXCVIQLK-GOSISDBHSA-N 470.456 0.597 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nc3ncccc23)C1 1777914377 UJMHGEOYULKKOP-OPAMFIHVSA-N 457.535 0.458 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnn(C)c1)C2 1778094388 HJWSUMKYNZRNRA-PZOAEKQQSA-N 469.546 0.611 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)CC1 1778351520 FEASJNMMOWPALA-KXBFYZLASA-N 459.385 0.011 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1Cc2ccccc2O1 1778836850 ONTPCMOZQAHANJ-TZBSWOFLSA-N 464.327 0.498 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032315 NDDYXANMGGXFSH-WAIKUNEKSA-N 452.515 0.629 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(CO)c(F)c3)CCO2)C1 1779035540 IZHPRXROOIFPES-JOCHJYFZSA-N 457.462 0.074 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)nc(Cl)c1)C2 1779371009 GHOOSEPLKZIVEE-OPAMFIHVSA-N 488.932 0.880 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@H]3CCC(=O)N3C2)C1 1780609684 BUSFWIUXQSMUTP-YBJWPOLQSA-N 477.606 0.274 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1 1781472870 OTQOCXCRWQPVFH-FQEVSTJZSA-N 454.911 0.568 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(C)c1C(F)(F)F)C2 1782209061 IXCFRUUMHUAQCS-FOIQADDNSA-N 488.511 0.939 50 20 JCGD 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CCn1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)c2ccccc2c1=O 17190914 GVXCBGCWWQHGIN-INIZCTEOSA-N 499.549 0.949 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCCN(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1 17523410 HYNAQWJPAWWLQY-UHFFFAOYSA-N 480.503 0.357 50 20 JCGD Cn1ncc2c(=O)n(CC(=O)NNC(=O)c3nc(-c4ccccc4)n(-c4ccccc4)n3)cnc21 21439309 VKGFFBCRGZSJKS-UHFFFAOYSA-N 469.465 0.839 50 20 JCGD COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c(OC)c1 725874100 VRTXMESJSFCZRI-UHFFFAOYSA-N 475.527 0.694 50 20 JCGD CCn1cc(NC(=S)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1 726121744 LIPNAAFITFZBSW-UHFFFAOYSA-N 466.589 0.874 50 20 JCGD COC(=O)N1CCC[C@@H](NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 726717497 XZQOCPNFAKLDFN-QGZVFWFLSA-N 497.574 0.201 50 20 JCGD O=C(NNC(=O)N1CCCN(Cc2cscn2)CC1)c1csc(N2CCOCC2)n1 727473351 JGJUEKRTMSHLMD-UHFFFAOYSA-N 451.578 0.999 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(S(=O)(=O)N(C)C)o3)cc2)CC1 728214069 LAXDDQMTIIJSQR-UHFFFAOYSA-N 471.561 0.223 50 20 JCGD C[C@@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cn2)C[C@@H](C)O1 728324141 QGFNEFFJOFIWMU-SPYBWZPUSA-N 470.482 0.839 50 20 JCGD Cn1c(CCC(=O)NNC(=O)NC2CCCC2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 744053971 KCOBXNWESQHVSY-UHFFFAOYSA-N 478.575 0.800 50 20 JCGD CS(=O)(=O)c1ccc(OCCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 746516607 OMQSQNCUSVXUCX-UHFFFAOYSA-N 454.530 0.613 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)cc1 861779574 ZFAWSBPYUFBLOY-UHFFFAOYSA-N 480.510 0.128 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 869796084 BCVOUIUHSJUOOD-UHFFFAOYSA-N 483.568 0.937 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1 914710970 NTMDWWVAHSHCQE-UHFFFAOYSA-N 488.316 0.903 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886118 UTVZQAYZAHXVNB-KRWDZBQOSA-N 486.616 0.701 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)CN2C(=O)c3ccccc3S2(=O)=O)c2ccccc2c1=O 921193444 OZEVIFNSEISGHT-UHFFFAOYSA-N 469.479 0.583 50 20 JCGD CCCNC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Br 1320186477 JRGWDVWEDUUEJI-CYBMUJFWSA-N 463.354 0.723 50 20 JCGD C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2)N1C[C@H]2C[C@H]2C1 1779251855 RYEIAZIQEOCVKF-IQHXESNCSA-N 470.574 0.153 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2 1779374597 QWMQMIUUAIIATF-IIBYNOLFSA-N 471.474 0.363 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@](C)(Cl)CCl)C2)CC1 1780712947 ZUMICTJKEQJEEK-JRGCBEDISA-N 477.433 0.901 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1780905415 UWKXHLQYGDQRCW-OYLFLEFRSA-N 498.515 0.086 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)Cc3cccnc3)CCO2)C1)NC(=O)NCc1ccccc1 1780968845 FVUPDVOCLNXVHI-RUZDIDTESA-N 480.569 0.800 50 20 JCGD CC(C)O[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969063 UQNTUEAIAILUSY-YADARESESA-N 475.590 0.976 50 20 JCGD Cc1cnoc1C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969345 XTBURKHRAIFNRR-QHCPKHFHSA-N 470.530 0.773 50 20 JCGD C[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccc(O)cc1 1781261058 FTAOZUJVQXNISW-CMJOXMDJSA-N 453.499 0.638 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1 1782018490 BAYJJOAEBCEFOP-JOCHJYFZSA-N 455.519 0.084 50 20 JCGD COc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1F 1782208925 BECMRLQEBFZEHY-VGOFRKELSA-N 465.526 0.730 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1783354956 ZNGSQNOCUVXZKE-MEDUHNTESA-N 464.407 0.850 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1 1784241859 QJXQQAQGLCCZIL-SQJMNOBHSA-N 471.602 0.854 50 20 JCGD O=C(C[C@H]1OCCc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784398235 RLLMCVYCHNQACX-LSUHJGNXSA-N 478.354 0.664 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cc[nH]c4cc3F)C[C@@H]21)c1cccc(B(O)O)c1 1786984775 IERAZXJXPKKXIZ-BPXKWBHBSA-N 465.290 0.894 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@H]1SC(=N)NC1=O 1787500465 JZTZGRRJYYKCFL-DCHHYWPUSA-N 465.345 0.459 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C[C@@H]21 1788610952 CEWOKZCXVFTZCG-BXYJTDFISA-N 494.552 0.542 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSC(=N)N)C[C@@H]21 1789222235 JBHBURDZZIHYMB-NUTKFTJISA-N 479.515 0.740 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(C)CN(C(=O)OC(C)(C)C)C3)C[C@@H]21 1791291536 XKKUWEAGLZYPCI-BZSNNMDCSA-N 495.621 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCCO4)C[C@@H]21 1791291550 YLJLZRRRYGENEV-ONTIZHBOSA-N 472.586 0.907 50 20 JCGD CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1793453621 MXYWDTPLFDMCIG-MOAIGLLQSA-N 487.022 0.164 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccnc1-c1ccccc1 1796566219 YEHCSCWFQLOZIT-JHDGKUDLSA-N 471.322 0.945 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)ccc1[N+](=O)[O-] 1797753910 ARTLHRUZIXIZTB-HBCWATKFSA-N 484.469 0.119 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1 1799346993 CHGCXCPOIUDDPF-ZMJPVWNMSA-N 464.313 0.379 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCCN1C(=O)OC(C)(C)C)C2 1801011723 YDQNWYLHIGMZRR-NYUBLWNDSA-N 495.621 0.739 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCNC(=O)C1)NC(=O)NCc1ccccc1 1802450538 JGQDFROHGIROAP-YSTOQKLRSA-N 470.574 0.497 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1803870854 ZHJXFANWQDNDNM-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD COc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1805207764 GFWGTLZYBNCFJE-GCJKJVERSA-N 460.299 0.798 50 20 JCGD CCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1805905682 OULYVLDPEMMUGE-JXFKEZNVSA-N 462.514 0.930 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C2CCC(O)CC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364358 FDPWVIUTURPJJC-LBDKCUJNSA-N 451.332 0.632 50 20 JCGD COc1ncc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc1F 1807369860 XJTWJQYCFAMFKK-LAUBAEHRSA-N 478.289 0.938 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1809227268 UQKSLEUGTHKPGI-XXBNENTESA-N 461.331 0.664 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1 1810793725 PGDSGICEKZLOFG-IBGZPJMESA-N 456.377 0.238 50 20 JCGD CC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1812649769 NIVUPOTXEPJFBG-OAZHWWMHSA-N 467.530 0.746 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1813028794 WEGJXSUXCYVKFJ-LNLFQRSKSA-N 472.995 0.072 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2cncnc2)[C@@H]1c1cccnc1 1813071911 VZINIJFVJMODOA-WMZHIEFXSA-N 453.547 0.883 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@H]1c1cccnc1 1813319563 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CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccnc3c1OCO3)CC2 1826088086 RNVVHGNENKBPCB-LLVKDONJSA-N 460.516 0.866 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830720360 XWPHKEWJWBMWJA-YYDVJCTNSA-N 481.977 0.641 50 20 JCGD CN1Cc2ccccc2C[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830725576 KCSXTGUWIOIOKN-DXIQSLLYSA-N 451.951 0.099 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726008 NELWJJOGEQDZAJ-XQBPLPMBSA-N 452.935 0.747 50 20 JCGD Cn1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccc1C(F)(F)F 1830727674 AUAPCCMYMBDKRW-CXAGYDPISA-N 453.845 0.714 50 20 JCGD COc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(OC)c1 1830735275 FRNCVYQETQCJNY-XMSQKQJNSA-N 470.950 0.693 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnc[nH]3)C2)C1 1832549274 LBEHFVWBCMFFCA-HTAPYJJXSA-N 499.996 0.931 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CN3CCNC3=N)CC2)CC1 1833261973 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CCOC(=O)N(CC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)Cc1ccco1 1846530738 NTRJPLMXVDALPS-UHFFFAOYSA-N 484.513 0.754 50 20 JCGD COC(=O)CSCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1 1847815845 OEIHIXMQHOAUAB-ROUUACIJSA-N 477.587 0.441 50 20 JCGD CCC[C@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1 1847869157 NJJHHCCIZKTMTD-UVPYHEFZSA-N 456.996 0.776 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CS(=O)(=O)N1CCCC1 1848100147 RMHHDVCWVYIHBK-JYJNAYRXSA-N 493.026 0.746 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1 15639694 UFNLLCQWWNSLEX-GOSISDBHSA-N 483.612 0.548 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C 24932982 LLXUPBSIKHKHJS-UHFFFAOYSA-N 482.584 0.635 50 20 JCGD NS(=O)(=O)c1ccsc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 800037226 UZWKFMZEJICFNS-UHFFFAOYSA-N 472.570 0.645 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccc3nn[nH]c3c1)N(S(C)(=O)=O)CC2 812188471 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CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCCc1ccccc1F)CCO2 1830698521 JARRPJYXQUCQAW-DEOSSOPVSA-N 478.565 0.978 50 20 JCGD O=C(Cc1ccc(Br)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833107033 TWZXRKDMZLTXBB-YJBOKZPZSA-N 476.755 0.443 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1833263159 DHBWFWSFXQVGFR-XJKSGUPXSA-N 460.417 0.182 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)c(C)n1)CCO2 1833462187 CABCLCVWVURENX-PVPASAESSA-N 486.504 0.733 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801429 IOIGTUCXBGSBSL-UHFFFAOYSA-N 492.385 0.824 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cncn3)CCO2)C1 1836139571 LNIPDPAMBRLOBT-DVQZYHKASA-N 472.452 0.620 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C)CN(C(=O)OC(C)(C)C)C1)CCO2 1836726991 WCBWOSZAQWRYHK-OPAMFIHVSA-N 489.997 0.954 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccc3F)C2)C1 1837455614 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CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840006963 ZTEQGRGSSTZMOY-MCFFVMPBSA-N 487.981 0.300 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1840151267 XIVBCHLXWJMTCC-KUHUBIRLSA-N 459.952 0.188 50 20 JCGD Cc1ncccc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840182303 FYLXWRQEFCRWCA-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD COc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)cc1 1840183655 RKAWFXOMEYPFQT-XMMPIXPASA-N 476.574 0.457 50 20 JCGD O=C(c1ccc2nc(Br)nn2c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011149 WHVDZSOECGNBRU-UHFFFAOYSA-N 484.119 0.302 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCN1CCN(C)CC1)C2 1844692261 BWPDRUTUGYOGJQ-UHFFFAOYSA-N 473.530 0.975 50 20 JCGD CCn1c(=O)n(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c2ccccc21 10768375 RUTQJMUXSRPJHM-UHFFFAOYSA-N 451.892 0.585 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)COc2ccc(C#N)cc2)C1 16225123 HHGRTICBUZFJNA-MRXNPFEDSA-N 461.500 0.790 50 20 JCGD CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)CNC(=O)c1ccco1 725740495 WGUWCJUMHKTQKB-LJQANCHMSA-N 494.526 0.321 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)C2CCN(c3ncccn3)CC2)CC1 728783233 FNKBIHWXUFCVJB-UHFFFAOYSA-N 460.564 0.990 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cccc(CN2CCS(=O)(=O)CC2)c1 728845464 ILXNRPUSXGBUFC-UHFFFAOYSA-N 472.571 0.385 50 20 JCGD NS(=O)(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccc3)CC2)cc1 733369302 HTENCBLFYAPGTJ-UHFFFAOYSA-N 466.541 0.196 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)CCc2ccco2)o1 748265552 KWYJFAWUAUNWJJ-CQSZACIVSA-N 453.473 0.983 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 750216156 RCGDJIWDKOQQDW-KBXCAEBGSA-N 477.495 0.192 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(F)c2)cc1 751260519 CKDYUXGYIWQOID-UHFFFAOYSA-N 489.503 0.228 50 20 JCGD COc1ccc(CC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1S(=O)(=O)N1CCOCC1 770406278 MOXSFWKEDGYDAD-UHFFFAOYSA-N 491.522 0.491 50 20 JCGD Cc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)cc1 844154043 RPWVWFHKPNCUDN-XLIONFOSSA-N 467.478 0.874 50 20 JCGD COc1ccccc1N1C[C@H](C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1=O 849206413 MSKNBOWNHBOHQC-CQSZACIVSA-N 456.411 0.961 50 20 JCGD O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)c1csc(N2CCOCC2)n1 912852063 GUSKUGWZKXATNP-UHFFFAOYSA-N 473.964 0.763 50 20 JCGD Cc1c(/C=C(/C#N)C(=O)OCC(=O)N(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc(C#N)n1C 913286746 HHRPRRIVDQONEV-KBBYAXEGSA-N 474.539 0.850 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)NC3CCCCC3)c2)CC1 913451434 WWEFFGUKJXUUAH-UHFFFAOYSA-N 451.549 0.816 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC2CCN(C(=O)c3ccco3)CC2)cc1 916243733 AALWNCMBCKVDRI-UHFFFAOYSA-N 477.543 0.844 50 20 JCGD CCCS(=O)(=O)N1CCC(NC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)CC1 916383303 BZWQUJURZPYTGI-UHFFFAOYSA-N 476.625 0.942 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)ccc2NS(C)(=O)=O)c1 920410097 VDNQEWYFYUWSTN-UHFFFAOYSA-N 458.493 0.522 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CS(=O)(=O)N2CCCC2)C1 1778090329 OTULYVPTQXIAPS-FRQCXROJSA-N 450.001 0.943 50 20 JCGD C[C@@H]1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)O1 1778199265 APWXHTWVFJHTLG-DRMXPCRNSA-N 473.574 0.730 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccccn4)[nH]n3)CCO2)C1 1779032307 IXJHTVCKPPQUOI-HSZRJFAPSA-N 476.497 0.228 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3n[nH]c4cc(Cl)ccc34)CCO2)C1 1779032626 PKGWYEHAFMWHMH-HSZRJFAPSA-N 497.943 0.901 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1 1779037172 SSZZRCFMBXZFAX-DEOSSOPVSA-N 478.509 0.327 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1779094546 DCCAZPROUPEKKD-LETWNGEGSA-N 476.480 0.352 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1779394645 PUBJYQFQKXUQSN-GSHUGGBRSA-N 461.567 0.164 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc2snnc2c1 1780043558 QUYFYSHNTNKIPS-XMSQKQJNSA-N 481.343 0.207 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)c(O)c1 1780550973 LOJBHKWMANGBFK-JKJLQIMHSA-N 469.498 0.978 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1ccnc1 1780968135 AXBOWGIRYNEWHF-CYFREDJKSA-N 483.573 0.620 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)C(C)(C)C)CCO2)NC(=O)NCc1ccccc1 1780968651 IOFULNDNBZGMRP-RDPSFJRHSA-N 475.590 0.570 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N1CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C1)CC2 1782988900 WDMZEICLBBMKIL-FNZWTVRRSA-N 478.354 0.624 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(S(C)(=O)=O)CC3)CCO2)C1 1783533670 DPGHPFGERZDOKC-CXAGYDPISA-N 466.398 0.271 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)C(=O)C1 1785669594 MVFDHEJWRGAVGH-HXUWFJFHSA-N 493.388 0.699 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cccnc4n3)C[C@@H]21)c1ccc(B(O)O)cc1 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483.529 0.486 50 20 JCGD CCCNC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1803446474 FNYDTNYJJFNASI-WZONZLPQSA-N 460.579 0.767 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n(C)n1 1805641685 SWABCYKWCLORBX-JXFKEZNVSA-N 462.514 0.755 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1806346965 QHHUEOZTTWOZDO-VQIMIIECSA-N 457.369 0.159 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359672 BVWFHFIPIBUQMO-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc3c(n2)OCCO3)[C@@H]1c1cccnc1 1808184054 NMKCCHGQPCWRGX-VGSWGCGISA-N 482.541 0.940 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808205385 XHPOSIIUQPZMNU-DZFGPLHGSA-N 479.371 0.108 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1 1808297471 QPEQUAAHOFZXSU-QIXHDGCFSA-N 492.496 0.736 50 20 JCGD 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C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836398858 YZDRWOJWCRUJBD-OAQYLSRUSA-N 470.206 0.788 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1837379791 GVZRDTBSPPMEGH-XWIAVFTESA-N 453.367 0.387 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccsc4[nH]3)C2)C1 1837459575 KTRZQEYUOHZAHC-JOCHJYFZSA-N 484.538 0.612 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cnn4ncccc34)CC2)CC1 1837920421 WZBJVGZTDGFBRL-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD CN1CCC[C@@H](C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)C1 1837921262 REKSKHBBYUEDRM-LJQANCHMSA-N 457.380 0.320 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)N1CCN(C)CC1)CCO2 1839101280 MMEUAAIUNVUZEI-HLIPFELVSA-N 475.428 0.110 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198374 CVRRZIPIXDICJO-WMLDXEAASA-N 453.305 0.865 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3-n3nccn3)CCO2)C1 1839381208 GNKDMZYBADBIGC-LAUBAEHRSA-N 463.922 0.591 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CCO2 1839388394 PPFCEIBPXXJEOW-KSMMKXTCSA-N 494.383 0.459 50 20 JCGD COC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802020 KBEWRUDGJQUUOG-UTKZUKDTSA-N 498.374 0.805 50 20 JCGD Cn1ncnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802176 NPTJAJUIAFIWLO-UTKZUKDTSA-N 492.374 0.891 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1839804313 PFIBOAFBJTXXHN-CVDCTZTESA-N 495.960 0.311 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1839966190 XBKDZHKOKOXEFJ-VBKZILBWSA-N 494.346 0.333 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1840156165 ORQDNMNNBSRWHV-AVRDEDQJSA-N 466.966 0.094 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1 1840185923 UBAZBCKFVYKSNF-QFIPXVFZSA-N 468.501 0.337 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840251910 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CC(C)(C)OC(=O)NC12CC(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)(C1)C2 1846109334 JFQSBNBVMAWCRX-UHFFFAOYSA-N 469.347 0.631 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(Cc2ccccn2)CC1 1848245390 FVAPBNHTYKOYNO-GOTSBHOMSA-N 462.359 0.489 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(Cc2ccccn2)CC1 1848246715 DYNNHWIYSNUDOZ-VXKWHMMOSA-N 477.569 0.808 50 20 JCGD COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)cc1 9931193 CDLBVRMWDHVBOU-AWEZNQCLSA-N 467.525 0.692 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)cc1 26772738 KDBSRMRQFFZGKP-UHFFFAOYSA-N 494.595 0.826 50 20 JCGD NS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1Cl 725907160 BNJDOYUTXMXMJN-UHFFFAOYSA-N 465.963 0.961 50 20 JCGD C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)ccc2Cl)C1 728371732 DLMNFOOZMOPWEN-JSGCOSHPSA-N 477.992 0.956 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)c2cc(F)ccc2Br)cn1C 728546826 JDSBJMQEGWHAIL-UHFFFAOYSA-N 462.301 0.760 50 20 JCGD O=C(CN1CCCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1)NNC(=O)c1ccc(F)cc1 748088854 FEIHUIQLOLRUJY-UHFFFAOYSA-N 492.529 0.755 50 20 JCGD O=C(NNC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1)c1ccc(-n2cnnn2)cc1 748328928 NLOVNILWBKHABY-IBGZPJMESA-N 490.572 0.946 50 20 JCGD CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 749160009 QIEOTIKLBCGKOX-RHSMWYFYSA-N 464.569 0.668 50 20 JCGD O=C(c1cc(Br)cc(S(=O)(=O)N2CCOCC2)c1F)N1CC[C@H](B(O)O)C1 864231009 IMPFJSZUQZMWAX-JTQLQIEISA-N 465.106 0.298 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C/c1ccco1)c(=O)n2Cc1ccccc1 901413383 IBWKXJPSLBTZIS-MDZDMXLPSA-N 492.492 0.508 50 20 JCGD COC(=O)c1sc2ncc(C(C)=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)cc2c1C 914773655 ORZLNQYCQFUWGD-UHFFFAOYSA-N 476.540 0.816 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2ccc(-n3ccc(C(F)(F)F)n3)cc2)c(=O)n(C)c1=O 915957536 MCZLNJGOYVGKAQ-UHFFFAOYSA-N 467.433 0.926 50 20 JCGD CCN1CCN(CC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)C(=O)C1=O 916107996 ZUOQEJDZURQQOR-UHFFFAOYSA-N 454.483 0.483 50 20 JCGD 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CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1833497125 YOZYSXACDHJLJU-KPZWWZAWSA-N 471.308 0.418 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C3CCC(CO)CC3)CC2)CC1 1833723102 ZENRAGAYYKNDSM-UHFFFAOYSA-N 465.639 0.730 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cnnn3C)CC2)CC1 1833897625 UHHWUCPNNOKHTQ-CVKSISIWSA-N 469.550 0.134 50 20 JCGD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1 1834262976 PLELFNCRGUJRJE-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD O=C(c1ccc(C(F)(F)F)nc1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1834272919 ZJBUIYWLXWRKQX-CXAGYDPISA-N 451.829 0.770 50 20 JCGD COc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834801300 XENIDGQTABQVMQ-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2 1834823057 GYDCTVXHADGUDG-HLNVMSFQSA-N 462.341 0.757 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)n3)CC2)CC1 1835077787 RTDAOIOWEPQKOP-NSHDSACASA-N 456.341 0.856 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835933828 GQCKMEYXXIZVOF-KBMIEXCESA-N 466.343 0.315 50 20 JCGD Cc1c(Cl)cccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934052 LLPKOPIJRRXEIR-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)C2)C1 1835934457 TWDJDYXRUGZLOE-ZJBJCVSYSA-N 498.307 0.805 50 20 JCGD O=C(c1ccnc(C(F)F)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935656 XURRQEGKMHKNGF-QFIPXVFZSA-N 475.257 0.083 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3cnccc13)CCO2 1837031988 DZUADKLISAUOEW-VWLOTQADSA-N 475.310 0.298 50 20 JCGD CC(=O)O[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)C(C)C 1837222360 QMQYCKHTWNGSMN-GRDNDAEWSA-N 453.305 0.721 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1837713277 SAECYZSVNGIAFX-QFIPXVFZSA-N 475.574 0.743 50 20 JCGD Cc1cnc2c(C(=O)N3CCOC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cnn2c1 1837713371 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SDRBUGKTMAFWRP-HSZRJFAPSA-N 460.531 0.007 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)C2)C1 1840150581 NXTDKQLFUVOLHE-MRUHUIDDSA-N 477.986 0.857 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](COC)NC(=O)OC(C)(C)C)C2)C1 1840152579 MRKDXRHYBXSWGR-CKJXQJPGSA-N 493.985 0.236 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)COC4)C2)C1 1840184573 VVQPGWCUTKRVJA-HSZRJFAPSA-N 460.531 0.160 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185848 UBTHZBZUTNAMQP-ILAWTMEDSA-N 462.547 0.821 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840960814 UTICWFDNOCNNPL-YCRPNKLZSA-N 477.986 0.593 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)CC2=O)c1 1841009945 SUDIQTDMMYXDKM-QGZVFWFLSA-N 471.558 0.625 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1 1841347842 AWSOFJAEOGKOHF-AVYPCKFXSA-N 459.971 0.798 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)cc2NC1=O 1844264696 XZXFEYQQBFWSDP-ZDUSSCGKSA-N 464.482 0.535 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nn[nH]c2C(F)(F)F)C1 1844806773 HLWRMWBQRUMGJS-AUEPDCJTSA-N 452.397 0.775 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CNC(=O)[C@]13CCN(C(=O)OC(C)(C)C)C3)C2 1846365836 XSXSMFAPXBHCDV-KXNSMUHISA-N 499.008 0.817 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCS(C)(=O)=O 1848099038 UCQCASCEUNKILL-IHRRRGAJSA-N 451.973 0.755 50 20 JCGD CCOc1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1OCC(=O)N1CCCCC1 728384371 HNTFHQYIPOCDCR-INIZCTEOSA-N 467.544 0.672 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1 728983461 JNFZVUHZOJXSAL-KRWDZBQOSA-N 490.590 0.281 50 20 JCGD COc1ccc(NC(=S)NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)cn1 729693412 XJNUSVGYPSDMEG-UHFFFAOYSA-N 469.520 0.882 50 20 JCGD CCOc1cc(/C=C(/C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)ccc1O[C@H](C)C(=O)N(C)C 732578671 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MVFATZUKVDANHL-UHFFFAOYSA-N 477.543 0.574 50 20 JCGD O=C(CCNC(=O)NNC(=O)c1ccc(Br)s1)N[C@@H]1CCS(=O)(=O)C1 916636161 PQJYEFKPLKYFIX-MRVPVSSYSA-N 453.340 0.148 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@@H](NS(C)(=O)=O)C1 918777416 ITTXUFOYYCTMAP-WCQYABFASA-N 463.354 0.971 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cccc(OC)c2O)o1 919755814 IUPRKSMOZSJKIB-CYBMUJFWSA-N 481.483 0.785 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)NCc1ccco1 920857854 RUHHBYGQUMPFPK-VEMDQMBVSA-N 484.556 0.504 50 20 JCGD CCNC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N3CCOCC3)ccc2n1CC 920858520 BRELCZOFTQQQST-UHFFFAOYSA-N 452.537 0.360 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCC(=O)N2CCC[C@@H](C)C2)cc1 1123723049 MKRCMXQMDGRIHG-MRXNPFEDSA-N 453.565 0.595 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ncc[nH]1)C2 1778095119 UEKUVJKBASISSM-TWLABZOOSA-N 469.546 0.990 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1 1778627893 FFGPZHMQJBRNBP-JHXRPTDYSA-N 469.527 0.973 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cn2cc(F)ccc2n1 1779027202 IWFSYIRZRBYLEZ-HYBUGGRVSA-N 480.305 0.595 50 20 JCGD C[C@H](Nc1nccs1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030357 OYFQCLRTGZLPPG-RNODOKPDSA-N 459.532 0.086 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncccc1C(F)(F)F)CCO2 1779032485 LJFZASZWFYJZBE-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)[S@](=O)c1ccccc1 1779037363 XVIORKGKOPLWMJ-KVCQHZKUSA-N 485.566 0.325 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1779316818 FFTYWGAUDYMXSX-DXIQSLLYSA-N 496.402 0.974 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CS(C)(=O)=O)CCO2 1780095171 IKKGCHNZRIGIEF-LHSJRXKWSA-N 497.526 0.644 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1CCc2nc[nH]c2C1 1782458706 ZCPHNLFLABOMRY-NYQDVAGCSA-N 466.347 0.022 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)C3CCN(c4ccc(F)cn4)CC3)C2)C1 1782798093 TZZRHGFXAMZRDI-RUZDIDTESA-N 496.348 0.261 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1783020100 RJDWXICHIFDLOH-PXNSSMCTSA-N 458.964 0.452 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2 1783601983 ICHZHRXLJQLGHS-PTAUBWNISA-N 465.906 0.807 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCOCC4)cc3)C[C@@H]21)[C@H](O)CCl 1784090794 NECAXWBVQRAIPS-FFGOWVMKSA-N 451.951 0.716 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784093349 XKAIPIFHHWVEIA-VGWMRTNUSA-N 463.959 0.107 50 20 JCGD COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1F 1786986658 VXZRFAOTAVESOW-QSFXBCCZSA-N 456.279 0.421 50 20 JCGD CC(=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1795442921 ZCIXXKOSLSUZHQ-YRPNKDGESA-N 487.362 0.029 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)ccc1OC(F)(F)F)C2)c1ccc(B(O)O)cc1 1795735321 ZKBZSQLYOISPPL-HBCWATKFSA-N 496.222 0.921 50 20 JCGD Cc1ccc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)ccc2c1 1795739253 XIFZLVLNFRLIKV-BBIADKPPSA-N 459.311 0.740 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C(F)(F)F)c1)C2)c1cccc(B(O)O)c1 1795739751 JDZGQURWCQNVCQ-HGKCTWBKSA-N 462.233 0.902 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1Br)C2)c1cccc(B(O)O)c1 1795740229 HFCVOLBFMDSTDI-XOIINTDNSA-N 474.120 0.041 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccnc(Br)c1 1798019596 JMQVSAMXMVGQDR-JLVBRIDZSA-N 474.120 0.041 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCOCC1)C2 1800332398 HMRKSBROVXQZKC-BDCURPAKSA-N 460.481 0.794 50 20 JCGD CC(=O)NCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803718765 QXSLZLCPAUODJJ-FXAWDEMLSA-N 481.557 0.562 50 20 JCGD COc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1 1807362994 OARFWPIOUMTSIM-GCJKJVERSA-N 460.299 0.798 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365987 ZWJVMIFHCPNTKV-SIKLNZKXSA-N 484.325 0.746 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368021 WMRTXUNUPRRSSN-RXVVDRJESA-N 475.314 0.374 50 20 JCGD Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(O)n1 1807373956 FCYUAKXPXZGDNR-GHTZIAJQSA-N 460.299 0.804 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2nncn2c1 1809910591 JKGWODCFVNOKBB-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(=O)nc3cccnn23)[C@H]1c1cccnc1 1811337255 KLCHFFHONOQYGX-GAJHUEQPSA-N 492.540 0.177 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1 1812118396 JKPCCLDVKWFZNF-UZLBHIALSA-N 490.524 0.693 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1 1813071636 VBFFRJYJWXQPOQ-RDTXWAMCSA-N 458.479 0.406 50 20 JCGD O=C(CCBr)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339922 UTLUSDNFTMORHS-LBPRGKRZSA-N 452.139 0.834 50 20 JCGD COc1nccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1F 1815354691 QCWNXKUEAWMSSJ-CYBMUJFWSA-N 470.291 0.905 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1 1817812350 CPPQLDIGZKEFLO-JOYOIKCWSA-N 478.311 0.873 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnn2cccnc12 1819019313 XCFUXJIIPOJFLM-SFHVURJKSA-N 459.275 0.752 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2)N1C[C@@H]2C[C@H]2C1 1819574910 WGEWHOVUURAJHU-ZOBORPQBSA-N 469.571 0.708 50 20 JCGD COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n(C)n1 1819793000 GISAVYLSCANHQD-SNVBAGLBSA-N 470.515 0.423 50 20 JCGD O=C(NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccco1 1827184021 XVWGBJAUSFSAPD-FQEVSTJZSA-N 467.331 0.623 50 20 JCGD CC(=O)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n[nH]1 1830535261 LBAKFWHKFXSFAL-KZULUSFZSA-N 457.325 0.713 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1831653713 CZQHFJIRAYDCGG-HRAATJIYSA-N 465.938 0.809 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCn3c(=O)oc4ccccc43)CCO2)C1 1832759795 SNZVWLIZFFPICB-AOMKIAJQSA-N 481.933 0.695 50 20 JCGD COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cn1 1834316696 ALNVQICDLCAMGX-UHFFFAOYSA-N 461.567 0.043 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1nccc2[nH]ccc12 1835016835 HECJTVXEWTXIPJ-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C3CC(=O)C3)CC2)CC1 1835118284 YAKHGNAIROXYKW-CVKSISIWSA-N 456.547 0.671 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnn4cccnc34)CC2)CC1 1835536722 YYDZLXFIBFSBJL-UHFFFAOYSA-N 470.578 0.288 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4cccc(Cl)c43)C2)C1 1835932271 XEIMKGARNBEQEQ-NLFFAJNJSA-N 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O=C(CCN1Cc2ccccc2C1=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732450 YHDXIUBMGDZZEN-PGRDOPGGSA-N 465.934 0.089 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)nc1 1830733454 MWSORQNRPWBRLR-HRAATJIYSA-N 455.939 0.604 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1 1830742368 ALSSOTHTLHEGNL-CKJXQJPGSA-N 477.986 0.857 50 20 JCGD CC(C)[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1830862473 ZHSXEMUPLHFDDL-GCKMJXCFSA-N 477.986 0.592 50 20 JCGD CC(C)(O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549718 ZUOJDFPIEYBTFS-BTYIYWSLSA-N 477.986 0.736 50 20 JCGD C[C@H](Cn1cccn1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833885766 JHNXWPJCKKFJOO-GOSISDBHSA-N 467.379 0.084 50 20 JCGD NC[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccc1 1834801044 JQVWCCHUFQDPSK-XMMPIXPASA-N 478.402 0.294 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccnc(Cl)c3)CC2)CC1)c1cccc(B(O)O)c1 1834801221 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0.643 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)c2ccccc2F)c1OC 859406010 FPQQXTCMPRGPJG-UHFFFAOYSA-N 467.475 0.939 50 20 JCGD CCc1ccc(C(=O)OCC(=O)NNC(=O)c2cccs2)cc1S(=O)(=O)N1CCOCC1 914631756 HCRNENOGBBALOA-UHFFFAOYSA-N 481.552 0.949 50 20 JCGD COc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)c(OC)c1 917836402 OKXXHDBEUDLBNZ-UHFFFAOYSA-N 471.470 0.831 50 20 JCGD O=C(Cn1cnc2sc(-c3ccccc3)cc2c1=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919883616 FCHLBRPBJFYJKQ-CYBMUJFWSA-N 461.525 0.643 50 20 JCGD CCn1nc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@H]32)c2ccccc2c1=O 921301280 UQYSDNABUNXHLP-RVKKMQEKSA-N 458.544 0.903 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1 1779031223 NXOGSQSWCBPPJG-QHCPKHFHSA-N 476.497 0.023 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3[nH]nc4c(Cl)cccc34)CCO2)C1 1779032781 VFUVRBRRMWRBKN-HSZRJFAPSA-N 497.943 0.901 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779294471 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JCGD O=C(NC1(c2ccc(NC(=O)c3cc(C(=O)O)ncn3)cc2)CCC1)c1ccc(B(O)O)cc1 1787085463 IPPDSQLFLJVLOU-UHFFFAOYSA-N 460.255 0.916 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1)C(C)(C)C 1787506526 CMXRZFQTPITREI-NXOVAROOSA-N 488.589 0.651 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C[C@@H]21 1787508181 NFRKKTVYXYHXAY-CTOHXUJISA-N 481.557 0.628 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)CC1 1788141046 DYKSQJTYESITCX-UHFFFAOYSA-N 499.398 0.786 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610907 DMENXUBMBCJWIR-NDXORKPFSA-N 480.525 0.551 50 20 JCGD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCCS3(=O)=O)cc2)CCC1)c1cccc(B(O)O)c1 1791179221 ZQYDVSOPRLCHPG-IBGZPJMESA-N 456.329 0.691 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791236079 ZNQGOENPANECJI-KXOXPVICSA-N 485.541 0.034 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1c(O)nc3ccccc31)C2)[C@H](O)CCl 1792978620 JFXZXTSOYRHZJZ-QOIYZWAUSA-N 450.923 0.711 50 20 JCGD COC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793880626 CJJIRZNLFYNFHW-LOUJCGABSA-N 461.943 0.661 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1C(F)(F)F)C2)c1cccc(B(O)O)c1 1795740300 PSXWYAZHDSNVQO-XOIINTDNSA-N 463.221 0.297 50 20 JCGD CCOc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797752900 LZRZQDNRZPTCII-YVWYUNDQSA-N 453.499 0.601 50 20 JCGD CC[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)NC(=O)OC(C)(C)C 1799366709 DKAGUTRLTYJCQQ-SHJAMOMRSA-N 489.378 0.263 50 20 JCGD COc1cc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c(F)c1 1799593070 KFAGDYMPUDOTSI-NXCRSVRDSA-N 454.474 0.550 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(-c3cccnc3)n1)C2 1801011092 AWAMEZITNLSHCQ-CWPLJXCYSA-N 472.571 0.781 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1803162087 ZLHNOBOORBXQAQ-KSEOMHKRSA-N 450.348 0.565 50 20 JCGD COc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807360966 DGPSWIGTOSCABC-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375477 PIZLMYAAOKVBEA-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377259 ZUUKAMSWXIHWJG-NFBKMPQASA-N 496.336 0.976 50 20 JCGD COCCOCC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808413921 CLBIVWRZKCAYHS-YCYMQERHSA-N 470.530 0.884 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810307540 DPZDZRUQPZTSAF-JPYJTQIMSA-N 490.568 0.993 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2cncnc2)[C@H]1c1cccnc1 1813071909 VZINIJFVJMODOA-CVDCTZTESA-N 453.547 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2c3c(nn2C)CCC3)[C@H]1c1cccnc1 1813073584 JYBMQRXSXXMCTB-VGSWGCGISA-N 467.574 0.996 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1 1813320009 ZWESVWXKCPYVPZ-JXFKEZNVSA-N 463.502 0.082 50 20 JCGD Cc1nccn1[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813489643 IMBQCNHZLZRANB-BUVFEPMLSA-N 461.331 0.847 50 20 JCGD C[C@@](O)(C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(F)(F)F 1817474170 OACUUQWKVKVGRK-KBXCAEBGSA-N 454.214 0.709 50 20 JCGD COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1 1822371439 SCBWSSZWUXFTHD-ZFWWWQNUSA-N 461.972 0.386 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cc(C)c(O)nc2=O)n[nH]1 1823370044 FYPPZRSOXHPYNN-TZMCWYRMSA-N 452.899 0.927 50 20 JCGD O=C(CCc1ccc(O)nn1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1824483523 RKSHRBRMTZJKFD-HNNXBMFYSA-N 467.316 0.177 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828922184 QRUHLGFZJNSAME-UXHICEINSA-N 458.563 0.833 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ncc(Cl)cc1Cl)CCO2 1829610214 GUQZOBQWQPYVPO-HXUWFJFHSA-N 488.372 0.831 50 20 JCGD C[C@H](S)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551424 NSMUZZUXPKJFCU-NJSLBKSFSA-N 466.000 0.893 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1834824235 YTUIVLCADVZBJV-LJQANCHMSA-N 466.336 0.513 50 20 JCGD Cc1ccn2c(=O)c(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)cnc2c1 1835407816 MQVMRKANGXLCTC-LJQANCHMSA-N 475.977 0.788 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3c(Cl)cncc3Cl)C2)C1 1835933937 KEHMKTUQERZCIO-NRFANRHFSA-N 494.140 0.452 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1F)CCO2 1836315461 BURGRQLKAGRMLS-QVGKIPNLSA-N 472.477 0.425 50 20 JCGD COc1cccc(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1837128175 NRLAYAQVYYUWKT-UHFFFAOYSA-N 481.358 0.625 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837222506 KWDRAYYASZRFPN-QGZVFWFLSA-N 483.573 0.830 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCCO4)CC2)CC1 1837920392 SJQYVDPUHPAPLP-UHFFFAOYSA-N 482.346 0.271 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2)C1 1839147290 MICBTRQVGOBMMB-MRUHUIDDSA-N 477.986 0.736 50 20 JCGD O=C([C@@H]1CC(c2ccccc2)=NN1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202991 WERDDINEQQSXQD-ABSDTBQOSA-N 483.338 0.900 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1O 1839266446 CQUSFGUSZRZXHQ-QHCPKHFHSA-N 469.498 0.083 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)c2n1 1839626472 BVYBDENZNAEANZ-VWLOTQADSA-N 492.341 0.015 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cc3)C2)C1 1840152794 UBXHDUDOUURHON-NZQKXSOJSA-N 481.977 0.847 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)c(OC)c3O)C2)C1 1840154616 AIJWDHPDAJCCDZ-QVKFZJNVSA-N 472.922 0.733 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(N4CCOCC4)c3)C2)C1 1840154830 HKSZOJYXGASJQP-REWPJTCUSA-N 481.977 0.847 50 20 JCGD Cc1cc(C#N)cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840184863 CVHYGRLLZSFROJ-QHCPKHFHSA-N 457.531 0.310 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccc[n+]([O-])c1)C2)NC(=O)NCc1ccccc1 1845038560 SNHCVVHBQWIHNY-UHFFFAOYSA-N 452.515 0.483 50 20 JCGD CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 20901162 WEJOZHCNBNOPIE-UHFFFAOYSA-N 496.567 0.728 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@H](O)CN1C(=O)c1ccc2c(c1)CCC2)NNC(=O)c1ccc([N+](=O)[O-])cc1 725997479 MCJCNAGOTFPPIR-PMACEKPBSA-N 496.476 0.663 50 20 JCGD CCCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 728017904 BCVOLLADDOHSOT-INIZCTEOSA-N 456.590 0.855 50 20 JCGD NS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(F)ccc2Br)c1 728510236 UVGPCCIBKRBDDY-UHFFFAOYSA-N 452.283 0.859 50 20 JCGD Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O 729276389 DNPSONLIKWQAQJ-JTQLQIEISA-N 458.338 0.950 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)[C@H](C)N2CCOCC2)c1 729623362 KMPIDQFSERPBNP-CVEARBPZSA-N 455.581 0.770 50 20 JCGD CCCCn1c(CCC(=O)NNC(=O)N2CCOCC2)nc2c1c(O)nc(=O)n2CCCC 745988243 WHSHGVZYHFFGLO-UHFFFAOYSA-N 463.539 0.904 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)Cn2cc(Br)c(O)nc2=O)c2ccccc2c1=O 751205461 HPCVCECDCOVNJV-UHFFFAOYSA-N 477.275 0.463 50 20 JCGD C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)CNC(=O)c2ccco2)C1=O 751207115 RZGBKDATRFEFSW-HSZRJFAPSA-N 463.450 0.777 50 20 JCGD N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1 916391586 FUGQPTNIVKTDQW-UHFFFAOYSA-N 450.455 0.040 50 20 JCGD CN(CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C(=O)c1ccc(Br)o1 917919119 MDVBQTGFONALFL-UHFFFAOYSA-N 493.723 0.876 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H](C)n1cccn1)c(=O)n2Cc1ccccc1 918254869 GAORDXVFAQLLSX-HNNXBMFYSA-N 464.486 0.033 50 20 JCGD CS(=O)(=O)Nc1ccc(O)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 919807321 DUEMGUSJLOMWBH-UHFFFAOYSA-N 482.540 0.623 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)C2(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)CCCC2)c1 919883455 AKDVYUOCSXWXOX-HNNXBMFYSA-N 457.574 0.907 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C\C(=O)NC3CC3)C2)C1 1778831146 RPPPLKJVPOXYEA-KSEXMQBYSA-N 486.481 0.798 50 20 JCGD CCn1nc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c2ccccc21 1779030007 DHIUYOHVFRVFQI-DEOSSOPVSA-N 477.525 0.812 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779036092 XBBSBRKAZIJKGU-HSZRJFAPSA-N 490.561 0.434 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780887298 AJBJEEBBTSSQPT-DEOSSOPVSA-N 474.363 0.568 50 20 JCGD N#Cc1cc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)ccc1F 1781298217 BMAQASIVFVNCQN-QHCPKHFHSA-N 451.263 0.063 50 20 JCGD CCOc1c(F)c(F)cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1F 1782012940 XGYSKIFGNOKPKJ-HSZRJFAPSA-N 492.259 0.940 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1782953000 JVPNNMSAVLPNJX-MDOVXXIYSA-N 494.010 0.526 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1 1783939160 APYCRXNDQJLMKX-NRFANRHFSA-N 455.556 0.104 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1CCc2ccccc2[C@@H]1O 1784149080 OJUWISQPUXDFJV-NHKCCNDQSA-N 478.354 0.256 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3C(=O)c4ccccc4C3=O)[C@H]2C1 1785065329 YPPQTKRUYNOGSX-VDGAXYAQSA-N 499.568 0.025 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1Cl 1785116289 DJVZRBWFJHKZJO-QFIPXVFZSA-N 458.707 0.786 50 20 JCGD Cc1ccncc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785317083 SFLULRCLAWHOOC-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4nc(O)nc(O)c4C3)[C@H]2C1 1785332671 RJWRHDMPILMEGJ-SPTHLVQHSA-N 483.363 0.756 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1 1786978795 WSPGBVBRNYJOAL-BWPZPKMVSA-N 466.343 0.772 50 20 JCGD C[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)Oc1ccccc1 1786985217 RVFNHWQYKKZHBR-UJFGGOPNSA-N 466.343 0.817 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)c3F)C[C@@H]21 1788610164 NHUGACCOIWWOLM-IWEFOYFVSA-N 459.453 0.870 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nn[nH]c3C(F)(F)F)[C@H]2C1 1789359235 CFRQGDWNYGRJJU-FWAJNHRISA-N 496.450 0.551 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3csc4c3c(=O)n(C)c(=O)n4C)[C@H]2C1 1789702699 BUAIYZLKBIEQOA-TUUVXOQKSA-N 497.017 0.838 50 20 JCGD Cc1cccn2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]4C3)c12 1791293810 KHLDOMHRLMSUDC-WDSOQIARSA-N 456.547 0.609 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1 1791600992 CXTCYWJZCRAFQU-LJQANCHMSA-N 476.530 0.988 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3cccnn13)C2 1792872411 FWPXSWVDQWXDEW-JRATXPSKSA-N 464.320 0.324 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)C2)C1 1792983538 MAOGFWCFUUKXLD-YVSFHVDLSA-N 471.982 0.823 50 20 JCGD COc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1OC 1795739687 ASRCZDSELOIVNK-YVWYUNDQSA-N 472.278 0.040 50 20 JCGD O=C(CCc1c[nH]c2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1795833863 KFQHFYMFEADCRN-NHKMSHSESA-N 461.327 0.684 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1796393115 QDGNZITTYJWHDU-ITGHMWBKSA-N 482.347 0.806 50 20 JCGD CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(S(C)(=O)=O)CC1 1797137120 RKVRASWQHZCVNZ-YVSFHVDLSA-N 450.001 0.655 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cn1cncn1 1797900031 GYKNFJFYQYVDTP-BCEDRHLLSA-N 486.485 0.651 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1797900734 XQCRVYQYUOXYSN-NRAIQUKZSA-N 489.353 0.967 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCNC(=O)C1)C2 1798522972 KGZHIZMRMWOMDB-GXNBUGAJSA-N 474.470 0.250 50 20 JCGD CC(=O)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)n[nH]1 1799094728 HLQCZDWXTOJWNN-OPMZPASUSA-N 497.556 0.162 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799342026 DANICGRGAKDBAP-ZUWCUPBKSA-N 482.347 0.542 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCC(=O)N1)C2)NC(=O)NCc1ccccc1 1799864678 GQSBRAKHQWKSDU-RDGPPVDQSA-N 456.547 0.249 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)C1CCN(c2ccc(F)cn2)CC1 1800289745 HNNWQRCREFAUTG-HIRMHNASSA-N 454.930 0.626 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2 1800754501 PUZWQBNLCNTCQR-BCEDRHLLSA-N 492.370 0.975 50 20 JCGD COCCOCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2 1800848735 MMEKXUYHHOZGDK-RMFSNUHRSA-N 476.643 0.124 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2 1800977436 OISYEBKDSGZKFA-YIDVYQOGSA-N 463.959 0.106 50 20 JCGD CCOC(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)OCC 1801146964 SCMDTUICWXOOFU-OYSOCFBGSA-N 463.535 0.499 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ncc[nH]1)NC(=O)NCc1ccccc1 1801210454 LUPHPVLWADRZFU-BBIADKPPSA-N 483.573 0.278 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1802837912 XFAQQPSZLJWVDQ-YPPYOEKHSA-N 482.545 0.229 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1806039127 OXJMBSKMNMWIJG-LAUBAEHRSA-N 461.287 0.193 50 20 JCGD O=C(CCN1CCCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1806644989 FKNUTXKXDUUSJU-XUZZJYLKSA-N 464.375 0.957 50 20 JCGD O=C(CC1CCOCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1806933212 KHUJIMOMLSESRX-REWPJTCUSA-N 451.332 0.898 50 20 JCGD Cc1nc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(=O)[nH]c1C 1807369437 JTTLJGOHXXNXPK-WIYYLYMNSA-N 475.314 0.095 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccn2c(O)nnc12 1808190524 SJYCTJQSQVZNGW-YLJYHZDGSA-N 486.297 0.143 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)NC=O)[C@@H]1c1cccnc1 1808417418 YSEMWESTXLEVMA-QGAZACGHSA-N 453.503 0.356 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1)[C@H](F)Br 1808679430 XYOLHFIHKNEHTG-XIRDDKMYSA-N 461.332 0.065 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1 1809781805 SKBRZCCTROZUBY-LAUBAEHRSA-N 464.530 0.817 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1810099918 MJFIJVLOPYBNQE-FRFSOERESA-N 457.325 0.937 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1 1810303065 PCKRFHOBAYSQQI-CXAGYDPISA-N 479.457 0.345 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnc2snnc2c1 1811338102 AOYSTAHXHNKLRX-JXFKEZNVSA-N 488.338 0.795 50 20 JCGD Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(O)n1 1811481869 RRDOHMXROQKRSH-RXVVDRJESA-N 460.299 0.804 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc2nn[nH]c2c1 1812298053 HAYUHZBYZSNVLO-GCJKJVERSA-N 470.298 0.666 50 20 JCGD N[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccn1 1815012145 UAUFTYRPVUBGJI-RDTXWAMCSA-N 451.317 0.144 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnc3snnc3c1)CC2)c1cccc(B(O)O)c1 1815360830 OOZZGEKYUNGFCH-CYBMUJFWSA-N 480.340 0.762 50 20 JCGD CC(=O)NCCC(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817282907 ODFPFZXTAUELIX-LGXUHMPSSA-N 459.532 0.715 50 20 JCGD O=C(O)c1cnncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819760970 QQMWLTGUQONWHH-KRWDZBQOSA-N 464.247 0.197 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1cn[nH]c1)CC2 1819793687 RJTMTYHYWWNKDS-GFCCVEGCSA-N 454.516 0.723 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1824525150 TVIAKRTUOZUNGU-UZLBHIALSA-N 464.393 0.280 50 20 JCGD O=C(O)c1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)ncn1 1825502642 FFMNWVPEOZJKQM-HXUWFJFHSA-N 466.303 0.402 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)cc21 1828499705 ZTPUYMXTNHNINX-AEFFLSMTSA-N 451.955 0.850 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1 1831190669 RPGOBAWXFAJMDT-SFHVURJKSA-N 490.561 0.749 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1 1831280797 BIBMUVQEVZCQFN-UXHICEINSA-N 462.377 0.177 50 20 JCGD COc1ccc([C@H](O)C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1 1833181363 XAKIZAXJCFIKHQ-UXHICEINSA-N 453.967 0.900 50 20 JCGD Cc1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1834797464 LIZZDTCSGMLVJL-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD CCOc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1 1834801226 RRKNVLIZQJUOER-UHFFFAOYSA-N 481.362 0.054 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)n1cccc1C=O 1834809307 YJMJZWBSKGRNKD-SFHVURJKSA-N 474.606 0.806 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1835640593 NLYCRNMYHWPGOQ-OPAMFIHVSA-N 491.029 0.950 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCc3ccc[nH]3)CC2)CC1 1835736699 CDGFBYACTXYUGB-UHFFFAOYSA-N 467.574 0.831 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1Cl 1835942147 YRPVWMKPSDGCNV-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD O=C(CCc1ccsc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836004953 VSUBPUFSCSEEMX-QFIPXVFZSA-N 458.345 0.131 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1 1836399643 HTRWCUANWOQUFK-DNVCBOLYSA-N 467.394 0.859 50 20 JCGD O=C(c1cc2ncccn2n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836872738 KTYXDJMWKDHDCT-WMLDXEAASA-N 456.272 0.490 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cc(C)cnc34)CCO2)C1 1836950203 QDPDIUKKGJAISW-OXJNMPFZSA-N 451.911 0.362 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1837609611 VUBNXOXFGWUEGO-VHKYSDTDSA-N 488.372 0.288 50 20 JCGD COCc1oncc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920414 WHGYHLDYCHGFJE-UHFFFAOYSA-N 471.319 0.427 50 20 JCGD O=C(O)c1cnncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1837945915 PPXWIFOVUDQEQE-QGZVFWFLSA-N 457.281 0.030 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)ccn1 1838722645 GSKCPVHPPVTDJG-IIBYNOLFSA-N 469.922 0.582 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CCO2 1839082867 RZBOZUGCXGNAOL-HMFYCAOWSA-N 467.639 0.695 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)C(F)(F)F)C2)C1 1839155334 RBMPUUAICPDARE-LSDHHAIUSA-N 464.268 0.358 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCOCCOCCOCCOC)CCO2)C1 1839220237 BYBHIKPNHRSKPH-SIKLNZKXSA-N 495.013 0.547 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)CCO2)C1 1839466958 DCZVUANPQJEEHZ-MGPUTAFESA-N 471.894 0.933 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CNC(C)=O)C2)C1 1839962377 CHNPZYKSMUZAFJ-BEFAXECRSA-N 462.385 0.779 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3C1)CCO2 1839994459 YVABRFZFPIEERL-PXDATVDWSA-N 472.586 0.621 50 20 JCGD COC(=O)C12CC(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](C)Br)C4)C3)(C1)C2 1840007142 QAGLEKYBHNQGCS-CYBNEDPLSA-N 459.337 0.570 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1840034010 XQGWHGGQPFAIOL-XHSUDLSASA-N 484.347 0.692 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1840152448 ILFQMBNQWXXPAM-JTSKRJEESA-N 478.933 0.490 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1840152859 WXNCMUROVQSRQO-VFNWGFHPSA-N 466.922 0.379 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C)CN(C(=O)OC(C)(C)C)C3)C2)C1 1840153116 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CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)[C@H](O)C1 1847559891 UZMALJLVCAWYLK-UFJVTBDRSA-N 459.971 0.796 50 20 JCGD CSCC[C@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)NNC(=O)C1CC1 11776530 YBAFJAFMCQJRMF-HNNXBMFYSA-N 477.008 0.999 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2nn(-c3ccccc3)c(C)cc2=O)cc1 17407029 ARMBOZMHSZEUGW-UHFFFAOYSA-N 469.523 0.931 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCc2c(C)nc3ncnn3c2C)cc1OC 104812525 VSPXHRCNZXUGAA-UHFFFAOYSA-N 456.459 0.695 50 20 JCGD CC(=O)N1CCN(CCOc2ccc(CCNC(=O)NNC(=O)Cn3nc(C)cc3C)cc2)CC1 728133738 CZVAUGRUOYIQQA-UHFFFAOYSA-N 485.589 0.616 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C[C@](O)(c3nccn3C)C(F)(F)F)cc2)CC1 728215373 YGDUYVSTBLDENJ-SFHVURJKSA-N 490.508 0.640 50 20 JCGD NS(=O)(=O)c1ccc(OCCSCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728890620 XYSCCHAYOYKFBM-UHFFFAOYSA-N 494.599 0.300 50 20 JCGD CS(=O)(=O)CCNC(=S)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 729153490 CQVYYNMPOQIADR-UHFFFAOYSA-N 470.598 0.319 50 20 JCGD COc1cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc(OC)c1OCc1ccccc1 729275514 OYWXYXSPLHOULP-CYBMUJFWSA-N 451.501 0.982 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1 745992458 ASZLQSWXXNXMHT-UHFFFAOYSA-N 462.484 0.945 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)c1 748466246 XDUMOLREGXPUIA-UHFFFAOYSA-N 473.555 0.773 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)n1 760983718 PFTMWJCPGAGHLQ-CQSZACIVSA-N 499.571 0.390 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 788023817 OXBRLLLBDWEZNQ-MRVPVSSYSA-N 477.870 0.219 50 20 JCGD Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 811883730 VPDCKBFOWSNIPX-UHFFFAOYSA-N 486.959 0.811 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccc[nH]1 822066087 IGKNOFAYYULWCR-WQMJKPAKSA-N 454.530 0.169 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc([N+](=O)[O-])ccc1I 915278957 JMFQENINCGMJFM-SSDOTTSWSA-N 453.214 0.395 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCn1nc2n(c1=O)CCCC2 916650155 QAKKADOIIAQUHY-UHFFFAOYSA-N 464.552 0.017 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)c1 929086505 DOVHBBMSCQJCGL-UHFFFAOYSA-N 469.541 0.790 50 20 JCGD CN(C)N(C(=O)C1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1)[C@@H]1CCS(=O)(=O)C1 1317732258 ODLZMWLYAJCMOS-QGZVFWFLSA-N 454.574 0.451 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnc1C(N)=O)C2 1778091810 RMAAESUUZXEADE-KWLDSLIKSA-N 495.540 0.442 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4nccc4c3)C2)C1 1778731176 ZKPRZBAEDZMDPC-LRULAXNGSA-N 463.498 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3O1)CCO2 1779034039 JOOBMVDPFUISFJ-GBXCKJPGSA-N 465.510 0.522 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779034873 VPXFCBJGUPEAAM-LEFICIQRSA-N 483.500 0.990 50 20 JCGD COc1ccnc(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)c1OC 1780448486 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CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnc[nH]3)[C@H]2C1)NC(=O)NCc1ccccc1 1785224394 MEAQKQPFJMDETI-BVSLBCMMSA-N 497.600 0.668 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ncccn3)[C@H]2C1)NC(=O)NCc1ccccc1 1785421603 AOLNVTSCTIGLOY-ACRUOGEOSA-N 495.584 0.345 50 20 JCGD Cc1cc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1F 1786986565 LMPZMHNWPDNTDJ-XERREHJYSA-N 458.270 0.860 50 20 JCGD COCc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1787719544 GAVUKYBJTOPQFN-RAKJEAAFSA-N 472.502 0.548 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788148024 WYZTZKGKXPKLNO-FQEVSTJZSA-N 453.304 0.265 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nc[nH]c4c3)[C@H]2C1 1788328855 XTMNFBCQKBPLTL-VHFSOBRXSA-N 463.498 0.469 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OCCCO)cc3)C[C@@H]21 1788610210 PDNLSQJYQPONNN-HSQYWUDLSA-N 497.552 0.353 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4cc(C)ccn4c3=O)C[C@@H]21 1791253934 JCERTTIUGYOXJI-DKIMLUQUSA-N 462.934 0.850 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]cnc3-c3cccnc3)C[C@@H]21 1791290672 JDNDQHBCUCSESW-BZSNNMDCSA-N 469.546 0.438 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1ncn2nc(N3CCOCC3)ccc12 1793109582 AWDDXHGCYVRKJL-JYYAWHABSA-N 462.938 0.417 50 20 JCGD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1793210749 ZCTBYLFUVNDUGT-QOIYZWAUSA-N 450.879 0.739 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)nc1 1794018934 NDWGJHIUUVFYHY-FKWFMORESA-N 470.505 0.877 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)C1 1795117264 WDXPZDRJRNIVBR-IDLUEMFASA-N 490.395 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2sc(N)nc2c1 1795657172 VMIISUCVIGYMNB-IVWMJMPLSA-N 481.538 0.394 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)(F)F)c[nH]1)C2)c1cccc(B(O)O)c1 1795739017 QBVPDRCWCOVNHV-FVCICTRLSA-N 451.210 0.230 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3cnccn3)c1)C2)c1cccc(B(O)O)c1 1795740340 VMWLEFAWZYAXKJ-JHDGKUDLSA-N 472.310 0.340 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ncccn1 1795837934 FDONRQOKPJJBOK-OBAMXFLESA-N 471.543 0.292 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796369672 AHNNEQKXTVRXPH-XLWJZTARSA-N 493.964 0.452 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1 1797233354 SCFWTGHUHQWBQV-FEJSZKPUSA-N 459.547 0.150 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(c1)n(C)c(=O)n2C 1797505496 VOSUQBQNGLKIJG-BJWYYQGGSA-N 456.547 0.502 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(NC(=O)C3CC3)cc1)C2 1797752873 KVMGXDQQKVVGRI-UPHUGPLXSA-N 492.536 0.551 50 20 JCGD C[C@@H]1C[C@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1799164351 NNGAXYIZTUHNTB-DUZMOWEYSA-N 457.575 0.968 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)=NO2)C1 1800710339 DWIAXCBXMHPXQR-AYRXBEOTSA-N 474.917 0.876 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)NCc1ccco1)C2 1800759604 XPDZSXWGNQUYPL-ZKPVWFECSA-N 454.321 0.825 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc(Cl)c1)C2 1801008805 CGKWLKXWUPBTTF-USGNIVHTSA-N 452.939 0.681 50 20 JCGD CN1CCN(CCC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1806914827 NQOOEHKDYSGXEI-AUSIDOKSSA-N 494.600 0.037 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n(C)n1 1807365087 WREOZZVOMJGJPG-UTKZUKDTSA-N 463.303 0.137 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807616721 OJEZOGXBULFJJB-CTNGQTDRSA-N 496.373 0.994 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1810514656 OCGDBTVHPQXTMU-RADWXHQJSA-N 460.579 0.765 50 20 JCGD Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)ncc1[N+](=O)[O-] 1815354447 BTIMDWLUBSDGGG-AWEZNQCLSA-N 481.299 0.974 50 20 JCGD Cc1nn(C)c(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1F 1815354895 HNOCCZIIKONKFM-ZDUSSCGKSA-N 457.296 0.544 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)[nH]n1)c1ccc(B(O)O)cc1 1817471986 ALUOUZFPGLVOMX-KRWDZBQOSA-N 487.285 0.112 50 20 JCGD Cc1nc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)no1 1819401664 NCFIAQPMDZYPBA-OAHLLOKOSA-N 453.463 0.648 50 20 JCGD CC(=O)N[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)C(C)(C)C 1819793343 MEKBWVHNKXNOML-YVEFUNNKSA-N 487.586 0.918 50 20 JCGD NC(=O)c1nccnc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1 1823006383 DXPIJRXSPBUDQF-UPONEAKYSA-N 457.285 0.948 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1824529137 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COC[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1831629764 MDRBTIMOMIUCQB-CYFREDJKSA-N 491.589 0.072 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCCCC2=O)CC1 1831765801 HOCPZSUXYBBWFH-HXUWFJFHSA-N 470.574 0.931 50 20 JCGD Cc1cn(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c(=O)nc1O 1831877252 VUDUXKNEIPQINA-GOSISDBHSA-N 476.578 0.250 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1 1832551932 VZKGZGXZDWKYON-MRNZGAJFSA-N 487.981 0.467 50 20 JCGD C=CCSCC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833706866 UYIPUOKRYHGNQP-UHFFFAOYSA-N 460.604 0.790 50 20 JCGD CCc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)c1F 1833736044 XYVXMCJYRPNCBH-FDCKDHBTSA-N 489.508 0.315 50 20 JCGD CC[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)N(CC)CC 1834798120 UFGPITJBQMXPGV-QHCPKHFHSA-N 472.439 0.672 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCOC[C@]4(CN(C(=O)CCBr)CCO4)C3)nc2N1 1834822455 OCDGZKBVFPPMQB-FQEVSTJZSA-N 481.347 0.821 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1 1835079472 YTTGVUNMRATIKX-HOTGVXAUSA-N 464.966 0.978 50 20 JCGD Cc1[nH]ccc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835215850 VXFMFHKLXFTYCW-UHFFFAOYSA-N 453.547 0.821 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@]3(F)CCCC=C3F)C2)C1 1835933997 KVQQLLSRQXWCOB-VXKWHMMOSA-N 464.274 0.182 50 20 JCGD COc1nccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1F 1836237814 IRMZXECYWZRXPV-SUMWQHHRSA-N 464.263 0.990 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)nn1-c1ccccc1F 1836343579 SNXFWKGMJMVGTQ-PGRDOPGGSA-N 496.923 0.690 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1836484153 ONZDHACMVJZOAB-WCPBPTQFSA-N 491.495 0.775 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C34CCC(CC3)CC4)C2)C1 1837461599 ZFLZOEWBCIUUIK-KGMOOGKZSA-N 471.558 0.726 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(OC2CCN(C(=O)CNC(=N)N)CC2)CC1 1837845067 VSDFCSDENBDEQV-UHFFFAOYSA-N 490.517 0.615 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cnc(N)s3)CC2)CC1 1837901200 SKQIVBVAMHNKEL-UHFFFAOYSA-N 452.581 0.711 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919405 NHPYTZCNAATOOB-UHFFFAOYSA-N 491.357 0.644 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cccn4cncc34)CC2)CC1 1837921258 QWCXQDPKYXTIIC-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528179 KBGIABDKPXAKGU-LAUBAEHRSA-N 499.904 0.844 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839106347 BWIBTFHNFBFJEW-NQIIRXRSSA-N 457.015 0.630 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839198653 MJNWHLGTBZQDQB-DYVFJYSZSA-N 452.321 0.296 50 20 JCGD O=C(c1cc2cccnn2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201178 YTYUJHIRKUFDRI-PBHICJAKSA-N 456.272 0.490 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1839666046 MIQQPHNBECKJQZ-CKJXQJPGSA-N 497.390 0.687 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839951894 BBLDNVHMKJRNNN-FDDCHVKYSA-N 462.547 0.283 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1 1840033435 FGJPMNLBWORWCK-DEYYWGMASA-N 456.341 0.517 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1840071922 NRGSHZKIUCAJOU-LATRNWQMSA-N 493.960 0.738 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)nn1-c1ccccc1F 1843011061 KQHZKPNAIASZDX-UHFFFAOYSA-N 478.289 0.831 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014266 RSLBNBOHDMVNKB-UHFFFAOYSA-N 465.315 0.450 50 20 JCGD O=C(c1cn2cccc(Br)c2n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014908 OKHGZTGDTBTPOP-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(Cc3ccccc3)CCO2)C1 1843925363 FCXLFMPACOVLGA-FQEVSTJZSA-N 457.575 0.464 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1F 1846894121 XWJMEVMUAJSYCZ-UHFFFAOYSA-N 475.502 0.359 50 20 JCGD CN(C)CCNC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O 18138985 ZTLBLXWJVUSBGE-UHFFFAOYSA-N 451.574 0.541 50 20 JCGD CSCC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)C(=O)N1CCCC1 748246305 IIAPKWRMNHELPG-DNXIFWLFSA-N 454.574 0.468 50 20 JCGD C[C@@H]1Oc2ccccc2N(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1=O 761183417 IVGDLZDXSJKREA-LIRRHRJNSA-N 469.450 0.721 50 20 JCGD O=C(Cn1nc2ccccn2c1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 900862124 GXBQTPXTDJVUQG-UHFFFAOYSA-N 469.465 0.659 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)CC2)cc1 912920726 AEOQPUHKIQQHMP-CALCHBBNSA-N 494.614 0.937 50 20 JCGD O=C(COc1ccccc1Cc1ccccc1)NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 914830097 WNWRESWGVOZFDW-VQTJNVASSA-N 485.562 0.839 50 20 JCGD CC(C)(CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCOCC1 915894699 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CC(C)(C)c1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1779030308 NWRWNIDRDHSNKK-QHCPKHFHSA-N 467.530 0.530 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)cn1)C2 1779371021 GYSNGDUONMDKGQ-XMSQKQJNSA-N 454.487 0.227 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(-n2ccnc2)ccn1 1780215799 OOZKQHVEGQDAEO-RCZVLFRGSA-N 489.341 0.388 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)Cc3ncccn3)CCO2)C1)NC(=O)NCc1ccccc1 1780970416 XVGRFDYDYYACFH-XMMPIXPASA-N 481.557 0.195 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782213374 NKCSQHLKANFDGX-GCKMJXCFSA-N 456.540 0.435 50 20 JCGD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1783218278 IUOVQERMONFEQL-CZECHOCOSA-N 454.907 0.930 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]3C[C@@H]3N1C(=O)OC(C)(C)C)CCO2 1783939737 KXQRLWDRQGTPLP-KKFFFLSNSA-N 493.605 0.587 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSC3CCCC3)[C@H]2C1 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AXPMBMUBQHPCRR-GHJDPZQESA-N 472.477 0.567 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nc(Br)nn2c1)c1ccc(B(O)O)cc1 1796379302 ITXZYMLQTQPUSZ-BJWYYQGGSA-N 498.146 0.737 50 20 JCGD Cc1cc2nnc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](C)Br)C4)c(C)n2n1 1796926346 SSJVBUGLJFFMQV-VFFTVRQLSA-N 451.325 0.728 50 20 JCGD CC(C)COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)ccn1 1797750560 IOMNVJPGRHTKSQ-UPHUGPLXSA-N 482.541 0.632 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncccc1F)NC(=O)NCc1ccccc1 1798302766 XZNCVQGQDCESKK-RMFSNUHRSA-N 484.532 0.770 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])cc2c1OCC2 1798520637 HRLDOVAYEMNTGH-RMHZUWNSSA-N 453.879 0.987 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(N3CCCNC(=O)C3)n1)C2 1802332312 ANQCFNPCJMHJSJ-BCDXTJNWSA-N 485.589 0.033 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(C)(C)C 1803383320 FRDOYTZIWSEYAT-KSEOMHKRSA-N 480.374 0.632 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1 1806051956 VWONMZQNXOHEIZ-HRAATJIYSA-N 455.519 0.573 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808418104 ZEPKZJHZFBDRQB-RZZYGGHASA-N 482.545 0.668 50 20 JCGD CN1CCCn2nc(C(=O)N3CCC4(CCCN(C(=O)c5ccc(B(O)O)cc5)C4)CC3)cc2C1 1809974176 RVUSVXAKOCJOOE-UHFFFAOYSA-N 479.390 0.557 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1 1810293731 GMMYZYOHEYXVGI-QRWLVFNGSA-N 493.484 0.205 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc(Cl)ncn1 1811122914 IKBBQJZKXRMLDM-OXJNMPFZSA-N 465.706 0.838 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1812864685 JZPAGTCEDJOBGO-RBOXIYTFSA-N 452.309 0.423 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1nn[nH]c1C(F)(F)F)CC2)c1ccc(B(O)O)cc1 1815343939 YGHXGWBHOIMOKA-SNVBAGLBSA-N 480.237 0.499 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2nnc3ccccc32)[nH]n1)c1ccc(B(O)O)cc1 1817470360 PSYYVJPEYRNPJS-IBGZPJMESA-N 473.302 0.840 50 20 JCGD CC(C)n1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1 1818293419 YMKBWRICFCWFST-QGZVFWFLSA-N 451.296 0.882 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819560606 DACYTWJOSNNOPE-KDOFPFPSSA-N 455.324 0.700 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797418 BQAMYIQGUJXYRK-NWDGAFQWSA-N 469.531 0.295 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ncnn1C)CC2)NC(=O)NCc1ccccc1 1822518398 OBHRBOXFVPTRHQ-OAHLLOKOSA-N 497.585 0.844 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060489 LTBUUSPDSBYIIB-AUSIDOKSSA-N 460.336 0.216 50 20 JCGD COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1828861312 NJIGRZHLVOWICI-VWLOTQADSA-N 495.341 0.079 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)c(O)c3)CCO2)C1 1830248216 PFRNABNBWJJGON-HRAATJIYSA-N 456.923 0.654 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830539112 BIBAYMHQZUPRPC-AVYPCKFXSA-N 498.378 0.082 50 20 JCGD O=C(CCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)Nc1ccccc1 1830719986 QISLZXBVTDFLNF-PGRDOPGGSA-N 467.950 0.852 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725775 RSEQSBXLNYIDSW-KKSFZXQISA-N 469.922 0.317 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830736660 VVVOKTZLAUAMAA-RXVVDRJESA-N 463.922 0.245 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1831656694 HRSLYDRPICEMKW-FOIQADDNSA-N 470.910 0.620 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1832438096 XPCUZSPSEOLSKS-VWLOTQADSA-N 482.342 0.132 50 20 JCGD CN1CCCn2nc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)cc2C1 1833312196 LBLYVHSIQAUVHP-FQEVSTJZSA-N 467.014 0.504 50 20 JCGD COc1ncccc1CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797303 CBYRHADOAAZODO-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)Cc3ccc(F)cn3)CC2)CC1 1834838285 MDOATDPSVQJFCK-UHFFFAOYSA-N 462.570 0.708 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3[nH]nc4ncccc34)CC2)CC1 1835022213 GDFCAJNPFBRULK-UHFFFAOYSA-N 470.578 0.516 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)NC(=O)c3cnccn3)CC2)CC1 1835797914 IVTDVKUXYCNXAB-YJBOKZPZSA-N 480.997 0.420 50 20 JCGD O=C(CCCc1ccccc1F)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933705 ALNLFWJXGQXCAL-VWLOTQADSA-N 484.333 0.598 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1 1836118776 RBUGGTDRULCPPR-HSZRJFAPSA-N 489.479 0.276 50 20 JCGD CN1CCN(CCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)CC1 1836412481 IERONMRIKHOMJS-LJQANCHMSA-N 476.435 0.886 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1838066634 KNYBRRLXEQZJQB-UBXTYJAUSA-N 489.577 0.566 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)no3)CCO2)C1 1838108219 SAHBACSALFRTNX-NRFANRHFSA-N 490.425 0.598 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2 1838862861 RLWHFENUQWGFTP-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c(=O)[nH]c1C 1839151089 HZGSFNLCOOBOPS-OALUTQOASA-N 461.346 0.693 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1839154254 IJBVLASFWOJRHC-PMACEKPBSA-N 470.357 0.965 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1 1840152267 CWLSQNJFHDHUQJ-KNKQGSTJSA-N 451.951 0.411 50 20 JCGD COc1cc(F)ccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187312 RWPBHNLGZYVKOD-QFIPXVFZSA-N 466.510 0.277 50 20 JCGD COc1ccc(-c2cc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)n[nH]2)cc1 1843013748 IDYUUSKACUUUTN-UHFFFAOYSA-N 460.299 0.896 50 20 JCGD CNC(=S)NCCC(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1844265955 GYOUMGLENDTTAF-ZDUSSCGKSA-N 462.016 0.806 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cnn3ncccc13)C2)NC(=O)NCc1ccccc1 1845038653 DCZURSFZZKQFTP-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1847085035 LSBFZAKYEZUYTE-OALUTQOASA-N 471.363 0.877 50 20 JCGD COc1ccc(CC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1S(=O)(=O)N1CCOCC1 23080814 WOQJZYPPBYYPAB-LJQANCHMSA-N 491.522 0.246 50 20 JCGD CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12 105565233 NFSGTFMPTAKTMX-HNNXBMFYSA-N 469.589 0.799 50 20 JCGD CC(=O)Nc1ccc(NS(C)(=O)=O)c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 728151481 GKBYMGPIJPGWHE-UHFFFAOYSA-N 482.544 0.384 50 20 JCGD Cn1c(=O)nc(O)c2cc(S(=O)(=O)NNC(=O)c3ccccc3Br)cnc21 728502350 YXOSOGLMCQPYMW-UHFFFAOYSA-N 454.262 0.420 50 20 JCGD Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 729508829 BTZLOXULOKELLR-UHFFFAOYSA-N 451.531 0.954 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)Cc2c(C)nc3c(c(O)nn3C)c2C)cc1OC 729754394 RJOCYPFTVZPLMD-UHFFFAOYSA-N 471.470 0.855 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNC(=O)Cc2ccccc2F)cc1 731365818 ADYUARPODYGCGB-UHFFFAOYSA-N 464.519 0.976 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccccc2N2CCOCC2)cc1 744886941 CGVKKBGWUWQLGO-UHFFFAOYSA-N 475.571 0.983 50 20 JCGD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc4c(c3)OCCO4)C2=O)cc1 770392520 WEYOYQKLWLKDPG-JOCHJYFZSA-N 454.439 0.695 50 20 JCGD CN(C)N(C(=O)CCCCC/N=C1/NS(=O)(=O)c2ccccc21)[C@@H]1CCS(=O)(=O)C1 849193433 UOIZJTHXGIQLSN-OAHLLOKOSA-N 456.590 0.778 50 20 JCGD O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 913416501 GIMSJTSJGMSSJE-BEFAXECRSA-N 461.496 0.745 50 20 JCGD Cn1nc(C(=O)NNC(=O)CNC(=O)c2ccc(Br)cc2)c2ccccc2c1=O 913573032 IUGIWLOMKOUQLB-UHFFFAOYSA-N 458.272 0.887 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N(C)C)o2)cc1OC 915029860 JZICLDLKMBIXEK-UHFFFAOYSA-N 455.445 0.165 50 20 JCGD CCOC(=O)N1CCC(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1 915878910 UCBVLKJEAOGSFC-UHFFFAOYSA-N 469.568 0.265 50 20 JCGD C[C@@]1(NNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)CCS(=O)(=O)C1 918218508 UTWMYGWCBNNDLZ-OXQOHEQNSA-N 454.549 0.242 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1c(C)oc(C)c1S(N)(=O)=O 919136367 LQLYYWQFUUFQJX-UHFFFAOYSA-N 459.864 0.824 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)C1 919887119 ZKOAYPUCSKNUGY-IJEWVQPXSA-N 472.589 0.484 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)c1cncn1-c1ccccc1 1318196973 DTTWEALMARIDNO-UHFFFAOYSA-N 463.502 0.345 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc2c[nH]nc12 1777884624 YMYKBIKXBACREX-HYBUGGRVSA-N 462.315 0.684 50 20 JCGD Cc1ccc(SCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1778088987 NFKNQEOEALNESH-QHCPKHFHSA-N 454.357 0.911 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccn1)C2 1778091109 GGQIPMFTTMSRAW-VWCSSDMBSA-N 453.503 0.738 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)C[C@H]3OCCc4ccccc43)CCO2)C1 1779028881 KQFMTFACYZHRPW-BWKNWUBXSA-N 479.537 0.833 50 20 JCGD CC(=O)O[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2)C(C)C 1779206853 CEDORUHZDWOPNN-NQSCKRDGSA-N 454.568 0.461 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ncc[nH]1)C2 1779374762 DOYMHPIPBXGOCO-VGOFRKELSA-N 455.519 0.169 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)cc2NC1=O 1780175282 JEFQDPVNIJJLAE-BSEYFRJRSA-N 494.508 0.162 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@@H](O)c3cccc(Br)c3)C2)C1 1780968370 BAKYATZULLGOLL-VKJFTORMSA-N 461.740 0.912 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CS(=O)(=O)N1CCCC1)C2 1781999107 PZMVGBOHOQHZNQ-HDMKZQKVSA-N 480.425 0.709 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](COC(C)=O)OC(C)=O)CCO2 1783349985 XRUCEDYGQHYPBK-MPGHIAIKSA-N 463.325 0.485 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@@](C)(O)CC(=O)O)C2)C1 1783928647 LXPZMWFFESCGKS-LVXYXVKQSA-N 491.969 0.564 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]3C2)no1 1783967444 UEHDXGIEIIYWLO-DSRCVFDASA-N 471.352 0.724 50 20 JCGD O=C(c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2 1785245624 NGRMEOQLKZWUOA-PXNSSMCTSA-N 489.953 0.685 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)[C@H]2C1 1785332665 RJWRHDMPILMEGJ-JMUUTAKRSA-N 483.363 0.756 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786982333 YQLCLSRRKGGZDH-IHPCNDPISA-N 489.378 0.265 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@@H]1SC(=N)NC1=O 1787495356 LJKPTGBOSYJUGM-JNLQPACOSA-N 461.382 0.554 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCN(C)C3)C[C@@H]21 1787507782 SSZXVDQOMCRBNS-HQBWOOTPSA-N 458.563 0.442 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccoc1C(F)(F)F 1787593317 NNDWSHLMVFUIJH-JQFCIGGWSA-N 466.221 0.885 50 20 JCGD COc1ccc(COCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1 1788609781 JSIZPFIZVZTBGG-HSQYWUDLSA-N 497.552 0.504 50 20 JCGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)cn2[nH]cnc(=O)c12 1789177157 NDLYCNBICQAHMI-DHMWGJHJSA-N 466.336 0.708 50 20 JCGD CN(C)[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(Cl)cc1 1790673031 DYFZTJFXKNFXGB-QGQQZZQASA-N 499.804 0.916 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C1 1791330029 OPSKWVOVQOIJGH-ZSORPBTDSA-N 463.934 0.872 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1C[C@@H]1c1ccc(F)cc1 1792808378 MHIORGCUPIYAAI-PNBTUHDLSA-N 452.291 0.512 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C 1792889326 MKOHIECSXHNTEW-HPCHECBXSA-N 464.357 0.245 50 20 JCGD Cc1onc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)c1C 1793584433 KPHMQZOVKBRSRF-HATOLVCRSA-N 484.557 0.841 50 20 JCGD 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CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2 1802336673 SXRARDNORCNHMY-BJWYYQGGSA-N 456.547 0.502 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CNC(=O)c2cccnc2)[C@@H]1c1cccnc1 1804371650 SSEKQIHCMJMVPB-JPYJTQIMSA-N 481.557 0.285 50 20 JCGD Cn1c(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cccc1=O 1805312107 QOUWYXAOPKBHOX-IERDGZPVSA-N 475.509 0.412 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)no1 1807365791 YTRVRFTYKNPOPN-FDDCHVKYSA-N 491.313 0.406 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808357911 IVFFPYIQWHSUFG-ACIOBRDBSA-N 473.342 0.046 50 20 JCGD C[C@H](C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)[C@@H]1SC(=N)NC1=O 1809978110 MDXWVTUOGOQLJP-YOEHRIQHSA-N 472.376 0.014 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C[C@@](C)(O)CC(=O)O)[C@@H]1c1cccnc1 1813066409 AMCHGXGILODZCP-URZJWIJPSA-N 463.535 0.076 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCc2cnccn2)[C@@H]1c1cccnc1 1813445568 FRWUQJAKSAABLS-VGSWGCGISA-N 474.525 0.823 50 20 JCGD O=C(CCCn1ccnc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347650 IYGHXWACVOVPLJ-INIZCTEOSA-N 453.333 0.726 50 20 JCGD COCCn1nccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2 1817595175 OEEQBGPWKSHTAM-CYBMUJFWSA-N 463.564 0.585 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc4ncccn4n3)sc2C1)c1cccc(B(O)O)c1 1819010075 IYPYMRPXNJDUCL-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD CNc1nsnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819400208 DVOZVDLAOZGNAH-CYBMUJFWSA-N 470.519 0.921 50 20 JCGD CN1CCC[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)C1 1819798103 WBAOZWUQLLRLMD-QWHCGFSZSA-N 457.560 0.709 50 20 JCGD COCCOCCOCCOCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1 1822263746 BYEDJPMHXMQMBA-DLBZAZTESA-N 476.958 0.698 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc(=O)n2[nH]cnc2n1 1823002265 CBFSLMAPERSHRD-KGFZYKRKSA-N 470.284 0.790 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824522912 LLOZYZPVSRDYGJ-HNAYVOBHSA-N 479.603 0.599 50 20 JCGD C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825642631 TZWWVKHRURATDE-CABZTGNLSA-N 452.139 0.832 50 20 JCGD CCOC(=O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1828210473 IPDJFGHDBATVQO-CQSZACIVSA-N 459.333 0.638 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873722 URTRCLBLCGMRIA-OALUTQOASA-N 453.584 0.130 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ncc(C)s1)CCO2 1833801735 FRIMTUBIOURHPQ-SGSZHJQISA-N 474.543 0.656 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3c(s1)CCC3)CCO2 1834544804 BKSGPUJKMFPHLK-QHCPKHFHSA-N 470.356 0.300 50 20 JCGD COc1cccc(OC)c1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800950 BZRRKAYEXIWCFC-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD O=C1NCc2cc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCBr)CCO4)C3)ccc21 1834823480 WMRZPMTUHUQFCY-HXUWFJFHSA-N 466.332 0.785 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCC(=O)N3C)CC2)CC1 1835117815 NAPCRNYFTCLZDM-BJRSOBTISA-N 485.589 0.313 50 20 JCGD N#CC1(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)CCC1 1835737459 WBNAEBCFVOKQIP-UHFFFAOYSA-N 453.547 0.564 50 20 JCGD Cc1ccc(F)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1835932246 WGQBRDDRRCBHEQ-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)CCO2 1837471565 OGBMLICNKAAOEI-UEOMBKFZSA-N 494.378 0.324 50 20 JCGD Cc1nccnc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838394752 SXUBADJMDRXCRE-UHFFFAOYSA-N 467.530 0.710 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc3c1OCO3)CCO2 1838475668 SDSQPKVNXOKCSK-GOSISDBHSA-N 456.293 0.665 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1 1838513464 TWVDARMALYGCGK-ACJLOTCBSA-N 455.924 0.410 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(C)(C)C)C2)C1 1838528320 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CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4scnc4c3)C2)C1 1840184382 JDGOPYZHCQAWHU-QFIPXVFZSA-N 475.571 0.739 50 20 JCGD O=C(CC1Cc2ccccc2C1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840931691 WTUGEYGDORPQNM-AREMUKBSSA-N 478.354 0.242 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843010685 RIQDUJYSLMYDDH-MJGOQNOKSA-N 469.347 0.653 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012405 MEFVFIOLDUIGDU-SFHVURJKSA-N 469.347 0.440 50 20 JCGD CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012595 FDPIYDUFECBJBA-GOSISDBHSA-N 459.352 0.877 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)CC2)CC1 1847558418 DSERHKRHQZZJMW-SLFFLAALSA-N 454.999 0.511 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1 1847869152 NJJHHCCIZKTMTD-OLMNGRFOSA-N 456.996 0.776 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1 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C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1778344679 AVGDZYLXWINAAX-CMBDLQSPSA-N 459.971 0.919 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1nnsc1C1CC1)CCO2 1779030288 NIAHKNDHBQTQRY-HXUWFJFHSA-N 457.516 0.171 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)N(C)C(=O)OC(C)(C)C 1779032445 KAFALTJDJCFVKK-IQMFZBJNSA-N 490.561 0.384 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1779197657 JNOCPOBIXRFLOB-AOMKIAJQSA-N 495.964 0.982 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779294717 LHKUKLSQUGCACV-MGPUTAFESA-N 459.616 0.553 50 20 JCGD CC(C)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n[nH]1 1779372689 XCRXBNKINRSCTN-AUSIDOKSSA-N 469.546 0.973 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCNC3=O)C2 1781996418 IPBVILRBMVSYKZ-IOHHAYIISA-N 468.352 0.537 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1782173062 VKHKXTOSQFDYSA-KJGJOIRFSA-N 467.954 0.888 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3[nH]cnc(=O)c3c1C)C2 1782173470 DMASDWRPKBRBRF-WHSLLNHNSA-N 465.938 0.712 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)C[C@H]3NC(=O)NC3=O)CCO2)C1 1782863708 KIWZUWLCSLVMNO-FROPBJADSA-N 473.436 0.300 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)O1 1783019101 SJPHBFHCHBUSLM-GQIGUUNPSA-N 466.332 0.931 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1783687355 SBLJJJQXVMHMKL-VQTJNVASSA-N 485.405 0.749 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1785453856 WUTUPJYKJVWDAQ-OPYAIIAOSA-N 455.914 0.303 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCCC4=O)C[C@@H]21)c1ccc(B(O)O)cc1 1786979629 FTJLFBORIWHTNK-APTRMMRNSA-N 476.338 0.793 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981105 SGKKCFSOALUXOJ-WOBLBUSWSA-N 452.316 0.965 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)c1ccc(O)cc1 1786981787 LJYXCBLULYFYTB-VPPRVIDZSA-N 452.316 0.469 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3scnc3C3CC3)C[C@@H]21)c1cccc(B(O)O)c1 1786984361 AUFJDNARGUVFKV-SZMVWBNQSA-N 455.345 0.607 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790236673 DQPPSCVUHYFYLR-KNBMTAEXSA-N 485.277 0.629 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OCCCO)cc3)C[C@@H]21 1791290640 GBBADMPUHADEQB-JBACZVJFSA-N 476.574 0.414 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccc2)on1 1792406129 VHLLRAUWQVSVAX-VPTLXERWSA-N 476.493 0.857 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(=O)n1O 1794360739 TXPYIYNUGKDEGH-VTEUUUEMSA-N 486.437 0.436 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnn1C 1794783000 QMLHUJAHCNGGAR-HBCWATKFSA-N 457.443 0.771 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795735108 MHBIVBQGEQPHFG-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD CCN(CC)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)c1ccccc1 1795736956 RYJRTDJNWPKZJM-DVKRWUGUSA-N 479.386 0.653 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc3ncccc13)C2)c1cccc(B(O)O)c1 1795737719 MFULZWMCRKFVFO-NHKMSHSESA-N 459.311 0.361 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@H](c3ccccc3)C1)C2)c1cccc(B(O)O)c1 1795739069 NFLNVBTYMMGYQU-UDKICSLYSA-N 463.299 0.087 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)c1 1799098858 JMZOALNZMUHBPJ-WRHDZBKDSA-N 497.600 0.688 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c([N+](=O)[O-])c1 1799822875 YXRJIWNYSFVCER-NOXHYTERSA-N 455.851 0.184 50 20 JCGD Cc1cc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1F 1801753884 GUQYQQYSQOUVTM-DBWKPXFBSA-N 459.453 0.789 50 20 JCGD C[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1801966906 USHIGBYQRZQIHU-RODWMJHOSA-N 487.420 0.588 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)CSC1=S 1802107037 HYRVEZRNINRPID-HMVGFALLSA-N 454.401 0.673 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)C1 1804550121 VFSMEDZRBHLTGP-BCDXTJNWSA-N 475.326 0.577 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1806340244 AQBDSXXIBNTHOJ-LRDDRELGSA-N 475.307 0.312 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359926 FSDKDKXWZGKNPL-FXAWDEMLSA-N 474.282 0.519 50 20 JCGD Cc1nccnc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303531 UOPCGXRLCUKRAY-OXQOHEQNSA-N 460.498 0.812 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1812863242 FYKBPHIAHQYABI-NJZAAPMLSA-N 463.269 0.596 50 20 JCGD COC(=O)CSCC(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813068258 KZJRLXLFMQLIRE-IERDGZPVSA-N 465.576 0.367 50 20 JCGD O=C(Cc1ccc(O)cn1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347715 MCMUUPPCDXOALN-OAHLLOKOSA-N 452.301 0.392 50 20 JCGD Cn1ccc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)n1 1815549280 ZSVVLENKNIGBAP-LLVKDONJSA-N 454.516 0.344 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(O)nn2)n[nH]1 1816297588 SAOIVQMSCMRDSS-HNNXBMFYSA-N 451.447 0.524 50 20 JCGD Cc1cc(NC(=O)CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)no1 1817240849 UOLOUIIPQHEVRZ-CQSZACIVSA-N 483.315 0.374 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)CC1 1818814119 SHPWQBSMTAUBIU-HUUCEWRRSA-N 461.972 0.673 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1819582881 UCRLQNYJXGLIHB-MLGOLLRUSA-N 454.491 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOC1=O)CC2 1819797211 PWLZXEJLDOGCCB-NSHDSACASA-N 473.515 0.210 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSCC(=O)O)CC2 1819800033 JTNVURGGFGALKS-SECBINFHSA-N 464.529 0.185 50 20 JCGD N[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1 1827051258 QXERFMPXDGAUMT-FCHUYYIVSA-N 450.348 0.695 50 20 JCGD O=C(C1CC(O)C1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548207 FQIVZVBRZAYKPN-AKGDMFDRSA-N 479.961 0.809 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)N1C[C@H]2C[C@H]2C1 1828810605 TYQGESGQBGGRRJ-PIBIMKELSA-N 453.392 0.940 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1828966498 ADYRHEDWJDKTOI-SGXKBVARSA-N 497.955 0.566 50 20 JCGD CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCN2C(=O)OCc1ccccc1 1829000846 MBPHUIPKTIOPIE-DEOSSOPVSA-N 465.315 0.452 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1830533814 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O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)CC1)c1ccc(B(O)O)cc1 1834799326 WVMNLCJJCGRFJZ-GOSISDBHSA-N 479.390 0.080 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801534 ULVWTJKTJJRCIJ-GOSISDBHSA-N 480.374 0.414 50 20 JCGD O=C(Cc1ccccc1Cl)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835011963 WLGGMXBWAUFQCO-HSZRJFAPSA-N 472.734 0.333 50 20 JCGD COc1nn(C)cc1C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835118310 NFNPGWZJHWBYNQ-JVWAILMASA-N 498.588 0.748 50 20 JCGD CC[C@@H](C)[C@H](N)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737064 UZTJEPLAICLSGZ-QRWLVFNGSA-N 459.595 0.244 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1 1835937060 MUIFHKLXWWGIJZ-HSZRJFAPSA-N 498.732 0.280 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)ccc1C 1835939736 ZDGXFEXDYPENBC-XMMPIXPASA-N 468.315 0.067 50 20 JCGD O=C(Cc1cccnc1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919437 RPGOEKMDRNWWCT-UHFFFAOYSA-N 451.332 0.616 50 20 JCGD CCOC(CC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)OCC 1837922010 AUNRYXRTRQFOGG-UHFFFAOYSA-N 476.379 0.768 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)n[nH]3)C2)C1 1838528313 QAHHFUGPEPOCMQ-OAQYLSRUSA-N 489.441 0.333 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCO2)C1 1838628696 QXYFZHBJNBDXFG-JLTOFOAXSA-N 485.877 0.647 50 20 JCGD CN(C)c1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1838925017 VAWZZBBDUFKKGZ-XMMPIXPASA-N 482.541 0.135 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622482 HFZNQKDHMAXMTB-LAUBAEHRSA-N 453.971 0.806 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CC1)CCO2)NC(=O)NCc1ccccc1 1839757658 RSXRNFYZIQXOTR-QFIPXVFZSA-N 477.537 0.291 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1839967028 WZOKYNDACGBHJD-QYWGDWMGSA-N 497.390 0.830 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1 1840184245 FJBNCHLHQGCDFI-XMMPIXPASA-N 469.542 0.678 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1845566346 FOSIPQAVKXOERR-UHFFFAOYSA-N 460.292 0.040 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CSCC(=O)O)C1)NC(=O)NCc1ccccc1 1846391158 DYFVRVKKBGFYQJ-UHFFFAOYSA-N 463.560 0.354 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CNC(=O)c1cccnc1 1848138256 SNAXHWOHRIWAAW-SWERZJPOSA-N 451.487 0.147 50 20 JCGD O=C(NNS(=O)(=O)c1c(F)cccc1F)c1cccc(S(=O)(=O)N2CCOCC2)c1 21316330 OUDBTGPIHZKNMN-UHFFFAOYSA-N 461.468 0.609 50 20 JCGD O=C(NNC(=O)[C@H]1CCOC1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 109259110 RDFDWSTUDUMGSY-FQEVSTJZSA-N 472.567 0.991 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cnc21 727069329 UPMKBNOHOYXXJC-UHFFFAOYSA-N 463.248 0.125 50 20 JCGD COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728854297 PQNBCNONHNMBED-UHFFFAOYSA-N 463.516 0.645 50 20 JCGD O=C(NCCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)C1CCN(c2ncccn2)CC1 728944390 XCHMCHODUYAUHF-UHFFFAOYSA-N 481.966 0.655 50 20 JCGD O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1nn(-c2ccccc2)cc1O 729233613 STHWFELNNHAHJV-UHFFFAOYSA-N 479.545 0.914 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2 770428670 ZSNZRLPWZPBQGE-INIZCTEOSA-N 497.551 0.001 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)C[C@@H](C)O1 912919061 HWMXYSDZMMAPJA-VXGBXAGGSA-N 467.375 0.918 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1 913587967 MZHDFXSNZASOCG-UHFFFAOYSA-N 485.522 0.920 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@@H](NC(N)=O)c2cccc(C)c2)cc1 913687045 NYSOABCFTIQXGQ-GOSISDBHSA-N 461.544 0.871 50 20 JCGD COc1ccc(-n2nnc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2C)cc1 915060020 RGGREHZGZGZLGG-UHFFFAOYSA-N 458.500 0.909 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2CCN(C(=O)N3CCCC3)CC2)cc1 915617173 YKYSOVBVCFDXGR-UHFFFAOYSA-N 465.576 0.691 50 20 JCGD COCCNC(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 915879237 JIDBDJPZBNOVNO-UHFFFAOYSA-N 471.518 0.041 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1 916392219 QLIIEMXGDVMKMB-UHFFFAOYSA-N 455.471 0.177 50 20 JCGD COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NC(=O)N[C@H]2CCS(=O)(=O)C2)c1C 916418697 JXTQKIPBZFLFOT-STKCSNAVSA-N 466.516 0.214 50 20 JCGD O=C(NNC(=O)c1cnc2nc(O)nc(O)c2c1)c1cccc(S(=O)(=O)N2CCCCC2)c1 916726746 UWBBFZIIWZWAMI-UHFFFAOYSA-N 472.483 0.685 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2)cc1 916739571 OVUYTNAHCXGGSS-UHFFFAOYSA-N 498.565 0.654 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)c1nnc(-c2ccccc2)o1 919962228 XBJRHOPJHRGOCF-UHFFFAOYSA-N 463.497 0.801 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1 1778026226 OLSUGXCVIJPQHZ-SSHHRWTQSA-N 451.923 0.920 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1OC 1779029247 PVGYVJSUGUNTSC-RUZDIDTESA-N 497.552 0.779 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C2)C1 1779076507 NEYONWZWCPLPSZ-DAYGRLMNSA-N 463.325 0.485 50 20 JCGD Cc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)s1 1779371034 IGKUYKWQJJXPPK-IIBYNOLFSA-N 458.544 0.891 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3cncc3c1)C2 1779372688 XBNGYSNAVOSUQE-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnccc1Cl 1779588391 MMUZJRSUCSZVRM-DENIHFKCSA-N 457.723 0.856 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)nn1C 1780433921 ZVXLMOPYMRQUFU-VSIOZEBNSA-N 457.491 0.006 50 20 JCGD O=C(CN1C(=O)C2(CCOCC2)c2ccccc21)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1780932974 PJCPKZQFQXAWIE-CVDCTZTESA-N 491.972 0.511 50 20 JCGD Cc1nc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)co1 1780970284 UBBDAWPICMWNBM-QHCPKHFHSA-N 470.530 0.773 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781332473 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N[C@@H](Cc1cccnc1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1818071070 ZVZMUVQCLJIAKN-ICSRJNTNSA-N 462.319 0.360 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403798 GFMLQNRJPSYHGL-KQPPXVQYSA-N 454.491 0.754 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3c(c1)CNC3=O)CC2 1819798042 RRKRMPLFFWXDKJ-ZDUSSCGKSA-N 491.533 0.925 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822780977 JECVKOSTJQWIPR-KXBFYZLASA-N 450.308 0.928 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cccc([N+](=O)[O-])c3=O)sc2C1 1824717907 BKSZGVZUWOFFPB-GFCCVEGCSA-N 491.530 0.198 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)CC1 1825492339 WQWQVOIRYRFLAB-IBGZPJMESA-N 453.304 0.313 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060533 OCASKAGWNYSJGJ-FDDCHVKYSA-N 492.385 0.813 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828873085 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O=C(Cn1cncn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1836139496 MNPPNKLXKUYYCG-NQIIRXRSSA-N 492.374 0.741 50 20 JCGD CC(C)(C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccn1 1837461024 MRKZHLIJOHGKQE-DEOSSOPVSA-N 482.541 0.128 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1 1837713290 TYYQWVMYAQZQOI-FQEVSTJZSA-N 482.566 0.920 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919417 OWPLVVPURIHRCQ-NRFANRHFSA-N 486.403 0.005 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc(CO)o3)CC2)CC1 1837921206 LRWMKDXGLZLOKM-UHFFFAOYSA-N 456.304 0.378 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1839152938 OKMNJWPWFVVZKK-MOPGFXCFSA-N 461.346 0.972 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839175699 ZIVLAMTVJFAHRR-YOEHRIQHSA-N 451.289 0.643 50 20 JCGD CCOC(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)OCC 1839202591 KNAAORIFWHMFGV-RDJZCZTQSA-N 455.321 0.923 50 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CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CCOC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1840190695 IMVBWIXMGVMZEA-PMACEKPBSA-N 496.388 0.618 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2 1840948896 UFYHEKUGVHXEEN-FGZHOGPDSA-N 464.274 0.182 50 20 JCGD O=C1CN(CC(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)C(=O)N1 1841892460 JMWCOLMYWPBWSS-HNNXBMFYSA-N 463.332 0.748 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)O[C@H]2C1 1843012543 ZKMAGIOXPBQYOH-RLLQIKCJSA-N 499.373 0.208 50 20 JCGD CCn1c(-n2nc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)cc2C)cccc1=O 1843133112 ICVDAZJGOSDGEY-UHFFFAOYSA-N 489.341 0.173 50 20 JCGD Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)c1 27619312 HVEISODRFJUXPU-HNNXBMFYSA-N 464.544 0.810 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)Cn2ccc3ccccc32)c1 729540517 GMFRNISVAIGPJX-UHFFFAOYSA-N 457.512 0.469 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)c2ccccc2c1=O 743908268 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Cn1ccc2cccc(C(=O)N3CC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c21 1777969822 BVWCASMMJZDNQZ-DEOSSOPVSA-N 462.510 0.934 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2 1779032651 VWIAHYURZKQQSG-XXBNENTESA-N 451.483 0.132 50 20 JCGD Cc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372616 OJYXOTRSOYUKMA-VGOFRKELSA-N 453.503 0.225 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1ncccn1)C2 1779373358 NPRQHYZRQLMYRW-VGOFRKELSA-N 485.570 0.395 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc(Cl)n3)C2)C1 1779502105 UGJDZUHNDYZZNE-HMHIXTCJSA-N 459.894 0.708 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)c3ccn(C)c23)C1 1779999985 FLZAXVTUVFVKJD-HOYKHHGWSA-N 486.573 0.779 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCS1(=O)=O)CCO2 1780098704 QRUICOSBBVYCNL-RXVVDRJESA-N 495.510 0.541 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1781384087 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CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784092173 IMDPEDWVVXXPBO-DBWAAGBOSA-N 477.961 0.913 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CCCO4)C2)C1 1784957337 ZMNLEPHWUUGYEV-DEOSSOPVSA-N 450.300 0.449 50 20 JCGD COc1cc(C)ccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1785003184 LLEIVTRTFVTFMJ-HSZRJFAPSA-N 453.499 0.759 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)NC2(c3ccc(NC(=O)[C@H](O)CCl)cc3)CCC2)n(C)c1=O 1786129092 GSEJJFTUISXQST-OAHLLOKOSA-N 488.932 0.168 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)c(Cl)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981015 LWZDHONSEABTOR-OWQGQXMQSA-N 478.141 0.975 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@]3(F)CCCCC3(F)F)C[C@@H]21)c1cccc(B(O)O)c1 1786982736 AEORJOBPUATXIY-DBSRCYSRSA-N 468.281 0.877 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnccn3)C[C@@H]21 1787508144 IVFOVGSIQUZTMG-ZCQORZAUSA-N 467.530 0.523 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c(O)cccc34)C[C@@H]21 1788609924 STUZTBDVBBFLQI-JBYOLUDKSA-N 490.520 0.846 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(-c2ccccn2)[nH]n1 1788947298 NUUAOUPBAHJLSE-ZJBJCVSYSA-N 475.314 0.059 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[S@](=O)c1ccccc1 1790595427 KDCZLGGXZIWIQH-XFFJPXBMSA-N 484.383 0.156 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C[C@@H]21 1791257831 VRXNDZJPLSWBTM-COZGXFGHSA-N 489.997 0.590 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCN(C)CC2)cc1 1792458704 YXYWTMZTIXNPLN-YHELAOLJSA-N 464.994 0.895 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792975793 XNYRVCWMLIOQLE-YYIAUSFCSA-N 457.955 0.743 50 20 JCGD COc1cc(N2CCC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)CC2)ncn1 1793106358 FVUJRVSDGUOQGI-YVSFHVDLSA-N 451.955 0.940 50 20 JCGD Cc1nn(C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793544435 ZUIOKNHPTCMORX-HATOLVCRSA-N 483.573 0.278 50 20 JCGD Cn1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)c1 1793881085 OEIIGIUIIKLIRR-FQLMCAECSA-N 455.943 0.755 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)nn1 1794562976 CSRFTONFSVRQLD-LMWOUKEDSA-N 469.926 0.518 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1 1795732702 BNSJFMBICLGXAT-BBIADKPPSA-N 452.316 0.265 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN(Cc3ccccc3)C1)C2)c1ccc(B(O)O)cc1 1795732900 QCROPGUBUFIGET-AGDMDRQQSA-N 491.397 0.482 50 20 JCGD CN(C)c1cccc(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1 1796189883 LVHUYBUMJFIPNZ-NUZGMZIFSA-N 451.332 0.763 50 20 JCGD C[C@@H](Sc1cccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1797596505 BEIABHAAIZIPAH-JNNRSPCRSA-N 460.386 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1Cl)C2 1797750416 AMVDHXNMCZQWEE-YVWYUNDQSA-N 457.918 0.784 50 20 JCGD Cn1cc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)ccc2n1 1797754094 UMLXAUYQLBICES-CWPLJXCYSA-N 463.498 0.089 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1797956186 HXYYPUVIDJKSJQ-JLVBRIDZSA-N 466.636 0.333 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C#N)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)CC1 1799236357 MUGIRZFUZQGGCM-YVSFHVDLSA-N 484.981 0.717 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2 1799264430 JLWTXCHLUFQNEZ-YHDJZSDMSA-N 451.951 0.773 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2)[C@@H](F)Br 1799344123 AGSHVKNQJGPQSS-CZAMWMTLSA-N 482.306 0.953 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1801316552 UBVAGZSBIWRGGT-REGYPHIPSA-N 455.345 0.145 50 20 JCGD CC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1 1801443428 RQQJBIKINWONPQ-GTDBDLECSA-N 456.996 0.822 50 20 JCGD CC(C)(CCl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1802900444 YXICRPZBGGHYPZ-XJKSGUPXSA-N 458.910 0.792 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1803009683 BVXITBDGGKOBGJ-IFIJOSMWSA-N 466.336 0.670 50 20 JCGD COCCOCCOCCOCC(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1 1805528545 UOOQHIAYVUBSPL-GOSISDBHSA-N 464.987 0.514 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(=O)oc2)[C@@H]1c1cccnc1 1806120455 OVZOVQMCMCZJQP-QRWLVFNGSA-N 462.466 0.667 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CC[C@@H](N)C(N)=O)[C@H]1c1cccnc1 1807191918 FOBZCKUEDHACQT-JYYAWHABSA-N 454.369 0.854 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1nc2ccccn2n1 1807934959 PCFUFQKRBRBCSY-GHTZIAJQSA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@@H](N)Cc2cccnc2)[C@@H]1c1cccnc1 1808366095 YRPICOHHIJCNLO-NYVOZVTQSA-N 488.552 0.365 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1808416643 PRNLFFGFWYVZTC-XODNQNILSA-N 496.572 0.594 50 20 JCGD COCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1808824247 XHMSCLGOXSTGGM-HRAATJIYSA-N 458.519 0.909 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809978533 CZBPDNFCTAQAKP-UHFFFAOYSA-N 461.331 0.876 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(=O)nc3sccn23)[C@H]1c1cccnc1 1813073840 OZQWJMFXSAGTRM-IERDGZPVSA-N 497.581 0.844 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1 1813075218 XZKDNBXVLJBECK-JTSKRJEESA-N 455.519 0.329 50 20 JCGD N[C@H](CC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1cccnc1 1815339809 QECDJFQQLXXJCN-DLBZAZTESA-N 465.344 0.534 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cccn2c(O)nnc12 1817965969 IZHQNCQRVIUHAI-KRWDZBQOSA-N 475.274 0.458 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4c(c3)n(C)c(=O)n4C)sc2C1 1818357901 BRVKKCVLALGKOI-AWEZNQCLSA-N 499.597 0.932 50 20 JCGD CC(=O)O[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(C)C 1819248179 XVSBVBHYXLKSGD-UYAOXDASSA-N 456.308 0.983 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403288 CJMBSZUMCWMZFK-KRWDZBQOSA-N 464.486 0.727 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CC(c4ccccc4)=NN3)sc2C1)c1ccc(B(O)O)cc1 1824435278 ZMTNQBPXSACJHU-YLJYHZDGSA-N 489.366 0.815 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNCP(=O)(O)O)CC2 1825446660 HMJKHEGGAAUBAW-IUCAKERBSA-N 469.298 0.953 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)N1C[C@H]2C[C@H]2C1 1827052397 YAEZMOSPHDAZAJ-CPDIYIAASA-N 453.392 0.940 50 20 JCGD COC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548601 LSPCJEVJDOZAJF-FDDCHVKYSA-N 495.960 0.991 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)COC1CCCCC1)CCO2 1830384142 ODCDVIURAGDPSA-JOCHJYFZSA-N 454.568 0.165 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)F)C2)C1 1832549210 HJCBKGFIGXMBOR-KPZWWZAWSA-N 455.886 0.840 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1 1833027784 SKKDWSOCVMYEAH-LIRRHRJNSA-N 488.404 0.965 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)C1 1834819596 SBVASUVPXHGIEP-CLCXKQKWSA-N 461.353 0.817 50 20 JCGD CC[C@H](NC(N)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1835059014 KZSKYSYQHDKGCR-KBPBESRZSA-N 450.353 0.695 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@@H]1Cc2ccccc2O1 1835476782 OCXAPEJOPFXERJ-DEOSSOPVSA-N 477.370 0.555 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737412 RIDBTJNUSXJCGG-QGZVFWFLSA-N 495.584 0.733 50 20 JCGD Cc1cc(/C=C/C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)no1 1835776355 SVJORIGVQVXTCP-VOTSOKGWSA-N 466.347 0.561 50 20 JCGD O=C(Cc1c(F)cccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926294 LNUPVMFDYSKODU-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(F)c1 1835940189 YMSUIIKCNJWOCZ-VQEXNLMWSA-N 498.316 0.298 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1 1836962104 HPGCPRJWJDTLPM-QRWLVFNGSA-N 454.886 0.797 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)nc1 1837456162 DDARCVHQPZHFGA-XMMPIXPASA-N 482.541 0.091 50 20 JCGD COc1cccc(OC)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460070 RVBGBKULCREZOM-XMMPIXPASA-N 499.524 0.086 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCOC3)C2)C1 1838528234 MDIUFKZVJYJMRY-OPAMFIHVSA-N 477.470 0.627 50 20 JCGD CN1CCN(C2(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@](C)(Cl)CCl)C4)C3)CC2)CC1 1839107579 RWLYDGVNFYBUNL-WOJBJXKFSA-N 477.433 0.459 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1839152061 MFUIMAOJHDLOCR-OALUTQOASA-N 452.379 0.401 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201393 WGWVLGNEABXAOV-YOEHRIQHSA-N 463.304 0.290 50 20 JCGD CC(C)(C)Oc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1839342922 ZJGULEMRQHPJKF-SANMLTNESA-N 496.369 0.928 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCSC(=N)N)C2)C1 1839963346 IICQPEWBXAEAJN-LRDDRELGSA-N 451.387 0.633 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)n(C)n3)C2)C1 1839966129 VNHIRTJPNPWZNH-ACJLOTCBSA-N 459.341 0.672 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1840077830 NRKLYFATTJHTCU-SFHVURJKSA-N 457.351 0.316 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cccnn3)CCO2)C1 1840408173 LEVLRODMTZZOII-RDTXWAMCSA-N 457.325 0.343 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)CCCO3)CCO2 1840659799 MVZKOMWMLHQDER-RUZDIDTESA-N 480.326 0.075 50 20 JCGD CC(C)(C)OC(=O)NCc1ccnc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1 1843010674 QJUZFGFAULQLEI-UHFFFAOYSA-N 494.357 0.917 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O 12802074 UROIZBSHUUQKGG-AWEZNQCLSA-N 485.522 0.830 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)COc1ccccc1F 14843802 BZXZRGIUTOSBMD-MRXNPFEDSA-N 487.531 0.134 50 20 JCGD O=C(CCSCc1nc2sc3c(c2c(=O)[nH]1)CCC3)NNC(=O)[C@@H]1CCS(=O)(=O)C1 16145932 UENCFNURAZVULS-SNVBAGLBSA-N 470.598 0.679 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc(OC)c1OC 16594145 ASPWQEBVGUJGFA-UHFFFAOYSA-N 494.526 0.154 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1 17583270 UCIQDBHCUWRVHK-UHFFFAOYSA-N 458.500 0.202 50 20 JCGD COCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)OCC(=O)NNC(=O)c1cccs1 19420028 KADXRNCFVCMWMU-JOCHJYFZSA-N 486.506 0.678 50 20 JCGD O=C(CNC(=O)NCc1ccc(F)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 24575796 DDGOLDCXBOXQSL-UHFFFAOYSA-N 477.518 0.871 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)NC(=O)c1n[nH]c2ccccc12 726381990 KWPHQWHCKWXYEL-LBPRGKRZSA-N 457.516 0.744 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)Cc3cccnc3)CC2)cc1 728957302 RYJCRYICJVQGDP-UHFFFAOYSA-N 475.527 0.548 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)c1 729274707 AWNNYVYJWIUIBG-CQSZACIVSA-N 468.557 0.803 50 20 JCGD NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)Cn2ccc3ccccc32)c1 729450533 ZYZPICUYPFWHDB-UHFFFAOYSA-N 457.512 0.587 50 20 JCGD O=C(NC[C@@H]1CN2CCC[C@H]2CO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 729620436 YJNBYAYFJYOGES-ZWKOTPCHSA-N 465.576 0.668 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCC(O)CC2)c2ccccc2c1=O 745475084 UCNKCCMKJGZAOF-UHFFFAOYSA-N 491.551 0.215 50 20 JCGD CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(CCOC)C3=O)o1 746397162 MMXOVILMOZOCBI-UHFFFAOYSA-N 478.527 0.987 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C(=O)N3CCCC3)CC2)cc1 748247628 SRISTMWMFUVKIT-UHFFFAOYSA-N 480.543 0.034 50 20 JCGD Cn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c2ccccc2c1=O 749838437 OVJHFKFLXFPDCE-UHFFFAOYSA-N 455.905 0.388 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1)c1ccc2c(c1)OCCO2 751269527 HNRVZSWGEABNKA-UHFFFAOYSA-N 495.457 0.922 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 761448512 HKZSJTMFQLRLHA-UHFFFAOYSA-N 474.543 0.419 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CN1CCCCCC1=O)N(S(C)(=O)=O)CC2 913161640 RWOKKCALAYTQCQ-QGZVFWFLSA-N 496.586 0.503 50 20 JCGD NS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)s1 915906255 VHIJMVPUNJAIFW-UHFFFAOYSA-N 487.585 0.324 50 20 JCGD COc1cc(-c2noc(CCC(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)n2)cc(Cl)c1OC 918146780 MMGNSOCKNRFTPC-JTQLQIEISA-N 472.907 0.922 50 20 JCGD CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1 918398737 FCHHXXNOQGLEIT-LLVKDONJSA-N 474.586 0.819 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N[C@@H]1CCS(=O)(=O)C1 919886397 WECUQYWKBHRIMW-MSGBMKDASA-N 470.573 0.217 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ncccn4n3)C2)C1 1777830806 KIVCJBMOANVEAX-QFIPXVFZSA-N 495.452 0.715 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2n[nH]cc2c1 1777860996 MPMCEHBNQRGXEZ-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD Cc1nc[nH]c1CSCC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1778913228 IPHXZUXMLZZCNQ-FQEVSTJZSA-N 452.581 0.154 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1F 1779036057 VWIINDMCUFEXPZ-QFIPXVFZSA-N 457.462 0.590 50 20 JCGD COc1cc(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(F)c1 1779036631 BTUYVKCKERWSDO-QFIPXVFZSA-N 475.452 0.729 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n(C)n1 1779371223 TWYWRUUNCUGXPG-XMSQKQJNSA-N 455.519 0.168 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1779374553 OIODTJIZWBAEGQ-QWQRMKEZSA-N 472.315 0.503 50 20 JCGD COc1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)cn1 1780970047 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CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)CC1 1785349661 JEJBORQVPWMJEA-UZLBHIALSA-N 462.950 0.903 50 20 JCGD Cc1c(F)ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1N 1786947032 WLNBZTSPUOKQJX-IXDGSTSKSA-N 470.505 0.622 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611298 RTMCMMUSXMOFKB-ALGWMNEGSA-N 466.542 0.552 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1)[C@@H]1SC(=N)NC1=O 1789923024 QBGLUZURQVRSIT-ZNSCXOEOSA-N 465.345 0.459 50 20 JCGD O=C(COCCOCCOCc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1791144939 OXDQSDVKCNCBKO-KJJMTIBFSA-N 499.004 0.816 50 20 JCGD COc1ccc(COCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1791383016 UUIGXXKUDGTKQY-VJBMBRPKSA-N 482.342 0.185 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)[C@@H](O)C1 1792513895 IHKIIOZWQOVQFA-FQMQPWHVSA-N 459.971 0.842 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3c(Br)cc(F)cn3n1)C2)[C@H](O)CCl 1792983475 JFCSMZZITYGVQS-OTMMVIPVSA-N 490.717 0.434 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(F)(C1)C2)NC(=O)NCc1ccccc1 1793424738 LIPHJTALVOSLLS-HBYYELINSA-N 473.549 0.814 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1793875191 WWXKLMBETVHUHW-KOWPAETKSA-N 457.955 0.645 50 20 JCGD CS(=O)(=O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1795361989 DMFSVEADNMFCCB-BJUDCHGJSA-N 453.467 0.506 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795741303 SWJQDPQAXDZEPL-CEQLMSFQSA-N 466.299 0.060 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccnc2c1 1797055724 XKHJGBYHEPKKPG-WNICUGFOSA-N 475.509 0.967 50 20 JCGD COc1ccc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cn1 1798440690 KURUMJJJCXZKRC-BJWYYQGGSA-N 452.515 0.973 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ncccn1)C2 1798522707 PCYXBOJOEITIHB-USGNIVHTSA-N 469.454 0.756 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3C=CS[C@@H]31)C2)NC(=O)NCc1ccccc1 1799098050 ZEDJNAOKTWVFEU-PACCEGMYSA-N 485.610 0.797 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCCCC1=O)C2)NC(=O)NCc1ccccc1 1799869395 NXAXOIMIKNAKKF-WKCHPHFGSA-N 484.601 0.983 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1800321303 GCFAKBVVPSGQJX-ZIVKBKJYSA-N 486.495 0.106 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1802088336 YQZWNWLFUACZJZ-RNJOBUHISA-N 482.361 0.836 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1802148806 OISPBFRHRRJRCF-GGFUIZRSSA-N 495.346 0.035 50 20 JCGD O=C(CNC(=O)c1cccs1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804572899 RXESAGGOBKWZDL-AVRDEDQJSA-N 492.366 0.573 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnsn2)[C@H]1c1cccnc1 1805001000 WOJXLHUCSVMPMW-CXAGYDPISA-N 452.500 0.565 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnc(OCF)cn2)[C@@H]1c1cccnc1 1805034384 PSXOAYMYARBCMG-IERDGZPVSA-N 473.509 0.870 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)CC1 1806535882 NAAISAALXFLWMS-UHFFFAOYSA-N 474.216 0.566 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)ccn1 1807362565 VYBBBCKNFIKXKF-SIKLNZKXSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2ccc(F)cn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370364 BWKHNTJKPKDFDO-WZONZLPQSA-N 462.290 0.858 50 20 JCGD CN1CCN(CCC(=O)N2CCCC3(CCN(C(=O)CCC(=O)NN(C)C)CC3)C2)CC1 1809554281 FCUNMSPXWHKWCJ-UHFFFAOYSA-N 450.628 0.228 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnn3ncccc23)[C@H]1c1cccnc1 1813070978 OWCKKYZBAXVBMC-VGSWGCGISA-N 464.530 0.817 50 20 JCGD Cc1cnn([C@H](C)C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1813379997 PNLRUYKVBGUAIE-PIPMEXSNSA-N 461.331 0.847 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)CC2)c1ccc(B(O)O)cc1 1815336054 ZADXGLOUBAAYSC-LBPRGKRZSA-N 456.245 0.864 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nn[nH]c3c1)CC2)c1ccc(B(O)O)cc1 1815348833 ZAPWACYZAGOICJ-AWEZNQCLSA-N 462.300 0.634 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)nc3sccn23)[nH]n1)c1cccc(B(O)O)c1 1817476617 MWINWBWEWJMNGU-INIZCTEOSA-N 492.326 0.779 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476654 YHJDYASATROVSC-SFHVURJKSA-N 462.275 0.429 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)Cc2cccnc2)n[nH]1 1818073593 SQLDFVFTAFMAKV-WMZOPIPTSA-N 456.551 0.740 50 20 JCGD O=C1Cc2cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3cccc(B(O)O)c3)CC4)ccc2N1 1818924098 WONLLMSMYCZFAE-MRXNPFEDSA-N 476.323 0.857 50 20 JCGD COCCn1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819796934 IUIDMFDDIMNKPD-GFCCVEGCSA-N 484.542 0.524 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)[nH]n1 1822410556 LYYRJVQMQLSQSI-OAHLLOKOSA-N 458.479 0.577 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2)N1CCN(C)CC1 1822692956 SEGABMZBQINMQL-KBPBESRZSA-N 486.602 0.003 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc(O)n3c1CCCC3)CC2 1826088018 NNVBXFPEWAWSFG-LBPRGKRZSA-N 475.575 0.980 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)C3CCC(O)CC3)sc2C1 1826354343 RWSLVOCHQXKTLF-OTTFEQOBSA-N 458.544 0.919 50 20 JCGD O=C(c1cnn2ncccc12)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053201 XNUDMLWKAAVZQF-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828593267 ACZRIUOKXFWQMQ-QSAZIKIQSA-N 494.976 0.550 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1c(F)cccc1Cl)CCO2 1830289913 NMUWFJWREIXCSA-JOCHJYFZSA-N 484.956 0.851 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](C)CBr)CCO3)C2)n1 1830539187 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CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1834560595 MRKJZYOCUXJECY-VLIAUNLRSA-N 453.927 0.104 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)[C@H](F)Cl 1835082930 HROYSLDYBVJTQF-HNNXBMFYSA-N 450.989 0.953 50 20 JCGD Cc1ccc([C@@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1835940148 WLXFQEVOBCXMOD-KBMIEXCESA-N 466.343 0.549 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836726250 JDNXDMSXUBRPOC-QFIPXVFZSA-N 457.380 0.463 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1 1837493699 RSUOISUIQQZZMI-JXFKEZNVSA-N 457.365 0.925 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920798 GTESBAKVDNBBNW-UHFFFAOYSA-N 489.378 0.503 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(F)(F)F)nn3C)CCO2)C1 1838080987 XDRUWMKRPIRUAF-SJKOYZFVSA-N 468.860 0.763 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838657095 OLQREAILIHTZTM-UHFFFAOYSA-N 462.595 0.941 50 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(F)(F)C(=O)O)C2 1798522127 GVOCPAJUSZRTCN-DPIQGUFMSA-N 485.396 0.833 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl 1799273939 WNCZVIGJMUGKPM-YQOMCPPKSA-N 486.396 0.992 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)ccc21 1799347542 PQPWXIMBHODTOT-NOXHYTERSA-N 469.311 0.771 50 20 JCGD COC(=O)C12CCC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)(CC1)CC2 1801011531 MZTHRQYYUNGTDQ-IQSLYQAOSA-N 478.590 0.463 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Br)nc1)C2 1801012639 TXKLFHKIMCAWSX-YVWYUNDQSA-N 482.379 0.349 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)nc3cccnn23)[C@H]1c1cccnc1)[C@H](O)CCl 1803141332 MZFATPPGWCZKNR-GMBSWORKSA-N 456.890 0.404 50 20 JCGD O=C(CCC(=O)N1CCCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804152388 XOFAENLCYGTZSH-HYBUGGRVSA-N 478.358 0.484 50 20 JCGD 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O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nccc2nc[nH]c12 1817928961 QRBHDSHJRDHONC-KRWDZBQOSA-N 459.275 0.981 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401524 GFTQWSSNBGKIEU-LRDDRELGSA-N 492.562 0.042 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CSC1=S)CC2 1826092114 MOCXEBQIPSRDMK-JTQLQIEISA-N 484.629 0.288 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)n3cnnn3)sc2C1 1826977000 RAPXFVJKRSAZRG-ASDXFMOLSA-N 470.519 0.437 50 20 JCGD Cc1cc2nnc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)CC3)c(C)n2n1 1827052964 QPKMKNZTESKHOV-NRFANRHFSA-N 490.373 0.968 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1 1829023829 BJXSQRTUCSQBQI-BMGDILEWSA-N 451.955 0.814 50 20 JCGD O=C(COCCO)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1 1829227639 JWSKRGFJJGTLEN-NQIIRXRSSA-N 471.913 0.982 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)N3CCN(C)CC3)C2)C1 1830543293 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O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3)C2)C1 1835937467 YEXPEIWQCJDAJZ-TZBSWOFLSA-N 498.772 0.894 50 20 JCGD CN1CCC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)C1 1836352425 TVMKFVKMYXXRMV-GOSISDBHSA-N 450.628 0.273 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4cc[nH]c34)C2)C1 1837460051 ZTTRCKQXTPITIM-DEOSSOPVSA-N 478.509 0.550 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCOC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cnc2c1 1837713130 JCYVINGKZAACME-HSZRJFAPSA-N 488.617 0.924 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3F)CCO2)C1 1838855590 HRXLGEUISGAICC-QFIPXVFZSA-N 457.462 0.208 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)CCO2 1839075601 BAQLGQLQIHQHTK-WHSLLNHNSA-N 477.986 0.952 50 20 JCGD CNc1nsnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839149744 QSGRJUVESHGWRN-JKSUJKDBSA-N 452.364 0.886 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)N1CCN(C)CC1 1839154582 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465.557 0.693 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1779000482 WQCLPDXUEKBCIG-QHCPKHFHSA-N 456.424 0.861 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)C[C@H]3OCCc4ccccc43)CCO2)C1 1779028895 KQFMTFACYZHRPW-PXDATVDWSA-N 479.537 0.833 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(-c2ccccn2)[nH]n1 1779771445 UIYZGOQDJBBFDF-RCZVLFRGSA-N 489.341 0.593 50 20 JCGD Cc1c(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)cn2[nH]cnc(=O)c12 1780020316 SEJMNNGILBZRTE-SFHVURJKSA-N 452.309 0.560 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1781291104 KBYPNZGPGXCYMV-SGXKBVARSA-N 467.950 0.979 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(-n3ccnc3)ccn1)C2 1782212163 KULZJZJYTKLZBP-HYBUGGRVSA-N 483.573 0.768 50 20 JCGD O=C(CCNC(=O)c1ccccc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1783099548 VMWSPXQXONOUDJ-ATIYNZHBSA-N 493.369 0.314 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]43)C2)C1 1783469792 ZKLRFEKMOFXNMH-JJLPPOTMSA-N 493.605 0.302 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1783553689 DOFQRCQARMKCPD-YWWLGCSWSA-N 499.373 0.209 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1783696596 QZUZFGMTKKYXCJ-ZFTMLNQLSA-N 468.290 0.671 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)CSCC(=O)O)C2)C1 1783957254 PDSAMOYBJOQJQK-FQEVSTJZSA-N 481.483 0.781 50 20 JCGD Cc1cn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)c(=O)nc1O 1783975136 GIDUYAUTWITJJU-MXAVVETBSA-N 471.352 0.268 50 20 JCGD COC(=O)c1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1784205591 OANWOYJMOLGLIC-JBACZVJFSA-N 488.585 0.759 50 20 JCGD COc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1F 1784700127 GHZUAFMSOKOXGF-QHCPKHFHSA-N 456.279 0.200 50 20 JCGD 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Cc1ccn2c(=O)c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)cnc2c1 1796189028 NQTMTSJYNOXVHA-REPLKXPHSA-N 460.299 0.248 50 20 JCGD CN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796370174 IERZTRMUQSMUJM-AEKWLRTRSA-N 492.976 0.872 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCC3)C2 1796441969 KQFAWTWDYCDSKO-FFZFCVPESA-N 467.530 0.557 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(C)nc2ccccn12 1796837013 NWURIRZMWALCSU-XSLZEOFGSA-N 477.525 0.980 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CN(C(=O)OC(C)(C)C)C1 1797716172 SSIQKERNZLKYFI-BJWYYQGGSA-N 451.568 0.865 50 20 JCGD CSc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1798328186 SVISBECBTQYYHX-FVCICTRLSA-N 456.528 0.319 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)Nc1cccnc1)C2 1798524946 RJTFBCPAKQZNFV-YVWYUNDQSA-N 497.464 0.757 50 20 JCGD 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0.502 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1830734991 BQFCVVIDLLNEDW-YRILPIOLSA-N 480.871 0.199 50 20 JCGD COc1ccc(COCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830738001 KZIQCMQTMSRJQV-GHTZIAJQSA-N 456.923 0.268 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)C(=O)c3ccccc3)CCO2)C1 1831151320 ZQWKZWKQWOKDOA-AVRDEDQJSA-N 467.950 0.469 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832080230 IRUCDPMAQRBEDJ-YVHKJVDXSA-N 489.997 0.832 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1scnc1C1CC1)CCO2 1833730267 WBACFWNEHWRCIQ-QFIPXVFZSA-N 486.554 0.403 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)Cc3ccc4c(c3)OCO4)CC2)CC1 1834539985 CKEYNHSZOOFHMM-UHFFFAOYSA-N 487.601 0.902 50 20 JCGD COc1cccnc1CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797359 GEOVSFMRBCUSMS-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD Cc1cc(C)nc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834798054 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C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1839151773 CUWBFVPSDAFOIZ-JCGIZDLHSA-N 465.403 0.706 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1839154256 IJBVLASFWOJRHC-VQTJNVASSA-N 470.357 0.965 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](Br)Cc3ccccc3)CCO2)C1 1839802243 POBIRWQULYJCNN-PERKRYKHSA-N 496.402 0.974 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)n3ccccc3=O)C2)C1 1840033714 NNJVZCRCTWHHOI-YZVOILCLSA-N 456.337 0.649 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1840035461 SAUIAMWENGPAIA-VFNWGFHPSA-N 481.391 0.623 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=C4c5ccccc5C(=O)N4CC3)C2)C1 1840154024 ICYZHBGQHYXNJI-YADARESESA-N 489.956 0.967 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2n1 1840185423 QLHDWCNRLSFSFF-XMMPIXPASA-N 486.573 0.394 50 20 JCGD CCC(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1842634720 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COc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1 1817473189 KSKLGFCBLXTSDF-QGZVFWFLSA-N 450.264 0.508 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc3ncccn23)[nH]n1)c1cccc(B(O)O)c1 1817476130 HETIBAAUQUZFLZ-QGZVFWFLSA-N 459.275 0.752 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnn3c2OCCC3)[nH]n1)c1cccc(B(O)O)c1 1817476899 GPLXDEHGXGGQIL-GOSISDBHSA-N 464.291 0.688 50 20 JCGD Cc1nnc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)s1 1817571403 NUQQIHFTUTTZDJ-MRXNPFEDSA-N 454.321 0.798 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1820142846 RFPXGHOQWYBBEP-MNOVXSKESA-N 457.516 0.058 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCNC3=O)CC2 1825999726 UZSCBDJHEWGVIZ-NXEZZACHSA-N 452.924 0.563 50 20 JCGD O=C(c1cnn2cccnc12)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059263 JVZNMKQGFFCQDL-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1829114535 ALVIHUVRVRIKOM-PMACEKPBSA-N 474.562 0.070 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1830542664 BBORMAOPOKNZAB-BZLDKRAPSA-N 486.407 0.875 50 20 JCGD O=C(c1ccncc1C(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728595 VQZZPWZPEUHRLN-RHSMWYFYSA-N 451.829 0.770 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830732827 BKFZBVXIKAEMSN-UWJYYQICSA-N 454.907 0.533 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1832396496 JPSBXUJWEZQBQC-IBGZPJMESA-N 450.366 0.034 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@@H]1CCC(F)(F)C1 1833043449 RHFBTVSZSPOHIF-QGZVFWFLSA-N 463.334 0.987 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncn(-c4cccc(F)c4)n3)CCO2)C1 1833354071 LSNODSYSGSUDAC-DYESRHJHSA-N 481.912 0.730 50 20 JCGD Cc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)c1F 1833702286 PQXDDTLBAZJHHH-SGTLLEGYSA-N 461.332 0.969 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(C)(C)C 1836799014 BEOSZDWYRDTHDO-JOCHJYFZSA-N 487.406 0.529 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1 1837046369 CQMMGMORVMBDPZ-IBGZPJMESA-N 463.362 0.773 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1837116886 AHIHKBCEYJACJN-RISCZKNCSA-N 459.341 0.367 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1 1837457973 YZGXVPHOQCYZRE-QHCPKHFHSA-N 471.489 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C3CCCCC3)C2)C1 1837459969 PXPMBKWAKNDQBU-DGQXCUQSSA-N 471.558 0.892 50 20 JCGD CC(C)C1(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CCC1 1837460308 ASIYCTFFBDQONW-JOCHJYFZSA-N 459.547 0.581 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc43)C2)C1 1837460764 JZSXTMJJKILQRS-NLFFAJNJSA-N 479.537 0.485 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)[nH]1)CCO2 1837763512 PEELOQMCFLQHCJ-FQEVSTJZSA-N 481.236 0.097 50 20 JCGD O=C(Cc1ccc(O)cn1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922160 RRWNOYXMGYQWLN-UHFFFAOYSA-N 467.331 0.322 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn(C(F)F)n1)CCO2 1838033670 PEZAVIUMUQILTN-PFRKPPGBSA-N 493.471 0.482 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)CCO2 1839037426 LBSAEOMCOBQKBR-QRFQSNJMSA-N 485.940 0.654 50 20 JCGD C[C@@H]1C[C@]1(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839091393 FCEPFSWQQCHPTL-BTZRARBUSA-N 487.601 0.835 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839351686 HGZTVAPCOCXDDQ-RDTXWAMCSA-N 458.284 0.546 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839670181 UODVLQVPHCFXSN-ROUUACIJSA-N 463.318 0.254 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1839718841 QNBFUOQYXAISPX-RTBURBONSA-N 491.328 0.449 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839881099 LLGJXENETYZLPU-WVBUVRCRSA-N 496.402 0.974 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840085850 NXUNQQQWTQQISY-WUQPGSQJSA-N 492.548 0.677 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1 1840153257 IVBDPZCZGAVSPD-FBZIKSMQSA-N 463.918 0.732 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)nc3C(F)(F)F)C2)C1 1840153271 JICHTPIIJWLFSG-GUYCJALGSA-N 468.860 0.763 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1 1840184243 FJBNCHLHQGCDFI-DEOSSOPVSA-N 469.542 0.678 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1 1840185293 JOLPZPNMUAHFEI-NRFANRHFSA-N 454.474 0.408 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1 1840187559 JCTQYQVELLLYFL-GOSISDBHSA-N 480.370 0.500 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)CO2)C1 1841353891 WPHSJGFJHKQAEC-GJZGRUSLSA-N 457.955 0.816 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1843415545 WRLOBPMSKBTPNK-ZKJHFGPLSA-N 481.513 0.330 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263435 FUMYESQDWQYTTP-INIZCTEOSA-N 458.519 0.512 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CNC(=O)c1ccco1 725740788 YMNUEWFSGNTFAS-CQSZACIVSA-N 484.918 0.044 50 20 JCGD CCCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 728017907 BCVOLLADDOHSOT-MRXNPFEDSA-N 456.590 0.855 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1)c1cnn[nH]1 729457134 ZAYDZFKRZNCPDU-UHFFFAOYSA-N 462.410 0.565 50 20 JCGD COc1cccc(/C=C(/C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n2nnnc2C)c1 818024202 IMXJXTCNYRDWNM-UNOMPAQXSA-N 485.526 0.700 50 20 JCGD O=C([C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1)N1CC[C@H](B(O)O)C1 864232601 ANRLWVBVOSRLIV-MNOVXSKESA-N 451.173 0.987 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(Cl)ccc2-n2cnnn2)cc1OC 915414303 QDSJLMZAHXJYCY-UHFFFAOYSA-N 460.834 0.951 50 20 JCGD COc1ccccc1OCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915889794 NEVWMEQZFBYERQ-UHFFFAOYSA-N 478.527 0.739 50 20 JCGD CN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Cc1ccccc1 919790498 QZRKDBRBMSLKQR-UHFFFAOYSA-N 475.571 0.784 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(F)(F)F)ccn3)CCO2)C1 1779032674 QQKGGIWLIWFKOE-FQEVSTJZSA-N 478.431 0.856 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1 1779034999 ZDGZNHPBDCGSQI-JOCHJYFZSA-N 459.453 0.650 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)N3CCOCC3)C2)C1 1779094542 DCCAZPROUPEKKD-BYOQUERRSA-N 476.480 0.352 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779277970 KRPYXDJDYWIGJD-LRAJWGHMSA-N 472.970 0.639 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1779342313 GJMHUABDYWLBFI-OJLHXUGZSA-N 483.529 0.503 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)NC(=O)c2cnccn2)C1 1779473481 CFQVSISSMVXABK-LPRVAIFDSA-N 482.379 0.892 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc(-n2c(O)nnc2O)cc1 1780103161 PXLPDFGSCPDMLG-WHSLLNHNSA-N 479.921 0.406 50 20 JCGD CC(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)on1 1780199012 WXXDPRGNWUEVFG-NFBKMPQASA-N 455.320 0.919 50 20 JCGD C[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1781993369 HDTYBHQBAUMWHC-LYHRCORUSA-N 461.563 0.227 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1sc3nccnc3c1N)C2 1782210922 ZQUDZZPYDSKWMB-JLCFBVMHSA-N 489.602 0.774 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(OC)c1 1782992619 PZVSEDXEVGFKMY-VWLOTQADSA-N 482.342 0.460 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1783450476 OKEDCIQWYVPCMT-CLOONOSVSA-N 499.373 0.067 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1783614855 GFVVVGSEYCKKQZ-QJNYJZHLSA-N 494.358 0.877 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1783614859 GFVVVGSEYCKKQZ-ZYKCCNLVSA-N 494.358 0.877 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)C2)C1 1783787732 XTQHMQLWMDXFLK-ZSDSOXJFSA-N 491.969 0.527 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCOc3ccc(F)cc3)[C@H]2C1 1783788033 ODPQEGREQPMJGJ-JHVJFLLYSA-N 485.516 0.887 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(=O)N(Cc4cccs4)C3)C[C@@H]21)[C@H](O)CCl 1784086091 SSDQQWRZOSLJFD-XWJBARJFSA-N 469.991 0.676 50 20 JCGD CCO/C=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1784235024 MBCITDZJWSYEDJ-LEBWJFOGSA-N 459.547 0.713 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccccc3OC(F)F)C2)C1 1785144470 RYAHOGHWKFIOAT-JOCHJYFZSA-N 460.242 0.725 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1785272455 MPKAJLZZYSYGRO-QHCPKHFHSA-N 485.733 0.736 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785505914 RPLAELHUBSVADR-ORRKXHIMSA-N 497.508 0.781 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)nn1C(F)F 1786981114 SWZSHZOIQQSTRS-ZVZYQTTQSA-N 462.262 0.174 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COC3CCCCC3)C[C@@H]21 1788607828 MHEFZZIFJDXQES-YSSFQJQWSA-N 459.547 0.628 50 20 JCGD CN(C)c1cncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788611688 QYIKBMXUPQFLCH-GKCIPKSASA-N 467.530 0.053 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCn3cncn3)C[C@@H]21 1789221808 GRJWHVBJTOTKRO-QSFXBCCZSA-N 486.485 0.795 50 20 JCGD O=C(NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)c1cccnc1 1789922498 NUMWHNLUVPFRCU-RZLSGREXSA-N 457.300 0.482 50 20 JCGD CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1cccc(Cl)c1 1792978662 LUBAADFVDXMIGV-WTNVTLLGSA-N 458.342 0.707 50 20 JCGD CC(C)(C)OC(=O)N1CCn2cnc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)c2C1 1792981875 YEEVFJIGDXRJNF-YALNPMBYSA-N 497.980 0.437 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792982461 DPDJOLKZIMWRAB-UHDSXZAQSA-N 459.971 0.823 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792983807 OTIVJDPUNLSMDV-YIDVYQOGSA-N 457.955 0.433 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1793087387 CCZIPZURLZTYNH-YVECIDJPSA-N 454.351 0.655 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1794154618 VVFBVTBTDBLDDO-BVRUVYRISA-N 496.992 0.707 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795740569 ARZNUGQKMPWTJC-ZTDQHOIESA-N 499.373 0.039 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n1 1796440960 GZTONWOHSGLIHN-UIZNVDRRSA-N 481.513 0.377 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cn2ccc(Cl)cc2n1 1797106019 ZBBAMBKFKJKNSI-YVWYUNDQSA-N 468.706 0.185 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)N1C[C@H]2C[C@H]2C1 1797629801 IUNGWSIGVVBBDD-BYSCXRCNSA-N 456.547 0.050 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)c1ccccn1)C2 1798522450 YHOZTXOTJDUTNT-YQMDMEMYSA-N 483.481 0.818 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc2cccnc2cc1F 1799241496 ZZZGZXFZRAUDJQ-GPVSGQMNSA-N 492.511 0.818 50 20 JCGD CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)C2 1799265809 MTBMHFJWMGDMKF-NEXGVSGLSA-N 459.971 0.964 50 20 JCGD O=C(Cn1nccn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1799412474 JMWFFRGMQGIELJ-SFNKJDCFSA-N 462.348 0.874 50 20 JCGD COc1cc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c(F)c1 1801012465 HKIHBOYSXHCRFC-NXCRSVRDSA-N 454.474 0.550 50 20 JCGD CC[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)NC(=O)OC(C)(C)C 1801012819 ZLUHHBKUWUUWSY-KYFSNAEOSA-N 483.610 0.642 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cc(O)n(C)n2)[C@H]1c1cccnc1 1804894236 YQDWAEQYDHAKTB-CUVSIRLISA-N 478.513 0.974 50 20 JCGD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1C 1805590969 IUDSHPBDUSMKQN-UZLBHIALSA-N 462.514 0.755 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(Cl)nn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362577 VYZOKBYSCVZPAH-OXJNMPFZSA-N 465.706 0.838 50 20 JCGD N[C@H](CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccnc1 1807364200 PIWGWVBCLOXPNS-BGWNEDDSSA-N 473.342 0.566 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1C 1807365881 PRAJVSLFVGLNJV-AUSIDOKSSA-N 461.331 0.366 50 20 JCGD CCc1[nH]nc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1807369486 LOXSIHADICDYTH-HRAATJIYSA-N 465.294 0.819 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)n(C)c1=O 1808309930 UEZOQSATNJLHTE-UKPHBRMFSA-N 491.911 0.069 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc2n(n1)CCC2 1809979799 BCPCZPNAUWTCNL-PGRDOPGGSA-N 459.315 0.538 50 20 JCGD Cc1c(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cnn1C 1810300445 YJNYDSXNPVIEGQ-OXQOHEQNSA-N 462.514 0.755 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccc1-n1nccn1 1811469737 JRTZZMHZPFCTAA-YKSBVNFPSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnc2c(c1)CCNCC2 1812378816 DYVOTOKIPCDASC-SQJMNOBHSA-N 499.380 0.478 50 20 JCGD NC[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1ccccc1 1815339609 JWKSEWJXCRXXOV-ROUUACIJSA-N 464.356 0.791 50 20 JCGD CC(C)c1nc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)no1 1815350172 HWSVXVWXDONCTB-CQSZACIVSA-N 469.332 0.798 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800605 QDZFLQXEHKXIEF-BXKDBHETSA-N 452.924 0.621 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826806142 MJZQSHFKWHUTJX-CZUORRHYSA-N 466.328 0.911 50 20 JCGD CN1N=C(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CCC1=O 1827050199 IHBQRFWVVTWBDU-HXUWFJFHSA-N 454.336 0.208 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1 1827599183 FMFOHVRDACZVLU-SFHVURJKSA-N 454.292 0.115 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)C1 1830428783 MFZYVJXDUXZZJY-AVRDEDQJSA-N 483.924 0.758 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1csnc1C)CCO2 1833745082 DOWYUQIAQMYVEN-CPOKCXMASA-N 474.543 0.656 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cc3ncccn3)CC2)CC1 1833875330 PCAZSLYDVZLZMW-STBIYBPSSA-N 480.573 0.725 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)nc1)CCO2 1834275404 HEFXEZWOIPVNLJ-FQEVSTJZSA-N 487.479 0.543 50 20 JCGD Cc1cnn(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835737069 VFTWWQFJQIOFFK-UHFFFAOYSA-N 468.562 0.075 50 20 JCGD Cc1ccc2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)sc2c1 1835929168 DJEDKXVLMIZNMY-XMMPIXPASA-N 495.366 0.668 50 20 JCGD CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1836005450 OBPDEMAIQUURQC-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccc(F)c1[N+](=O)[O-] 1836452024 RYVDIYSICMFMSD-UHFFFAOYSA-N 498.320 0.913 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCCN3C)CC2)CC1 1836725653 SQUUZEMSEDUUFF-HXUWFJFHSA-N 451.612 0.842 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ncc(F)cc3F)CC2)CC1 1836985816 SFWWOAKFKSTSNF-UHFFFAOYSA-N 473.285 0.966 50 20 JCGD Cc1[nH]nc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1F 1837331330 NLUDCWVKKXJDMD-UHFFFAOYSA-N 452.531 0.842 50 20 JCGD Cc1noc(C)c1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837437241 GWZBNUUSFDMZHT-UHFFFAOYSA-N 455.320 0.897 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nc(O)n3c1CCCC3)CCO2 1837759213 WGIALIMBAZPZQO-OAQYLSRUSA-N 466.611 0.847 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922183 UHZRPAZDKNZXJE-JOCHJYFZSA-N 473.379 0.283 50 20 JCGD CCn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)cc1C 1838149319 FXMVVJHMMSLCIX-VAHWYXDJSA-N 485.545 0.415 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1839153164 CLGOFMKWAABGBV-OALUTQOASA-N 459.330 0.713 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)C1 1839199198 SCQMWJSIBKGSKQ-HNSFDTNUSA-N 465.316 0.723 50 20 JCGD O=C(c1n[nH]c2c(Cl)cccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839495312 XGQMLZKDJPWXFC-KUHUBIRLSA-N 457.314 0.886 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc2N1 1839607980 DDRSZLQYAAQLRZ-LAUBAEHRSA-N 451.907 0.241 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(S(C)(=O)=O)c3)C2)C1 1840030775 WINRIKDIZMFFEV-KUHUBIRLSA-N 489.388 0.944 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1 1840144254 VZESESIMJUGNGP-ASKKUZCQSA-N 473.364 0.982 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(OC)cc3)C2)C1 1840149566 SQYSKLXXYIPYAM-WIYYLYMNSA-N 456.923 0.784 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1 1840152732 RGZFIGRDUATUJJ-YWZLYKJASA-N 451.911 0.362 50 20 JCGD CCC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)n1cccc1 1840183869 FQBQUWDGIFPBPA-CVDCTZTESA-N 463.579 0.659 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCOC1)CCO2 1840536642 UQFVRIJXILSOQS-KSFYIVLOSA-N 477.470 0.627 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840897748 UUZAFRFZCGPTNS-HOQHSMRBSA-N 453.879 0.664 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)c(=O)n2Cc1ccccc1 10161331 GSZQMIWZUAKECR-UHFFFAOYSA-N 491.464 0.797 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(OC)c(S(N)(=O)=O)c1 11043796 FQNHMUKCNLCGMO-UHFFFAOYSA-N 471.875 0.623 50 20 JCGD C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)C2=O 15314607 SHVCXJGAINEIIP-UUOWRZLLSA-N 470.574 0.847 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)c1 728206301 HAVWXOIRZLAWJM-QGZVFWFLSA-N 488.522 0.892 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)cc2)CCN1 728975294 JIWQVEKHLIHIHO-UHFFFAOYSA-N 488.494 0.560 50 20 JCGD Cc1ncsc1C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C/c1ccccc1 729453511 DVOZRXRFBFLLFQ-SHQCLWGWSA-N 486.597 0.606 50 20 JCGD CN(CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCCC1 729622445 FYDFRVQXIDLZAV-UHFFFAOYSA-N 481.619 0.845 50 20 JCGD Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 729756102 MDLIGRUXRRXRNI-INIZCTEOSA-N 469.454 0.364 50 20 JCGD Cc1cc(NC(=O)[C@@H](C)SCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)no1 785298869 NOUYCHOXOZAJNJ-IUODEOHRSA-N 478.483 0.574 50 20 JCGD CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 834791274 FQBRZEQNJYMXDL-AUUYWEPGSA-N 491.522 0.908 50 20 JCGD Cn1c(=O)c2ccc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)nc2n(C)c1=O 914463757 AZNCQIRJYKMKIX-UHFFFAOYSA-N 450.480 0.759 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)Cc2cc(F)c(OC)c(S(N)(=O)=O)c2)cc1OC 915594879 HSKUHRASGSGQJD-UHFFFAOYSA-N 455.464 0.893 50 20 JCGD C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 915789177 XDRCNPYAMHCYSO-CYBMUJFWSA-N 467.475 0.880 50 20 JCGD CN(CC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)C(=O)c1ccc(Br)o1 917387724 IUZUVWDCVQRFOC-UHFFFAOYSA-N 462.260 0.822 50 20 JCGD CCc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OC)c([C@@]2(C)NC(=O)NC2=O)c1 917719817 NVPFTYMRCHWTBR-OAQYLSRUSA-N 476.511 0.701 50 20 JCGD CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n[nH]c1C 917722153 RMNSGPGLFFJUKV-UHFFFAOYSA-N 485.544 0.303 50 20 JCGD Cc1nn(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1Cl 918141240 KCARFDBBTCOYRF-UHFFFAOYSA-N 455.924 0.635 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cc1ccccc1F)NNC(=O)c1ccc(Cl)cc1 919181589 LWHQFKSJPIEVBD-AEFFLSMTSA-N 477.876 0.988 50 20 JCGD Cc1ccc(C)c(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 921248332 VOUZEDMBPBXFBH-UHFFFAOYSA-N 465.488 0.899 50 20 JCGD CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028583 NBPYRKIMWSYZHX-BWKNWUBXSA-N 478.553 0.185 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)nc3ccccc13)CCO2 1779030861 YJAALKVZJLOBSZ-XMMPIXPASA-N 476.493 0.696 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)n1 1779237759 ZBNWCNNZEXBSKL-KDOFPFPSSA-N 459.316 0.807 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779300019 KPBRCEXGOSMVDK-IERDGZPVSA-N 473.643 0.944 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1780095210 JSIFJTMWRUARBH-DNVCBOLYSA-N 455.851 0.563 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1780199888 ACUAHIJVFVYEOQ-MGPUTAFESA-N 465.894 0.376 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(CO)on2)C1 1780216152 TVXYZGFIHWNDKW-CJFCWMOSSA-N 472.502 0.428 50 20 JCGD CN1CCCn2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cc2C1 1782563244 AAYVCECOSYSOCP-YJBOKZPZSA-N 458.332 0.853 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)[S@](=O)c1ccccc1 1782682466 XMKHENBHZANUIY-XXVJPEFISA-N 470.356 0.006 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1782781350 VJLMHGWSRRFGJZ-XMSQKQJNSA-N 467.950 0.521 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1783448974 OFCBVTBTQAKYCW-WIEQDCTASA-N 457.955 0.673 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784093886 ITWWSROZSMWKFD-SIRPWMCASA-N 471.982 0.823 50 20 JCGD COc1ccc(COCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1784098378 BLLHJGODSXRMGX-DEOSSOPVSA-N 483.525 0.354 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3COCCN3C(=O)OC(C)(C)C)[C@H]2C1 1784795042 KUVHLLUPMQCVCB-TXTZMMAHSA-N 489.997 0.856 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)C34CC(C3)C4)C2)C1)NC(=O)NCc1ccccc1 1784836203 USDSINFWCDYTGL-PBSMCPNCSA-N 455.559 0.963 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccc([N+](=O)[O-])c3)[C@H]2C1 1784882402 GMAVPPQIBOBZQN-NDXORKPFSA-N 496.524 0.819 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(S(C)(=O)=O)cn3)[C@H]2C1 1785713336 IBEIGEQFMIDDSG-QEWYBTABSA-N 459.952 0.332 50 20 JCGD Cc1ccc2oc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)cc2n1 1787157445 PDURKPMEQSPCPL-ZJBJCVSYSA-N 463.299 0.723 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1)n1cncn1 1789726851 XWAAMKBFQVQEQE-VMXMFDLUSA-N 498.588 0.165 50 20 JCGD COc1cc(C)c(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790289098 BRODDFAXHBAWMX-HARLFGEKSA-N 466.343 0.899 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4c3)[C@H]2C1 1790431706 DJEGJXGYMAKTIF-GKCIPKSASA-N 463.498 0.240 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790946679 JPMMJBDVVTVEMS-DBXVSBKESA-N 452.316 0.427 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c(F)c(OC)c1F 1791293952 QZWXMCUBDRWDMV-QRTARXTBSA-N 498.527 0.948 50 20 JCGD COc1cc(F)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1791886690 NTTJJMWKHRWLDH-FNHZYXHNSA-N 450.511 0.801 50 20 JCGD C[S@](=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1792795044 GWBUWGKIGOHNQM-UVEPIENXSA-N 483.990 0.772 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCNS(=O)(=O)c1ccc(Cl)cc1)C2)[C@H](O)CCl 1792982514 GGAILZYVADTMCQ-ZDFLXESQSA-N 494.397 0.198 50 20 JCGD COc1ccc(C(=O)CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1795136677 FLPWHJNAJFXKOZ-NHKMSHSESA-N 480.326 0.241 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1 1795732948 RTUURBNUUZOORW-MHYJACLRSA-N 464.327 0.382 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)C(=O)OC(C)(C)C 1795766336 GEGWJXYJZUNQOQ-QDMKHBRRSA-N 460.535 0.804 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1ccccn1)C2 1796441347 CAFVHUPOAFXAIP-BQHNGGHWSA-N 467.530 0.606 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797753117 TYJZZQZIDTZKSP-DBWKPXFBSA-N 473.917 0.864 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccncc2)[nH]n1 1798146963 ABCLFJPGNBFMPR-FKWFMORESA-N 490.524 0.809 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CC(F)(F)C1)C2)NC(=O)NCc1ccccc1 1799095464 YUNHWRPQMKOZPM-OPVJXMOQSA-N 479.528 0.968 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccccc2F)CC1 1802045134 OPXJBQLWSDSNKZ-YVWYUNDQSA-N 467.501 0.759 50 20 JCGD CCOC(=O)/C=C/C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1806294381 RZGBUSQDZYBPDC-IKSNEBHTSA-N 466.498 0.519 50 20 JCGD N[C@H](CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccnc1 1807258942 JRZQZUWBSKXIBX-BGWNEDDSSA-N 473.342 0.566 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cnnn2C)[C@H]1c1cccnc1 1808409959 PZIJNPJSTJXUJN-VQMZYRHSSA-N 463.502 0.664 50 20 JCGD O=C1Cc2cc(C(=O)NC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)ccc2N1 1809683855 JDPYEDHHXFVYPG-YADARESESA-N 484.321 0.889 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809967111 VNSXCKRYCMABTF-WPWMEQJKSA-N 479.346 0.345 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1810097540 LGKDNWPEEYSAAC-GSNRYTIQSA-N 499.528 0.286 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1ccnc1 1810294321 JDJKXKMXKYJXQZ-WRWLIDTKSA-N 462.514 0.857 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1nc2ccc(F)cn2n1 1812289114 DRQCMAQJSMHOLM-UWJYYQICSA-N 488.288 0.577 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1 1813176272 WPCCLIIVKDTHKY-MYSHNMEISA-N 491.508 0.146 50 20 JCGD O=C(Cn1nnc2ccccc21)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350173 IDWJQRFGHZVDDC-HNNXBMFYSA-N 476.327 0.494 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2[nH]nc3ccncc23)[nH]n1)c1ccc(B(O)O)cc1 1817471755 ZQYIAHVKQHCQKD-GOSISDBHSA-N 459.275 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])[nH]n1 1819403503 PYMDJOVITYYTNV-ZDUSSCGKSA-N 468.434 0.659 50 20 JCGD Cc1nccnc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797794 KITSEYWVSYLZDV-NSHDSACASA-N 452.500 0.780 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3nc(O)n4c3CCCC4)sc2C1)c1ccc(B(O)O)cc1 1820235057 BVJUVEIWGDHAPD-AWEZNQCLSA-N 481.343 0.601 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(CCO)CCO)n[nH]1 1822023494 RDEJYPFNQNWOGO-DZGCQCFKSA-N 460.373 0.719 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ncn(C)n1)CC2)NC(=O)NCc1ccccc1 1822517913 CUYIPVNQBOERDO-OAHLLOKOSA-N 497.585 0.844 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C)CC1 1824108382 FQENOZRANUJBOX-RTBURBONSA-N 497.637 0.865 50 20 JCGD Cn1nc2c(c1C(=O)Nc1nc3c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC3)CCC2 1824238415 XRXAQJIUXSLYPN-CQSZACIVSA-N 465.344 0.585 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1c3c(nn1C)CCC3)CC2 1826089934 SCTUQXMZSVVWLQ-GFCCVEGCSA-N 459.576 0.964 50 20 JCGD CC[C@H](O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548824 PTOLQIVITZKYCD-SVMVAKDDSA-N 467.950 0.809 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830364429 KBVVNPLVBVEKTN-UZLBHIALSA-N 462.927 0.203 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCCc1ccccc1F)CCO2 1830698523 JARRPJYXQUCQAW-XMMPIXPASA-N 478.565 0.978 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830725502 PAENNPMHWWAHGK-SIKLNZKXSA-N 468.934 0.714 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1 1831204945 BZZBXEHHBIYZCV-DNVCBOLYSA-N 462.385 0.923 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1831609496 PFGNXPAATWAMKB-QWEUIYMBSA-N 476.480 0.840 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(Cl)c1 1832535506 NRVLZWZSANGQPJ-FXAWDEMLSA-N 461.342 0.947 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)CC2)CC1)[C@H](O)CCl 1833312428 UXMAZMVLVQHFHA-ZRBLBEILSA-N 493.048 0.793 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cncnc3)CCO2)C1 1834306369 AKHXFIHKIIAEEP-QFIPXVFZSA-N 485.453 0.694 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834821673 SVXMZGHAXKNNRL-VZMFNRANSA-N 484.351 0.362 50 20 JCGD COC[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835116433 NHYSKTQOMVWXQA-MSZQUAHTSA-N 460.579 0.975 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)ncc1[N+](=O)[O-] 1835187036 AUPZNBUGAHAUJN-UHFFFAOYSA-N 495.345 0.477 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCN(C)CC3)CCO2)C1 1835404718 LGXWILBYLWDXTE-FXAWDEMLSA-N 475.428 0.254 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cnc2snnc2c1 1836100963 WRKYIQHSTBAVLX-UHFFFAOYSA-N 494.386 0.265 50 20 JCGD COc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)ccc1O 1836304330 MBXHXHGECHVPFK-UHFFFAOYSA-N 496.568 0.898 50 20 JCGD O=C(c1cc(-c2cc[nH]n2)n2ccccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836774511 ACARURQMOWMVPK-NZQKXSOJSA-N 487.944 0.999 50 20 JCGD Cc1ccn2c(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)cnc2c1 1837459315 CMNAFGDMBHCALQ-XMMPIXPASA-N 493.524 0.025 50 20 JCGD C=CC[C@@H](C(=C)C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459364 NHMNEHSHRMHCFY-GAJHUEQPSA-N 457.531 0.524 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc(=O)cco3)CC2)CC1 1837589717 RDPYBLRSBJBIEG-UHFFFAOYSA-N 454.288 0.246 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837715056 TZHYXRLMSLYCIT-OXJNMPFZSA-N 475.615 0.137 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Br)cn1)CCO2 1837830006 FXRCLQPVDWDVSR-HXUWFJFHSA-N 498.378 0.287 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc(O)n1 1837920111 BMSVCYIWDTWKPK-UHFFFAOYSA-N 467.331 0.701 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]cnc3C)C2)C1 1838528043 BSYKHBKCOFOWAF-QFIPXVFZSA-N 487.469 0.935 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1NC(C)=O 1838606957 FUBMOGCJTUKQBC-DYESRHJHSA-N 469.922 0.323 50 20 JCGD CCc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838837769 NDPYEFPWKYHAQK-NRFANRHFSA-N 474.543 0.088 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839031987 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCS1)CCO2 1840576692 VHQPBWZCYKEQLO-NYYYDFRBSA-N 463.560 0.472 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1C1CC1)CCO2 1840656282 KIMFYFLMSQGHMY-VWLOTQADSA-N 464.327 0.628 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1F 1840772685 JNUCZDCIXUMTCN-CRAIPNDOSA-N 466.890 0.834 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc2)CC1 1840774010 HWQITGCGUSWRMM-XUZZJYLKSA-N 495.020 0.498 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(C(=O)N(C)C)c3)CCO2)C1 1840789288 AQIBKJKKENJRFQ-AVRDEDQJSA-N 467.950 0.712 50 20 JCGD C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011913 KENNUSZHKNYTOE-FQEVSTJZSA-N 483.374 0.880 50 20 JCGD O=C(c1cn2cc(Br)ccc2n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014079 UNALWDOYIGFEST-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)cnc2s1 1844264336 HRABZBPVKDSYIP-UHFFFAOYSA-N 467.511 0.194 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2Cc3[nH]nc(C(F)(F)F)c3C2)C1 1845857567 VEIIOWSQQRLFFA-NSHDSACASA-N 477.447 0.659 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)c1ncn3c1CNS(=O)(=O)c1ccccc1-3)C2 1846363210 VRIWCIJMGRIGCZ-CQSZACIVSA-N 493.973 0.735 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)Cc1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1 15884550 OHQAWMITAPXJMW-UHFFFAOYSA-N 493.538 0.494 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)Nc2ccccc2F)c1 16786227 VORLSUJGOSWZFW-ZDUSSCGKSA-N 455.489 0.822 50 20 JCGD NC(=O)CNC(=S)NNC(=O)COc1c(I)cc(Cl)c2cccnc12 727067891 SOZQORMTRPTJDX-UHFFFAOYSA-N 493.714 0.852 50 20 JCGD O=C(COC(=O)c1c[nH]n2c1nc(=O)c1ccccc12)NNC(=O)[C@@H]1COc2ccccc2O1 728329749 GEWDQZBDKDKXOG-KRWDZBQOSA-N 463.406 0.320 50 20 JCGD O=C(NCc1ccccc1OCCN1CCOCC1)NNC(=O)C1CCN(c2ncccn2)CC1 728951008 SWFCFZHQTJEHDL-UHFFFAOYSA-N 483.573 0.935 50 20 JCGD Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 729165669 HVIOBPDUGFJNQC-UHFFFAOYSA-N 458.500 0.119 50 20 JCGD O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 730812534 SQPGJWZUWXPSJY-UHFFFAOYSA-N 455.514 0.565 50 20 JCGD CC(=O)N1CCCc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)ccc21 747848535 OFSVQUYITFYHKD-UHFFFAOYSA-N 486.959 0.910 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccnn1C)N(S(C)(=O)=O)CC2 748833951 FDWTWIRZUYJVLQ-HNNXBMFYSA-N 451.505 0.147 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1 751202572 UGTWOMCTPMMUHW-UHFFFAOYSA-N 469.907 0.306 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)CNC(=O)c2ccco2)cc1 751207449 XSQMSJKZSAUBDV-QGZVFWFLSA-N 476.511 0.603 50 20 JCGD C[C@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1)c1ccccc1 788024224 WGMIHPXMKWAOEC-WMLDXEAASA-N 465.553 0.922 50 20 JCGD COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 873765584 MDPHOYCTAWALJO-UHFFFAOYSA-N 494.595 0.866 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1 913422753 VHZIZLSLTHQQCS-UHFFFAOYSA-N 471.495 0.993 50 20 JCGD CCOc1ccc(NC(=S)NNC(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)cc1 913444009 SMLJIACGOUSGOX-ZDUSSCGKSA-N 453.546 0.568 50 20 JCGD COc1cc(N2C[C@@H](C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cc(OC)c1OC 914437958 TXSMUQAAKKSHAJ-KBPBESRZSA-N 455.533 0.558 50 20 JCGD CCOc1c(Br)cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OC 915880283 DRTVXHHOOMGYOJ-JTQLQIEISA-N 450.311 0.988 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCc1ccccn1)N(S(C)(=O)=O)CC2 915885073 KOTJYRUNXDAYBS-GOSISDBHSA-N 491.570 0.921 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)Cc1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1 919819955 BITAFIBCNBAAIR-UHFFFAOYSA-N 477.539 0.657 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)cc1 919884471 GQJAGBMDMMCDAX-INIZCTEOSA-N 466.541 0.927 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N(C)[C@@H]2CCS(=O)(=O)C2)cc1 920851175 CDYIWQDLXJJHEQ-MUMAZLPKSA-N 471.539 0.987 50 20 JCGD CCn1nc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]32)c2ccccc2c1=O 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O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(N4CCCC4)c(F)c3)C2)C1 1780143891 FBHHWXQRYZBZNC-RUZDIDTESA-N 481.333 0.863 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1781860892 KQNCKHXFBSCTCG-UVWXRNBGSA-N 454.293 0.350 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C)nc1C(F)F)C2 1782212098 UUPPUPMCGQYJBZ-QVKFZJNVSA-N 470.521 0.858 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1 1783448696 CCHGQFUJEULAJQ-CLOONOSVSA-N 499.373 0.067 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3c(=O)n(C)c4ccccc43)CCO2)C1 1783534824 ZMKPBFDPQKLXTH-VBKZILBWSA-N 465.348 0.953 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cn1ccc3ccc([N+](=O)[O-])cc31)CCO2 1783933430 JKNFEGBBRISWQD-HSZRJFAPSA-N 486.529 0.752 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1CCN(c3ccc(F)cn3)CC1)CCO2 1783937586 VHEVSVDEUVWRNZ-DEOSSOPVSA-N 490.580 0.640 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(F)(F)CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978667 JBKMKVQXLDRUKU-WDSOQIARSA-N 450.291 0.785 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCCC3(F)F)C[C@@H]21)c1cccc(B(O)O)c1 1786982643 ATYXDQGMXDBLBZ-WNHJNPCNSA-N 450.291 0.785 50 20 JCGD Cn1c(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc2ccccc21 1786982785 HPCSULCXNCZIMH-APTRMMRNSA-N 475.354 0.694 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1 1787450124 MHLOYGUHYITSFY-JHZZJYKESA-N 479.933 0.957 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3ccnc3)C[C@@H]21 1787506926 ULJAQXYAGKNOOA-UBJKDTOKSA-N 455.519 0.558 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)C1=NO[C@@H](c2ccccc2)C1 1788142629 KUXQQKIBNFHGIH-MHADKKCISA-N 477.326 0.477 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H]3CNc4ccccc4O3)[C@H]2C1 1788552097 RHSGGMFFYFZDRA-BXYJTDFISA-N 494.552 0.542 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C[C@@H]21 1788611305 TVXWIDZYHWDSOA-CWNDDBTHSA-N 494.508 0.013 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N[C@@H]1C[C@@H]3CC[C@H](C1)N3C(=O)[C@@H](O)CCl)C2 1793112423 IIAGHMARUUXCBN-JBXGNFEISA-N 452.939 0.860 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC(=O)N1)NC(=O)NCc1ccccc1 1795702250 GLDYEVXSGAZAEY-RDGPPVDQSA-N 456.547 0.249 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCSC(=N)N)NC(=O)NCc1ccccc1 1796035381 GDNWYQPDQVKKLI-BCDXTJNWSA-N 475.619 0.988 50 20 JCGD COc1cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)ccc1[N+](=O)[O-] 1796188428 FCAXWKNLZLAHTJ-REPLKXPHSA-N 467.287 0.778 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2c(s1)CCCC2 1797384312 HOGHHWRLWVPWPA-UPHUGPLXSA-N 454.357 0.824 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)CC1 1797959033 JZBHVMADCXLZAE-RMFSNUHRSA-N 498.697 0.980 50 20 JCGD COc1ccc2[nH]cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C4)c2n1 1798483147 CRNJBZDIQNGEBU-CRAKFPHTSA-N 493.524 0.909 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](c1ccc(Cl)cc1)N(C)C 1800306633 BFYLDADNTAGCOZ-YVCBRDFCSA-N 480.009 0.905 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1)C2 1801010604 KYFIRSYHXZOPDV-KAUDDPROSA-N 495.621 0.642 50 20 JCGD CCNC(=S)NCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1801242737 DNWSYISUUPHLCT-REPLKXPHSA-N 489.646 0.455 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(C)CC1(F)F)NC(=O)NCc1ccccc1 1802002558 OMRLLAPYJKHNNG-YZIUBNRHSA-N 479.528 0.968 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2 1802336750 XNCHGQCXTDODQJ-CIAFKFPVSA-N 471.602 0.899 50 20 JCGD CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1804917602 SLMCOTCZWINHGL-PGRDOPGGSA-N 475.314 0.584 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1 1807366647 GDNGCDGAWGWSQP-PIPMEXSNSA-N 461.331 0.847 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)CC2)C1 1809968994 KOZMKEURDOHCMC-QGZVFWFLSA-N 494.357 0.218 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1 1810303095 PDOJWZKIVDDJQA-YWZLYKJASA-N 485.508 0.985 50 20 JCGD COCc1c[nH]c(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1811347974 GSEWYSPMQYMBMN-KNQAVFIVSA-N 462.315 0.869 50 20 JCGD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc2nccn12 1812169419 IKJFOYKICDTRAS-DENIHFKCSA-N 484.325 0.746 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1 1812976369 DLDXXXJEKJQSKX-JPYJTQIMSA-N 458.563 0.473 50 20 JCGD Cc1cc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)nn1C 1814987379 BNPQMIICTDYUPV-SFHVURJKSA-N 465.518 0.999 50 20 JCGD NC(=O)c1ccccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343613 DLUNCDRONYKCPG-CQSZACIVSA-N 464.312 0.461 50 20 JCGD Cc1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(=O)[nH]c1C 1816112330 BYYGGCIMRVWNNT-QGZVFWFLSA-N 464.291 0.409 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3nncn3c2)[nH]n1)c1ccc(B(O)O)cc1 1817471931 XDYCZPLUTUDOQL-SFHVURJKSA-N 459.275 0.752 50 20 JCGD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1)[C@H]1SC(=N)NC1=O 1818100045 BIPGEDDLDHSUEX-DRZCJDIDSA-N 499.557 0.517 50 20 JCGD COCCn1nccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819796915 HRZSAZBPGPSGMC-LBPRGKRZSA-N 484.542 0.524 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(N)=O)CC2)NC(=O)NCc1ccccc1 1822518340 LHFZTNHTNTYBPE-HNNXBMFYSA-N 487.586 0.667 50 20 JCGD O=C(CSc1nc[nH]n1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822711377 XUZDXQUWZCMQND-HNNXBMFYSA-N 455.309 0.306 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)c1ccco1)CC2 1826085200 JNYCMDDCWXQGLV-LBPRGKRZSA-N 462.532 0.451 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)nc3cccnn13)CC2 1826088433 XTQOLZJOZRQHCY-GFCCVEGCSA-N 484.542 0.145 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2nc3ncccn3n2)CC1 1828175414 FDYATMZDMPUXJU-IBGZPJMESA-N 462.319 0.351 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525292 OAEXALMSXSBFPP-KKSFZXQISA-N 498.374 0.923 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnncc2C(=O)O)CC1 1828924072 IHWMDBGLVLCQHQ-IBGZPJMESA-N 481.513 0.720 50 20 JCGD O=C(Cn1cncn1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829010385 RRYSSDRATGFCRV-AVRDEDQJSA-N 490.948 0.330 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)N3CCCC3)C2)C1 1830534505 AQIAIIRHTGYVHR-OXJNMPFZSA-N 474.396 0.876 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CNC(=O)O1)CCO2 1831576345 JEFKESSNIOXDHI-HFCGBKAISA-N 476.436 0.437 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(O)C(F)(F)F)CCO2 1832148666 CAUNFYHXLPNQGT-UGFHNGPFSA-N 461.275 0.787 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnnc3O)C2)C1 1832549544 UGGHPHQQIWHBQV-YCRPNKLZSA-N 499.952 0.384 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(C(F)F)c3)CCO2)C1 1833321184 KHZUBRGZGZMSDR-JOCHJYFZSA-N 490.467 0.402 50 20 JCGD O=C(CNC(=O)c1cccs1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833836677 ZUMMQZMAKKGDQU-UHFFFAOYSA-N 498.414 0.043 50 20 JCGD Cn1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)n1 1833883891 UELPRBSCGAXSAF-UTKZUKDTSA-N 492.374 0.891 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cnc1C 1833915557 QBVQKRNLPAPIQG-UHFFFAOYSA-N 464.375 0.877 50 20 JCGD Cc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1F 1834018750 GGKXIQZSYHEKAX-UHFFFAOYSA-N 472.525 0.355 50 20 JCGD COc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834498292 KLEDNKCNXLUSMH-UHFFFAOYSA-N 479.386 0.803 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1 1834603280 PIBYCXHPEURGCQ-HXUWFJFHSA-N 486.034 0.804 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CC[C@H](N)C(N)=O)CC2)CC1 1834736379 OKACMGCJKGOGBJ-CVEARBPZSA-N 460.417 0.324 50 20 JCGD CN[C@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1)C(=O)O 1834738582 HHEUWZBFBIBTOP-CZUORRHYSA-N 461.401 0.652 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cccnc3Cl)CC2)CC1)c1ccc(B(O)O)cc1 1834797561 YTJUYCUNHPZJBL-UHFFFAOYSA-N 484.793 0.843 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1835931708 YKFOJQKWCPHXJE-RUZDIDTESA-N 490.325 0.140 50 20 JCGD COc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1OC 1836209745 QPMUAXLSJUREBG-UHFFFAOYSA-N 490.605 0.657 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c[nH]c3cnccc13)CCO2 1837175591 MAWHAPUDXBVLFE-SWOYFSSUSA-N 493.524 0.767 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1cnccn1)CCO2 1837485222 DTLYVZKMSCAXHY-PMUMKWKESA-N 456.341 0.517 50 20 JCGD Cn1cc(CCC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1837920959 MQTWDFYOOBTYJH-UHFFFAOYSA-N 468.363 0.345 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ncccc1Br)CCO2 1838076098 YXIYRPZHLDEFFV-HXUWFJFHSA-N 498.378 0.287 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(C)CCCN1)CCO2 1839120459 GUDPAWHGSUAUMA-KNXBSLHKSA-N 489.013 0.717 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1839152939 OKMNJWPWFVVZKK-OALUTQOASA-N 461.346 0.972 50 20 JCGD COc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1F 1839198358 YPZDNMYAQZRHHZ-DYVFJYSZSA-N 464.263 0.990 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CCO2 1839384622 MOFAKCQPMPFRKV-PJIJBLCYSA-N 494.383 0.317 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839519129 WOLREBIIHRGUGQ-DNVCBOLYSA-N 471.352 0.909 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1839879395 ONSNLRUWIUDIBN-FPTDNZKUSA-N 492.485 0.115 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1839964842 GEWBZAZQQIALEU-IFXJQAMLSA-N 466.336 0.973 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1839966216 XSHAXAORAPQJJD-YJYMSZOUSA-N 499.387 1.000 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1 1840035353 OCJNHHVVZBFULS-ORAYPTAESA-N 454.321 0.639 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C2)C1 1840186895 GBTSHYODVUBWIR-ISGGHPHESA-N 489.529 0.437 50 20 JCGD COC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1840321846 PEFYXIYCQCMUBC-XXFFJTNUSA-N 478.452 0.684 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840427026 RZGRBKVIKMEKBT-DHSIGJKJSA-N 460.300 0.996 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2 1840859104 YYRSVWOYNXPBCG-XMMPIXPASA-N 482.317 0.307 50 20 JCGD O=C([C@H](O)CCl)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1[C@@H](O)CCN1C(=O)OCc1ccccc1 1847564031 PMVRGRPRJONDRE-FKSLSLAPSA-N 465.934 0.560 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CCNS(=O)(=O)c2cccs2)c2ccccc2c1=O 17162056 CRLKKMZGANTPOU-UHFFFAOYSA-N 463.541 0.998 50 20 JCGD C[C@@H]1CN(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCO1 726256595 OKWZHXAPWXSLLQ-QGZVFWFLSA-N 475.571 0.830 50 20 JCGD Cc1ocnc1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 726524120 BKACUSUACNPBGB-UHFFFAOYSA-N 479.497 0.822 50 20 JCGD COc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cn1 729693107 JDQWLCPAQQUBMZ-UHFFFAOYSA-N 469.520 0.882 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)cc1 747292816 ODGIZPXNFYSXRL-UHFFFAOYSA-N 459.524 0.843 50 20 JCGD O=C(NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21)[C@@H]1CCS(=O)(=O)C1 750931777 BKUHLRAIMFVQRT-SECBINFHSA-N 468.289 0.634 50 20 JCGD CNS(=O)(=O)c1ccc(CCC(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1 762039547 MVQDWDIDACFNHO-UHFFFAOYSA-N 454.530 0.226 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2cccc(F)c2)cc1OC 786577386 FGRUXROWOCPMIW-UHFFFAOYSA-N 469.447 0.126 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CCCNC(=O)C1CC1)N(S(C)(=O)=O)CC2 915064942 YOJMYTRMPPQYBA-QGZVFWFLSA-N 496.586 0.407 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCc1ccnc(N2CCOCC2)c1 916388705 FWKKEYZOGYHWEF-UHFFFAOYSA-N 467.574 0.961 50 20 JCGD CN(CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)S(C)(=O)=O 916580324 MZDSRCLXBNBLTK-UHFFFAOYSA-N 497.599 0.391 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)n(C)c2n(C)c1=O 919702463 ZUXUOPCKWPQTNA-UHFFFAOYSA-N 452.496 0.703 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)c2ccccc2c1=O 920030519 ZRDJKLUHKSDQIE-YFPIXMDGSA-N 488.504 0.498 50 20 JCGD CC(=O)N1C[C@H](C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)Oc2ccccc21 920058604 QGQMPLHEOCSEND-RTBURBONSA-N 455.423 0.331 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)c2ccccc2c1=O 921160624 QQDZQOAEKLHZGY-UHFFFAOYSA-N 454.468 0.200 50 20 JCGD 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1835117998 GGHFSDKIIATLAM-MOROIOLQSA-N 458.563 0.729 50 20 JCGD CC(=O)C[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738078 BUFDSQCOSCLQBM-OAHLLOKOSA-N 458.563 0.486 50 20 JCGD O=C(Cc1ccc(Cl)s1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935258 KTSPCZGKXFZTSF-OAQYLSRUSA-N 478.763 0.394 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccs3)CCO2)C1 1835964864 JXZQSOBWRAFOEB-SIAOZKNOSA-N 471.539 0.530 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CS(C)(=O)=O)CC2)CC1 1836875426 IPJCSLVEQXIKLY-WMLDXEAASA-N 453.001 0.920 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)Cn3nnc4ccccc43)CC2)CC1 1837025116 MLNNBJGSIZSSDG-UHFFFAOYSA-N 485.589 0.803 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1837039798 COELWELYCJAEHK-YZSQISJMSA-N 488.589 0.987 50 20 JCGD CC(=O)c1cc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n[nH]1 1837367588 NXVTXSXBQJQTKC-UHFFFAOYSA-N 462.551 0.598 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)o1 1837453713 NSJFTXYNUWLQEM-WMLDXEAASA-N 462.272 0.999 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(Cl)cc3)C2)C1 1837457592 KOKUWFYANULBHZ-HSZRJFAPSA-N 487.944 0.651 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n1 1837659182 SWHQBECMZLUICX-MGPUTAFESA-N 485.379 0.527 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc4nn[nH]c4c3)CC2)CC1 1838394551 IZMFJMYGIUMPHN-UHFFFAOYSA-N 492.540 0.882 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OCCCO)cc3)CCO2)C1 1838549999 OHGJFCBDNFODNR-UGKGYDQZSA-N 470.950 0.772 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)ccc1F 1839319713 CNLIAVOVSWIBAA-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)C(F)(F)F)C2)C1 1839966368 CDQPJFGDYUKTBM-XHDPSFHLSA-N 474.274 0.295 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1840154444 XCQHVDSLSXYVSX-YJYMSZOUSA-N 470.935 0.080 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)C(=O)CC4)C2)C1 1840185769 XGIROKQWZSJKDS-DEOSSOPVSA-N 472.542 0.259 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)C(C)(C)O 1840916503 MJBMPAXTDUUHEK-LAPQFRIASA-N 481.949 0.641 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccnc1 1841470308 KYVKVCSGZDADTP-HXUWFJFHSA-N 494.357 0.844 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1842651705 XUJUGEXBTZPMPF-UHFFFAOYSA-N 450.300 0.855 50 20 JCGD CCc1c(Br)c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)nn1C 1844263991 RYPVQPUSEFZYIE-UHFFFAOYSA-N 490.362 0.874 50 20 JCGD O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)CN2C(=O)C3(CCOCC3)c3ccccc32)C1 1845020452 JDMAWADOYWOWOF-SFHVURJKSA-N 461.946 0.885 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCS2(=O)=O)C1)NC(=O)NCc1ccccc1 1845913875 GAPLGEZMJYBLDQ-SFHVURJKSA-N 477.587 0.113 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccccc2NS(C)(=O)=O)cc1OC 10265488 HLGSSQCVOBRKCR-UHFFFAOYSA-N 451.457 0.693 50 20 JCGD Cc1cc(C)cc(OCC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1 14842728 MOOFWIAUUCRDGZ-LJQANCHMSA-N 497.595 0.611 50 20 JCGD O=C(CN1CCN(S(=O)(=O)c2ccc(F)cc2F)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 15486935 NTQMISCLWJWDFV-UHFFFAOYSA-N 483.453 0.641 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)Cc2nc3ccccc3n2C)c1 16179115 LQHRHTTUNKUCLW-UHFFFAOYSA-N 474.543 0.156 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)CNC(=O)c1ccco1 725739682 LZCITENQJSTPCN-ZDUSSCGKSA-N 472.520 0.396 50 20 JCGD CC1CCC(NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1 728293929 QCLJRSRMWFHOKN-UHFFFAOYSA-N 460.535 0.668 50 20 JCGD CCOc1cc(C=NNC(=O)[C@H](C)NS(C)(=O)=O)ccc1OCC(=O)N1CCCCC1 728436117 KZFLXSCMANHAHW-HNNXBMFYSA-N 454.549 0.864 50 20 JCGD CC(=NNC(=O)CNC(=O)c1cccs1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 729820244 YWPOBXONUFSPHF-UHFFFAOYSA-N 472.570 0.744 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1 831961089 TVNIUMRTKHHJHR-LENZSSGSSA-N 475.479 0.107 50 20 JCGD CC(C)CCOc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 914881970 YSUMAPSWLPMFQW-IRXDYDNUSA-N 451.545 0.908 50 20 JCGD O=C(NCC(=O)N1CCCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 916473549 QBSSMJCGZUKNKM-UHFFFAOYSA-N 451.549 0.818 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cn2cccnc2n1 916720327 RBONGPOAVWOONF-UHFFFAOYSA-N 458.500 0.144 50 20 JCGD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O 916739678 ROQYQNYFIFDFDN-UHFFFAOYSA-N 462.470 0.730 50 20 JCGD Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 917278310 MWLPDWCTOZTVHS-LPHOPBHVSA-N 484.444 0.435 50 20 JCGD COC(=O)COc1ccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 917721198 SHBZQXDHYHGLEK-UHFFFAOYSA-N 485.540 0.177 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CCCC4=O)C2)C1 1777925679 MMYQWEUOLQHHGH-VWLOTQADSA-N 477.521 0.961 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779035950 ROMVOICCEXDHCH-JOCHJYFZSA-N 457.462 0.590 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3ccnc3c1)C2 1779372624 PAUQIMCGQXAFRM-NTKDMRAZSA-N 477.525 0.774 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1779954181 RYLCHADZIRYWCV-BLLLJJGKSA-N 459.297 0.890 50 20 JCGD COc1cc(OC)cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1780656585 CRKCUQHLASIKTH-QHCPKHFHSA-N 454.288 0.141 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCS1(=O)=O)C2)[C@@H](F)Br 1780776858 LTMUBAGGLTUTOU-BRXULGCHSA-N 455.346 0.768 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCCN3C)C2)C1)NC(=O)NCc1ccccc1 1781030804 CQPHARCOHUYRFI-OFVILXPXSA-N 486.617 0.647 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ccc1C 1781909808 CFYDZXIIUAGONS-XMMPIXPASA-N 465.315 0.391 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1Cc3ccccc3N1)C2 1782213275 KJSJBUMQJIQOSX-DCLXLUIPSA-N 457.575 0.910 50 20 JCGD CCOc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1OC 1783699405 RHBMXPAEIWCOIX-RUZDIDTESA-N 482.342 0.460 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(C4CCN(C(C)=O)CC4)CC3)CCO2)C1 1783873905 ADUOMEMREQTGIQ-XUZZJYLKSA-N 499.052 0.793 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cn3ccc(Cl)cc3n1)CCO2 1783934342 FDRCGIWHSBKUIK-NRFANRHFSA-N 462.938 0.804 50 20 JCGD O=C(CCCC(=O)Nc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784050440 GHJHIYVYTQQHGQ-VJBMBRPKSA-N 493.369 0.769 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)CC2)CC1 1788223558 BGOWEXXLTBULNH-UVUJQTEASA-N 499.052 0.289 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21 1788610438 RTDHTKAJSGTEPO-AGRHKRQWSA-N 456.478 0.055 50 20 JCGD CC[C@H](C)[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724953 SSEWKHHJYRPSLQ-NSYZTORCSA-N 489.617 0.719 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)ccc(O)c3F)[C@H]2C1 1790212628 FCAAFDZPLQNGBF-XEZPLFJOSA-N 454.474 0.637 50 20 JCGD Cc1cccc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)n[nH]c12 1790478485 KJUIUYPNFFVLAG-VDGAXYAQSA-N 462.315 0.458 50 20 JCGD O=C(COCCOCCOCc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1791144937 OXDQSDVKCNCBKO-CMOCDZPBSA-N 499.004 0.816 50 20 JCGD C[C@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791290857 BQXQHPWRCALYHT-VGWMRTNUSA-N 452.581 0.296 50 20 JCGD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1792943119 CQVCJDWJXXCJHG-VPTLXERWSA-N 487.705 0.374 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1793878238 IDKLOHJGKBNAGI-NDKCEZKHSA-N 454.351 0.308 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCS1(=O)=O)C2 1793879129 KDIKEWJKQCQQAY-NPJQDHAYSA-N 494.010 0.285 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCCNC(=O)C2)n1 1794842258 DETKWQRPNWHRPV-YYIAUSFCSA-N 463.966 0.914 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(F)CCCCC1(F)F)C2)c1ccc(B(O)O)cc1 1795734138 FJPSWIDXUGGJHR-DOHHPOSVSA-N 454.254 0.487 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(O)c1)NC(=O)NCc1ccccc1 1796139587 GZPXIFARZHFQCZ-OPMZPASUSA-N 498.540 0.042 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2 1796393061 YKKMVTBHKDWBOL-AHDPXTMNSA-N 478.384 0.899 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCOCC2)n1 1796619428 SLYMWRYKCBIAMH-RCJHGTSTSA-N 452.939 0.375 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ncccc1Br 1798185118 FIVXDULXGXXUCQ-XOIINTDNSA-N 474.120 0.041 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1NC(C)=O 1798609288 IUWCXOMXJOTJOF-VPTLXERWSA-N 496.524 0.169 50 20 JCGD CCOc1ccc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799616361 XESPCUQWWWBFAP-VPTLXERWSA-N 472.734 0.936 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccc(F)cn3)CC1)C2 1801012733 HWCXQSJVEGYWSN-FEJSZKPUSA-N 490.580 0.400 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801012734 XKOQNLJIPYRRGB-VTEUUUEMSA-N 452.939 0.925 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@H]1CCN(C(=O)Cn2cnnn2)[C@@H]1c1cccnc1 1804240352 ZGQTYLKVBKHFMY-SOLBZPMBSA-N 492.968 0.906 50 20 JCGD Cn1cccc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)c1=O 1806296601 KWHFKYSBUHXNQL-UHFFFAOYSA-N 452.515 0.542 50 20 JCGD N=C(N)SCCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1807127819 QJCOHMPJBGZWEK-KDOFPFPSSA-N 470.559 0.416 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370889 MRVXTEHCXRPFBF-OFNKIYASSA-N 450.348 0.567 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C2CC(O)C2)[C@@H]1c1cccnc1 1808410290 UKDIWRPHXAWRIL-OUVGGJRISA-N 452.515 0.992 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1 1808668275 NWURTGXZOWAMFP-UGUYLWEFSA-N 459.316 0.929 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1 1809912365 YOKWLHADXKYHSA-VGOFRKELSA-N 464.530 0.817 50 20 JCGD CC(C)N(C)CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810308109 JEDMZXGUAWVWMH-DYESRHJHSA-N 453.547 0.740 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@@H]1c1cccnc1 1813075009 YSMIDNMEIGOZEQ-MGPUTAFESA-N 469.502 0.262 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350210 KLGNFGNPJWFBBT-OAHLLOKOSA-N 453.333 0.713 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)cn1 1816095084 YJVJFUOLDBPKDS-SMDDNHRTSA-N 472.976 0.908 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3nccc4nc[nH]c34)sc2C1)c1cccc(B(O)O)c1 1816898983 ZLWYHEYQIRTAPW-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccnc1C(N)=O)CC2 1817277222 MENWQUNQWFDYTE-PUIKZXOXSA-N 494.537 0.997 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nccc3nc[nH]c23)[nH]n1)c1ccc(B(O)O)cc1 1817471517 QQCOGTGBBPRZDQ-KRWDZBQOSA-N 459.275 0.981 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCN(C(C)=O)CC3)sc2C1 1818898583 SUHPEDKQFRQEFV-ZIAGYGMSSA-N 457.984 0.473 50 20 JCGD O=C(CC(F)(F)C(=O)O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052980 RHJCXMCSUVTNSX-KRWDZBQOSA-N 452.263 0.710 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(CO)c(F)c1 1827905804 QAPMAVJMLGVGFA-MRXNPFEDSA-N 469.303 0.994 50 20 JCGD O=C(C(O)O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCN2C(=O)OCc1ccccc1 1829232516 UALBGCIYNLKHSJ-LIRRHRJNSA-N 488.310 0.440 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830354154 SDRNOIOBDXVKQD-YIGJPRQDSA-N 496.004 0.887 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830538579 KDPCAYOCGOLAOD-BEFAXECRSA-N 473.368 0.631 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)nn1-c1ccccc1F 1830723816 QTTKVOFPUGPJPV-AVRDEDQJSA-N 496.923 0.690 50 20 JCGD O=C(c1ccc(N2CCCOC2=O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830736608 UYSNRJMEGRDADX-AVRDEDQJSA-N 481.933 0.703 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F 1831319507 ZPTQWDUSSDTYAU-XMMPIXPASA-N 478.565 0.896 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)n1 1833308319 RSJNEBNDXYLETN-SFHVURJKSA-N 451.955 0.825 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(N4CCOCC4)cn3)CC2)CC1)[C@@H](O)CCl 1833308549 VDXNFZIHIYERRR-NRFANRHFSA-N 480.009 0.703 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)c3ccccc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797917 LSRRGWXQRGFZLA-HSZRJFAPSA-N 465.359 0.285 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1834821224 CENMYWUQUCOEOD-FQEVSTJZSA-N 481.347 0.910 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834826696 TZLFRGWLRUYLRM-IBGZPJMESA-N 457.369 0.821 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738157 VZLKZXYMRFJCTD-MRXNPFEDSA-N 495.588 0.161 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccncc1Cl 1835898165 ARHSIMHVSMQYQN-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccccc3C(N)=O)CC2)CC1 1836451068 LOZHCXLWIXFSAH-UHFFFAOYSA-N 472.590 0.344 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCCO3)CCO2 1836967947 FFMYSFJQNNPAPW-GOSISDBHSA-N 457.325 0.521 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1 1837457972 YZGXVPHOQCYZRE-HSZRJFAPSA-N 471.489 0.137 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccn1)CCO2 1837741427 RVGSBPMLMDHYKC-GTTVDESPSA-N 497.556 0.472 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3c(O)cc(O)cc3O)CC2)CC1 1837920021 CPNYOOOKXPDLIK-UHFFFAOYSA-N 484.314 0.409 50 20 JCGD COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1 1837921328 ZXVUZACMICWZFD-UHFFFAOYSA-N 468.319 0.091 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc4cccnn4c3)CC2)CC1 1837921644 TZULTNCHJOFNGV-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1838066627 KNYBRRLXEQZJQB-FLOSOGMCSA-N 489.577 0.566 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)nn1 1838830057 GITCKSAJYNSQBE-SFHVURJKSA-N 457.325 0.730 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(F)c(C#N)c1)CCO2 1839188200 PQWCVDCXFMVLLV-QHCPKHFHSA-N 475.521 0.069 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nc2nccn12 1839202786 PHSBUWPYDUFRPZ-RDTXWAMCSA-N 470.299 0.798 50 20 JCGD CC(C)Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839404678 JHQXLZPNEQVQBB-AREMUKBSSA-N 480.370 0.949 50 20 JCGD CN1CCCn2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CO[Si](C)(C)C)C4)C3)cc2C1 1839622163 OMWHOGXSFVMAJN-JOCHJYFZSA-N 479.654 0.640 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)OC(=O)NC(C)C)C2)C1 1840154320 SHSRGITYZFMNTC-YWZLYKJASA-N 463.959 0.610 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1840520607 PDHDCVDCONOJQK-LWQICCLCSA-N 465.576 0.294 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cnc(-c3ccccn3)nc2)C1 1842151404 DLQXISSYGVCVBK-UHFFFAOYSA-N 458.482 0.668 50 20 JCGD CC[C@H](CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)NC(=O)OC(C)(C)C 1845234561 QXSBONFMNXKRTI-GOSISDBHSA-N 459.352 0.877 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)/C=C/C(=O)NCc1ccccc1 1847540519 DBKLHHVZGFTPQL-ZBWOGFRMSA-N 462.510 0.373 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1cc([N+](=O)[O-])cn1)NC(=O)NCc1ccccc1 1848165062 FOAXUOHYFPPSIA-OALUTQOASA-N 484.517 0.339 50 20 JCGD O=C(Cn1cnc2ccc(Br)cc2c1=O)NNC(=O)c1n[nH]c(=O)c2ccccc12 107545817 LHBLFTMPIGKMMJ-UHFFFAOYSA-N 469.255 0.857 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)c2ccccc2c1=O 729614359 FYCINEGGJCAGAH-UHFFFAOYSA-N 493.572 0.753 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2sc(S(N)(=O)=O)cc2C)cc1OC 746619711 GYNNMVKYKVJLGL-UHFFFAOYSA-N 457.486 0.339 50 20 JCGD CN1C(=C(C#N)C(=O)COC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)N(C)c2ccccc21 792636947 ARMNVYMDUVWZBJ-UHFFFAOYSA-N 477.481 0.257 50 20 JCGD C[C@H]1Cc2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc2N1S(C)(=O)=O 806001650 PIRHICBXDRNJMN-ORAYPTAESA-N 489.506 0.541 50 20 JCGD Cn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc21 903882388 NIWQHLLYWDKIOL-UHFFFAOYSA-N 480.524 0.539 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)OCO2)c1cncc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)c1 915806700 UAFQUIPAIRCSRS-UHFFFAOYSA-N 491.416 0.689 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](C(C)C)N2CCN(C)CC2)c1 916257723 ATENWGWAVMHNIX-HXUWFJFHSA-N 482.651 0.933 50 20 JCGD O=C1CCC(=O)N(c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc2)N1 920288513 WWMAOSHZZMOCAY-UHFFFAOYSA-N 485.522 0.704 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@]3(F)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1778324308 DPBCTFAXAIGMRS-GOTSBHOMSA-N 499.584 0.538 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1 1778722587 AVUFAMJHOVVNPT-SJUCLPJRSA-N 478.509 0.508 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccn3cn2)C1 1778724262 RCIUVYYWXYSURX-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028726 JXZABUSAWQRKMD-HSZRJFAPSA-N 490.561 0.432 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-c4ncc[nH]4)cc3)CCO2)C1 1779036223 YEEYCKKWRULRSI-XMMPIXPASA-N 475.509 0.833 50 20 JCGD O=C(/C=C1\C(=O)Nc2ccccc21)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779283081 YJXAPEBSOGLWAO-IGNGENJZSA-N 489.337 0.530 50 20 JCGD Cc1cccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371518 WYHLKXOTQSECRV-WZONZLPQSA-N 452.515 0.830 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1780096836 IJMRVUIIVOCRRX-QHCPKHFHSA-N 490.513 0.686 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2CCN(C)CC2)C1 1780642460 UTGBHIHKSIMJON-MIALQEHNSA-N 459.429 0.920 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(-n2cccn2)cc1 1780968193 ZKHSSYXTTVTIGT-ZEQKJWHPSA-N 488.353 0.993 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)Cc3ccncc3)CCO2)C1)NC(=O)NCc1ccccc1 1780968890 QVPUARSXXBMUIV-RUZDIDTESA-N 480.569 0.800 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCCO1)CCO2)NC(=O)NCc1ccccc1 1780968946 KQMRMXXHLZSAAC-YKSBVNFPSA-N 473.574 0.732 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2)C1 1781355423 NCCTZBDFGXOWOT-KSMMKXTCSA-N 478.384 0.875 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1Cc3ccccc3CN1)C2 1782211892 DWEVLDUYFJQSGC-BPYKYCOYSA-N 471.602 0.588 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC[C@@]3(C1)CN(C(=O)[C@@H](O)CCl)CCO3)C2 1782852509 WPVAJMFCEWZIRF-WDUKFBBWSA-N 468.938 0.052 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CCO2 1783527544 CVDFMPJGEFOWOK-ZJNRKIDTSA-N 464.357 0.485 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccccc3F)C2)C1 1784735950 INHXJFRASWRCAE-HSZRJFAPSA-N 455.490 0.901 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc([N+](=O)[O-])cn3)[C@H]2C1 1785218426 AWWVAEDLBYMKJX-MHEUCROKSA-N 458.313 0.945 50 20 JCGD Cc1cn(CC(=O)N2CC[C@]3(C2)CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)CCO3)c(=O)nc1O 1785353776 MLPVATPCXMLULP-FZRLKEFVSA-N 499.474 0.973 50 20 JCGD Cc1ccc2oc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)cc2n1 1787157562 VMEKQCWJJIUPRC-ZJBJCVSYSA-N 463.299 0.723 50 20 JCGD COc1ccc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)[nH]c2c1 1787904491 HFCFDWVLEZADRG-NYDSKATKSA-N 477.326 0.763 50 20 JCGD O=C(CNC(=O)C(F)(F)F)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788149414 OTJXOCLUXYBTRX-UHFFFAOYSA-N 463.221 0.793 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1789933877 DODSYBDIGALQNB-YGJAXBLXSA-N 451.923 0.776 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21 1791144953 PUUNUKABVQRGOE-JYJNAYRXSA-N 471.378 0.466 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791155996 VSLGGSPWQYYVNO-BODMPHMZSA-N 490.561 0.192 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)C(F)(F)F)[C@H]2C1 1791314374 VIEDABDJKZYBNV-BJDJZHNGSA-N 458.275 0.818 50 20 JCGD CN1CCN(c2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)cc2)CC1 1792529036 UNRIYYSYINVWGB-VILGAWFOSA-N 476.386 0.684 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)[C@@H]1C[C@H](O)CN1C(=O)OCc1ccccc1 1793117983 NQEKIQPOKGAKLT-DWIKVQACSA-N 479.961 0.996 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CS(C)(=O)=O 1793370325 JTWUWVSPGRSWHV-FIIQBIKZSA-N 497.526 0.404 50 20 JCGD Cc1nn[nH]c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793881163 SELMBROMNDFSIT-XFMPKHEZSA-N 456.931 0.448 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)[C@H]2C1 1796370232 IYGGSHUGIHQXJW-AJOQJMSBSA-N 475.945 0.992 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2 1796393063 YKKMVTBHKDWBOL-UXXRCYHCSA-N 478.384 0.899 50 20 JCGD Cn1c(=O)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)nc2ccccc21 1797955946 QWMWINLDVZCGKZ-CCWDJLKJSA-N 458.591 0.988 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1800957163 YAWJZMDHQZXRBL-PUCRAGRTSA-N 485.541 0.465 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C2 1800974468 VJEGLGGNDRHPRR-BQULAQKPSA-N 489.997 0.448 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(C)=O)c1ccc(F)cc1)C2 1800979037 OVXKZXKSIHUGQE-PTIUUAQKSA-N 455.914 0.846 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)CCC(=O)NN(C)C)CC2 1801012678 FWHJDTRZAAWACA-FLFXDLLNSA-N 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CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1804295734 ICOHUOQIHNLFSR-KHMAMNHCSA-N 461.943 0.681 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1804577908 ZHQONXFLFDEBBV-NZQKXSOJSA-N 461.331 0.595 50 20 JCGD NC[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccc1 1807251090 FUPULCPBEIVCJG-YFNKSVMNSA-N 472.354 0.824 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2ccc(F)cn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362178 FANMAJPHAUSZOX-MBSDFSHPSA-N 462.290 0.858 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807367407 KUYYNZRZJWNAPO-NYDSKATKSA-N 474.326 0.944 50 20 JCGD Cc1cnn(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1 1807664856 HYGKNHIQAPUVHA-UWJYYQICSA-N 462.514 0.605 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1808357913 IVFFPYIQWHSUFG-PMVMPFDFSA-N 473.342 0.046 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1 1808416126 FATHRGXDZWRZAZ-VCMTVRCOSA-N 477.529 0.903 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1 1808920050 XILHCUPIONJNQH-NFBKMPQASA-N 487.325 0.748 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1810305583 LXGSWSGBZIWWCZ-APWZRJJASA-N 480.525 0.743 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)C1 1814861099 HDJFRNAVWIXSEE-FCEWJHQRSA-N 468.319 0.985 50 20 JCGD COC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)cn1 1817541174 ADVBBYVGGAXOJI-CYBMUJFWSA-N 474.543 0.924 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1)c1cccc(B(O)O)c1 1819024315 ZZHRFHKSRABSQQ-CQSZACIVSA-N 462.300 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)c2ccco2)[nH]n1 1819403194 XKDNKNBQVGROER-INIZCTEOSA-N 480.485 0.737 50 20 JCGD CCc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)n(C)n1 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O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4ccoc4C3)CC2)CC1)c1cccc(B(O)O)c1 1834800515 JHWBNXXEEWQMDL-FQEVSTJZSA-N 479.386 0.950 50 20 JCGD CNc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834800916 APWVDOCTNAVKNB-UHFFFAOYSA-N 464.375 0.907 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1n[nH]c2ccccc12 1835560070 SXOXGSPBWABMOJ-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccnc(Cl)n3)CC2)CC1 1835738026 QJPBVOSWXWWANR-UHFFFAOYSA-N 486.964 0.628 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc4ccccc34)C2)C1 1835936888 ICPWPPWJDDZTDA-RUZDIDTESA-N 491.309 0.004 50 20 JCGD COc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459551 JUGBEWPYEGMQKP-HSZRJFAPSA-N 469.498 0.078 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc(O)ccc3O)CC2)CC1 1837920086 KGKULSDSXWOFNP-UHFFFAOYSA-N 468.315 0.704 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839040292 CNIRDYACBKEJGN-GCJKJVERSA-N 480.949 0.578 50 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CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(-c3cccnc3)[nH]n2)C1 1779755831 FSRTWPRBZXYDIK-HYBUGGRVSA-N 483.573 0.972 50 20 JCGD O=C1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)=Cc2ccccc2N1 1779985629 NZJJQZOCOSVSKX-RUZDIDTESA-N 475.310 0.236 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnn(C)c3)CCO2)C1 1780098437 ACAWOPGSJQBAPS-JOCHJYFZSA-N 471.470 0.940 50 20 JCGD CC[C@@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)NC(=O)OC(C)(C)C 1781357885 PCFYDYNBRSVXIY-YADARESESA-N 489.378 0.503 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782159094 IQMXSUNJNOELPV-TWQKFESNSA-N 499.568 0.568 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](Cl)COC)C1 1782180286 VHHPBXZDMKAHQN-DBXWQHBBSA-N 464.987 0.824 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)n1cnnn1 1782866566 CVBYTFJVCCBZLK-FLQJBOFYSA-N 457.441 0.949 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1783176735 AQMISSWTCJYINB-ASSNKEHSSA-N 462.459 0.488 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783881864 NNTYRMSEFUELKI-PGRDOPGGSA-N 481.981 0.416 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)C1 1783936962 BNNKTVBRLWYXIN-JKSBSHDWSA-N 452.552 0.169 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783947736 YFLNBSJUCYBJMA-XIKOKIGWSA-N 453.367 0.862 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCOCC4)cn3)C[C@@H]21)[C@@H](O)CCl 1784086844 POQVBVLHPUXCJO-CBVHJVASSA-N 452.939 0.111 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785076520 OWFUZGGDHUIKJX-QXKUPLGCSA-N 490.001 0.545 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785581331 NPTCZKPDEZTJAI-YYWHXJBOSA-N 495.341 0.234 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21 1788611697 RQVBBRMBLHGSCK-RCBQFDQVSA-N 471.493 0.332 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1csc(C(F)(F)F)n1 1789021030 YHLSTPMMUVOLER-NOLJZWGESA-N 483.277 0.749 50 20 JCGD COC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1 1789657676 BFQCPYIRXZDPNS-IBGZPJMESA-N 468.514 0.584 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCCO3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724672 JSHXHNVNBJCHCY-CMOCDZPBSA-N 487.601 0.881 50 20 JCGD CC(C)NCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726620 GIBKNKHQVMASED-FKBYEOEOSA-N 488.633 0.700 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)CC1 1789925962 KQUROFAXROYVJS-AJNGGQMLSA-N 484.388 0.328 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1791984994 TUQZPMMJPVMVKJ-NQCBNZPSSA-N 461.327 0.901 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792982956 XFVOZIVEDJGTNA-HAOOACFXSA-N 471.982 0.823 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(C(F)(F)F)cn1 1794098648 RGBZNFKTJXERTB-USGNIVHTSA-N 485.507 0.996 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC#N 1795462658 KDEWAYNJYYQCBA-YRPNKDGESA-N 484.362 0.354 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)cc1)C2)c1ccc(B(O)O)cc1 1795735017 JBOITKKUBCTENJ-HGKCTWBKSA-N 462.233 0.902 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3ncccc3c1)C2)c1cccc(B(O)O)c1 1795737790 TXVMUSWNCZOBFS-IRJINJETSA-N 459.311 0.361 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1CNc2ccccc2O1 1797676250 SNMBDELLEUQZPF-IKUJCWISSA-N 494.552 0.973 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(Cc3ccccc3)c1)C2 1797751921 ZMKUTSRGHIDTKH-HATOLVCRSA-N 489.536 0.447 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccncc1-c1ccccc1 1798342946 YULGLTWKVPEQEG-IRJINJETSA-N 471.322 0.945 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(N)n1)C2)NC(=O)NCc1ccccc1 1799094756 IWALLRRAXPCQQE-HGKCTWBKSA-N 487.586 0.275 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)c[nH]1 1799097181 HHXNNLGYAQEFFV-VTYHHJSWSA-N 468.558 0.873 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CS(C)(=O)=O)C2 1799217682 BMXOYLFZEODFEL-BTTYYORXSA-N 453.473 0.817 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl 1799276346 JHDHKTMHWOEWEL-VTWRMFPLSA-N 453.319 0.307 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 1799986687 XQYXAWFBSIJJOC-FLXSYLCISA-N 481.594 0.225 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)n1)C2 1800333212 UIXVXMQLMRKBMR-RMRMTIIFSA-N 471.420 0.976 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2 1800975326 MMQALEGHWMCVEI-YIDVYQOGSA-N 463.959 0.370 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cc(=O)n2[nH]cnc2n1 1807352335 FDUPANCAARIDFU-GUYCJALGSA-N 474.319 0.917 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371322 SMJYUIPFKDMMQF-LPHOPBHVSA-N 460.137 0.866 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CC(c3ccccc3)=NN2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373051 MJYZUPDIXGFZPP-FTBPSBKWSA-N 497.364 0.847 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1807373616 UHFAAVPSBPYMFV-HKUYNNGSSA-N 451.288 0.034 50 20 JCGD O=C(Cc1ccc(F)cn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807480199 YPYPEWUBIBWWRR-FDDCHVKYSA-N 462.290 0.858 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc2cn[nH]c2cn1 1810084904 LTOJSERQLFBXSB-JTSKRJEESA-N 470.298 0.666 50 20 JCGD CCN(C)[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 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C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cncnc3)C2)C1 1830538289 AZAULAVRCCRTPS-HNAYVOBHSA-N 455.353 0.897 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1F 1830732812 AXFNHPCCPVEIJB-STZQEDGTSA-N 485.940 0.233 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830735759 MNKBLXLOXKCBFB-OXJNMPFZSA-N 461.342 0.947 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c1 1830738283 NHRZTGZKGNFXHV-ADYAGGNBSA-N 456.898 0.904 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(Cl)c3)CC2)CC1 1833992532 CEQZCSGVATYJIB-UHFFFAOYSA-N 480.997 0.999 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccn4ccnc34)CC2)CC1)c1ccc(B(O)O)cc1 1834798699 YULBGUKUYMRFNZ-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD COC(=O)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1835167542 HWFJSNALGKTPFY-UHFFFAOYSA-N 494.357 0.047 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)CC(C)(C)O)CCO2)C1 1835269135 ZGJSTPYTXKWTAS-QFIPXVFZSA-N 479.486 0.751 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1nc2ccccc2[nH]1 1835296955 IIJHRPDHGCDRGK-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccc(Cl)cc4[nH]3)C2)C1 1835926495 PDBXJSSSKPPQEK-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938184 OXJJDLBQTSCOQF-XMMPIXPASA-N 486.450 0.488 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC3(F)F)C2)C1)NC(=O)NCc1ccccc1 1839054162 JEKYMIJTUGYGHL-PGRDOPGGSA-N 495.527 0.444 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)COCCO)CCO2)C1 1839195299 MVUBUOJIKADTJD-IXNCKXOBSA-N 465.453 0.337 50 20 JCGD N#Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(Cl)c1 1839423544 JKMNLXFULXBHHL-HSZRJFAPSA-N 483.717 0.275 50 20 JCGD N#Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(Cl)c1 1839424252 WVMBXSXJXCNLKR-HSZRJFAPSA-N 498.927 0.594 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3nn[nH]c3c1)CCO2 1839629360 MCDWBGKAKUYFCY-XTVKVDEJSA-N 494.512 0.162 50 20 JCGD CC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CCCCC1 1840124522 VHBMTUZNXUREII-HSZRJFAPSA-N 459.547 0.726 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(Cl)c3)C2)C1 1840185620 QIOVIVCLSTUODE-OAQYLSRUSA-N 452.939 0.783 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2 1841290063 KEPGQPXJVJCTIA-OLZOCXBDSA-N 475.384 0.990 50 20 JCGD CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)C1 1841983925 IXJPYMPBFQENCC-ZDUSSCGKSA-N 450.927 0.045 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c[nH]c1C 1843013130 NEXHIKNVBHMAIS-UHFFFAOYSA-N 467.331 0.629 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C[C@@H](F)C1 1843886276 OSFWTYXMMMTWMF-PKOBYXMFSA-N 489.353 0.779 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1845145348 DUECEBIKRCDBTA-UONOGXRCSA-N 461.943 0.636 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CC1)C2 1846384803 KHBPPPVWGAHNAZ-SFHVURJKSA-N 451.568 0.866 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl)C(=O)NC1CC1 9889690 CDWJKSDAAYJKSJ-UHFFFAOYSA-N 465.315 0.054 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c1cccc(F)c1 11302329 LBRFHDKNPRSGDM-UHFFFAOYSA-N 473.866 0.770 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1 14339232 YLNPDIBBRJMCIV-UHFFFAOYSA-N 483.554 0.821 50 20 JCGD C#CCNS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1 16559676 NENGWEVNCTXSPB-UHFFFAOYSA-N 479.898 0.878 50 20 JCGD Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1OCC(=O)O 109767148 LJGOACWUTRZDHC-UHFFFAOYSA-N 497.551 0.866 50 20 JCGD C[C@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1 725873196 WHRKJOGEVLRZCN-CQSZACIVSA-N 460.466 0.534 50 20 JCGD Cc1cc(Cl)ccc1OCCCC(=O)NNC(=O)CNS(=O)(=O)c1cn(C)c(C)n1 725879917 RKVZQCAUVOMBOU-UHFFFAOYSA-N 457.940 0.975 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)c1 725899026 SHGGWSHLLDIZDK-UHFFFAOYSA-N 473.511 0.995 50 20 JCGD Cc1nn(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1[N+](=O)[O-] 726379202 HPTPDZLGBRPUPH-UHFFFAOYSA-N 480.503 0.280 50 20 JCGD CCn1c(CCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)nc2cc(S(=O)(=O)N(C)C)ccc21 746949178 GOZUSKDEENYLAX-OAHLLOKOSA-N 485.632 0.731 50 20 JCGD Cc1ccc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C 778204947 SBHIZFDCPFUYNT-SFHVURJKSA-N 477.495 0.112 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 811677962 NWPXDZNACDBNDB-HNNXBMFYSA-N 490.538 0.368 50 20 JCGD Cc1cc(C(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)ccc1[N+](=O)[O-] 913151692 ULEBGCJLGUGBBA-UHFFFAOYSA-N 489.510 0.879 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(S(=O)(=O)N(C)C)o1 915030859 XFBMEUDTARPHIW-UHFFFAOYSA-N 459.864 0.810 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNS(=O)(=O)c1cnn(C)c1 915638498 XHXKKHWPRNTJPZ-SNVBAGLBSA-N 460.310 0.076 50 20 JCGD CCO[C@@H]1C[C@@H]1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 916147854 HAGLMKKRLQYBEY-ZWKOTPCHSA-N 482.541 0.636 50 20 JCGD O=C(COC(=O)CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)[C@H]1COc2ccccc2O1 916530173 MUUPSNFBNKOEQW-GOSISDBHSA-N 482.449 0.283 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCCn1nc2n(c1=O)CCCC2 916650177 RAYXOPFHHGPEFM-UHFFFAOYSA-N 470.578 0.314 50 20 JCGD COc1cccc(C(=O)NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1O 919755566 CILOQPBTWKLYKD-UHFFFAOYSA-N 490.538 0.475 50 20 JCGD CCCNC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N3CCOCC3)ccc2n1CC 921039147 CUMFOYAELAPLSY-UHFFFAOYSA-N 466.564 0.750 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1778874331 LBROOLUQMKTJRZ-CQMUHVERSA-N 494.508 0.685 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032430 JUJJAXRNSOORLY-HSZRJFAPSA-N 469.546 0.782 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1779221807 KYHPFYAZABVQSA-JVBXNSIJSA-N 479.603 0.793 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)n1ccnc1 1779371056 AFRKZDUXCSEPFF-YBOAYWMSSA-N 455.519 0.270 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1780132107 SQAMUWQYPFZHGX-QHCPKHFHSA-N 472.278 0.280 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc[nH]1)CCO2)NC(=O)NCc1ccccc1 1780969829 KFNAGPGYIAFHDS-QFIPXVFZSA-N 455.519 0.199 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1782899031 FSVHQINYDUUIQK-HSZRJFAPSA-N 472.734 0.715 50 20 JCGD COC(=O)N(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)Cc1ccccc1 1783691012 JHNVALLILFLEAE-RUZDIDTESA-N 495.341 0.079 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C1)C2 1784094126 LHRGHWKFMVQLQA-OIDVLUPKSA-N 482.965 0.202 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)[C@H]2C1 1784197207 LJPRDJFLFVPDOO-VIQHNZTISA-N 477.986 0.496 50 20 JCGD Cc1cc(CC(=O)N2CC[C@]3(C2)CN(C(=O)CN(C)NC(=O)NCc2ccccc2)CCO3)no1 1784363351 KJJQYWVHAVHDTN-DEOSSOPVSA-N 484.557 0.702 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1785607529 OIMLVLKXRWLEGD-VFCRVFHLSA-N 474.986 0.993 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc4cccnc4cc3F)C[C@@H]21)c1ccc(B(O)O)cc1 1786981647 BXWLGMYYGUPMTG-XZOYJPPVSA-N 491.328 0.890 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)nc2ccc(Cl)cn12 1786985214 RONZBWUMSNOXOU-VDGAXYAQSA-N 496.760 0.883 50 20 JCGD CC(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)no1 1788610584 HYSLCCJFDNRAGY-AXHNFQJDSA-N 456.503 0.704 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)N1CSCSC1 1788685559 JNCYIJUFUCZNNW-QZWWFDLISA-N 473.665 0.382 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnn3C)C[C@@H]21 1789220775 NCZZUTWZBRYBFG-AXHNFQJDSA-N 472.458 0.556 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)C1 1789808334 BSGSSFJWYYSUHT-AHDPXTMNSA-N 480.389 0.998 50 20 JCGD COCCOCCOCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1791134376 FEEBCQDKSASILZ-ULQDDVLXSA-N 465.385 0.821 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1794141914 BPNOMQYXIGWIRK-BQJWPVKWSA-N 474.986 0.908 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)cc1)C2)c1cccc(B(O)O)c1 1795739891 NGLIMARAFVCWSE-HATOLVCRSA-N 460.299 0.069 50 20 JCGD Cc1ccc2oc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)cc2n1 1795941222 RWWJVXYFWIULKY-VTEUUUEMSA-N 464.482 0.652 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)C1 1796190373 SDOSFGJZMMBUPH-HULAXLKRSA-N 483.374 0.875 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O 1796429987 RUJAJKXGPTZYBD-QPHKQPEJSA-N 461.382 0.552 50 20 JCGD Cc1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1796669987 ZHKRPSBZHRMLFX-JHDGKUDLSA-N 480.569 0.939 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)C2)NC(=O)NCc1ccccc1 1799098043 ZEDJNAOKTWVFEU-AZWPUGGCSA-N 485.610 0.797 50 20 JCGD C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2 1799276931 MYFPEIXWQFNNLO-HRJSJKBJSA-N 464.371 0.925 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1799354773 VTKQSNKQYDIQDG-YVECIDJPSA-N 454.351 0.655 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc(C)c1C(=O)O 1799870660 XJUZYPVHXZKHOW-CWPLJXCYSA-N 481.509 0.517 50 20 JCGD COC(=O)N(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)Cc1ccccc1 1802107128 AVLYCMJUXCQPIC-KOUNCHBCSA-N 479.342 0.887 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803147037 SIFMNBOBBSBLAN-QWFCFKBJSA-N 457.955 0.757 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1804577909 ZHQONXFLFDEBBV-OFNKIYASSA-N 461.331 0.595 50 20 JCGD Cc1cc(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1C 1807365884 PRAJVSLFVGLNJV-CVDCTZTESA-N 461.331 0.366 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(-n3cncn3)c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373011 LYZVRRTXHJRQRS-XUZZJYLKSA-N 496.336 0.976 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810248814 OBCBBVUYVZVJFL-JBACZVJFSA-N 451.332 0.654 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812810788 OZVPCBONURMTML-NQIIRXRSSA-N 482.346 0.606 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@@H]1c1cccnc1 1813071193 PUZPZILQGITOKY-OXQOHEQNSA-N 480.529 0.523 50 20 JCGD Cc1cc(NC(=O)CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)no1 1815340056 CUPHVRZWFAKTHV-CQSZACIVSA-N 483.315 0.374 50 20 JCGD COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)ccn1 1815343993 AWEKSMHJBJVIIV-OAHLLOKOSA-N 452.301 0.766 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(-n3cccn3)nc1)CC2)c1cccc(B(O)O)c1 1815361136 YSFOWRMMNBAGKN-KRWDZBQOSA-N 488.338 0.943 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3n[nH]c4c3CCCC4)sc2C1)c1ccc(B(O)O)cc1 1816783946 UIXXDVZJJMASNL-AWEZNQCLSA-N 465.344 0.964 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)Cc2ccccc2)[nH]n1)c1cccc(B(O)O)c1 1817479021 GGDLQHQYXYJWFI-SFTDATJTSA-N 462.315 0.999 50 20 JCGD Cn1ccc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n1 1817558649 CMNSCUHFKKOIPQ-KRWDZBQOSA-N 451.491 0.690 50 20 JCGD COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCN(C(C)=O)CC3)sc2C1 1818898580 SUHPEDKQFRQEFV-KBPBESRZSA-N 457.984 0.473 50 20 JCGD CN1CCN(C2(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)c4cnccc4C(=O)NN)[nH]n3)CC2)CC1 1820796712 QGBKGTLQGNOKCY-IBGZPJMESA-N 495.588 0.494 50 20 JCGD CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)nn1C 1820962278 GIHMWBXQVDRPKN-CQSZACIVSA-N 453.333 0.658 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(=O)nc4sccn34)sc2C1)c1cccc(B(O)O)c1 1821152874 BSMDTUHXPZDVOH-CYBMUJFWSA-N 495.351 0.432 50 20 JCGD Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c(O)n1 1821514249 ZCTUMCXRNYVWCZ-AWEZNQCLSA-N 452.301 0.772 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccnn1)CC2)NC(=O)NCc1ccccc1 1822518335 KITXIHHCNXNXKM-MRXNPFEDSA-N 497.585 0.693 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1C=CCN1)CC2)NC(=O)NCc1ccccc1 1822518474 PCMQGHMMPVZSEY-WMZOPIPTSA-N 483.598 0.929 50 20 JCGD C=C(CC(=O)OCC)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1822922379 NHYWMYSSSCHKSK-HNNXBMFYSA-N 457.317 0.558 50 20 JCGD CNC(=S)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1828931520 QLMQVEWBBBVKFC-KRWDZBQOSA-N 454.641 0.463 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1830534878 DLRXYMHOQFYGOB-KZULUSFZSA-N 471.308 0.276 50 20 JCGD O=C(C1CCN(c2ccccc2)CC1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830610208 MFRZOSUNIHKKLL-NFBKMPQASA-N 465.978 0.959 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830725630 LCVAJNMKNDZGPX-IQUTYRLHSA-N 484.377 0.175 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830732432 YEEVKKUOCKLCEC-QVKFZJNVSA-N 475.970 0.300 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1O 1830735664 LIHRFAWHDICVCC-FXAWDEMLSA-N 455.895 0.020 50 20 JCGD O=C1CCCCN1CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1831765624 OPMWFBZHZCWBKM-NRFANRHFSA-N 455.364 0.612 50 20 JCGD Cn1nncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1833236703 QHTBOCRHUAQOBH-UTKZUKDTSA-N 492.374 0.891 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3c(s1)CCC3)CCO2 1834544802 BKSGPUJKMFPHLK-HSZRJFAPSA-N 470.356 0.300 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1 1835079671 MHLPPCGKQSPVSU-HOTGVXAUSA-N 464.966 0.978 50 20 JCGD Cc1c[nH]cc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737001 QDENCRJKWMGGBJ-UHFFFAOYSA-N 453.547 0.821 50 20 JCGD CCSc1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835926586 TUIZHEVUIQTDAY-HSZRJFAPSA-N 485.371 0.257 50 20 JCGD O=C(CCCC(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933968 IJHYBESQKRYOHG-LJQANCHMSA-N 458.242 0.169 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4F)CC3)C2)C1 1835941094 GRBWHXJYGMCVEX-DEOSSOPVSA-N 482.317 0.307 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1noc3ccccc13)CCO2 1835983496 ZXVZCPTVZOAACU-QHCPKHFHSA-N 473.530 0.200 50 20 JCGD CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c2ccccc21 1836339809 QWSNVPWJQLVFJW-DYESRHJHSA-N 450.923 0.726 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1 1836850617 VHDMYRONJRDIRS-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD O=C(c1cc2cn[nH]c2cn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837199221 CJWUXEVNPZRJFX-RHSMWYFYSA-N 456.272 0.718 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn(C(F)F)c3=O)CCO2)C1 1837772060 JPHHLFFGBNNHEO-AUUYWEPGSA-N 463.865 0.567 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc4ccnn4c3)CC2)CC1 1837920314 ZAVHPZNJYVTDAC-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920979 OQNGHADKUIVXKW-LJQANCHMSA-N 452.744 0.232 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccc4c3NC(=O)C4=O)CC2)CC1 1838347619 CUJZGMSELRLQKJ-UHFFFAOYSA-N 499.568 0.807 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1 1838513466 TWVDARMALYGCGK-SCLBCKFNSA-N 455.924 0.410 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc21 1839200075 BJSXYIDQVZJQQH-UZLBHIALSA-N 499.337 0.638 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1OC 1840185915 ZYROKLPTPIFNKH-QHCPKHFHSA-N 478.546 0.147 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C[C@H]2C[C@H]21 1840912470 FZSYNBASZHZHRU-XBJPRQPRSA-N 487.981 0.440 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841353020 ZFJXXGUSZCPHLS-UONOGXRCSA-N 461.943 0.636 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2ccc(Br)cn2)C1 1842090851 WTMJTXSXJKEXBI-UHFFFAOYSA-N 458.121 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc(Br)cn2)C1 1842091197 KHQLTRRRIVIZIF-UHFFFAOYSA-N 473.331 0.902 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1843383398 WAIYJFCMVSXEOU-OAHLLOKOSA-N 455.556 0.103 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2 1843416437 KHCZQCONRIZETQ-QZNIYLPFSA-N 454.531 0.725 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263596 UUULYMZYYUBKEM-KRWDZBQOSA-N 486.529 0.081 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CN1CCN(C(C)=O)CC1)C2 1844692476 AHXSJJKRNTYZOT-UHFFFAOYSA-N 487.513 0.501 50 20 JCGD O=C1NC(=O)[C@H](CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](Br)Cc2ccccc2)N1 1848131469 AFGDVGWDLRTKSV-UGUYLWEFSA-N 463.332 0.793 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNc3nnc(C)c(=O)[nH]3)CC2)cc1 11547904 UTBWSPRANFVLNE-UHFFFAOYSA-N 464.504 0.194 50 20 JCGD C[C@]1(c2ccc(CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)NC(=O)NC1=O 726282677 PPYITUSDRZBUPF-HXUWFJFHSA-N 459.484 0.289 50 20 JCGD Cc1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)ccc1-n1cnnn1 728213712 HSZRMTKLHAIHSC-UHFFFAOYSA-N 456.532 0.664 50 20 JCGD O=C(COC(=O)[C@@H]1CCCCN1C(=O)c1ccco1)NNC(=O)[C@@H]1COc2ccccc2O1 728331226 GHVIUSSPXDMEKJ-KSSFIOAISA-N 457.439 0.805 50 20 JCGD CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1 728381980 SKCZDJCXHXESGC-SNVBAGLBSA-N 496.405 0.722 50 20 JCGD N#Cc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)cc1 728959303 KDZASTKQBQIHER-UHFFFAOYSA-N 498.569 0.312 50 20 JCGD NS(=O)(=O)N1CCC(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1 729298375 DGQBRBKXNYIJOD-UHFFFAOYSA-N 484.538 0.121 50 20 JCGD O=C(Cc1ccccn1)NNC(=O)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12 729394967 DVGLHJLSODZRGS-UHFFFAOYSA-N 471.495 0.360 50 20 JCGD COc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)c1O 747875657 XCWWNKZUUHTCNY-UHFFFAOYSA-N 451.505 0.305 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)[nH]n2)cc1OC 768192384 CQUKIYFCTAARMV-UHFFFAOYSA-N 459.484 0.833 50 20 JCGD COc1ccccc1N1C[C@@H](C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1=O 849206130 DRPQPUVHXNYSRS-AWEZNQCLSA-N 456.411 0.961 50 20 JCGD O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1I)N1CC[C@@H](B(O)O)C1 864234125 NCAREPQQPYQYIM-LLVKDONJSA-N 494.116 0.001 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)cc2)C[C@@H](C)O1 912921112 LTYBKWYJJZRFPQ-TVFCKZIOSA-N 482.603 0.745 50 20 JCGD COc1ccnc(NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccc(Cl)cc2)n1 914762831 ODSQKTZVAMOOEX-ZDUSSCGKSA-N 477.952 0.364 50 20 JCGD O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 915184913 KSDNURJFVUKFQS-UHFFFAOYSA-N 483.524 0.558 50 20 JCGD COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)c(OC)c1 918779560 ZZPXQYFKXCLOTK-UHFFFAOYSA-N 480.485 0.492 50 20 JCGD COc1cc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1OCC(=O)N(C)C 1251629777 PZPBJOFIFRTTMH-UHFFFAOYSA-N 485.545 0.699 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CN3CCN(C(C)=O)CC3)C2)C1 1778359727 XDRILMXRNNDHHG-APWZRJJASA-N 459.385 0.154 50 20 JCGD Cc1cccc2c(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)n[nH]c12 1779037349 WSHBEXIEKWWJEB-QHCPKHFHSA-N 463.498 0.627 50 20 JCGD COc1ccnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1OC 1779374178 IAIRNXREMNUJEY-HOYKHHGWSA-N 498.540 0.539 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)Cc1ccccc1)C2 1779375576 PVWAQKJVCRPWGC-BPYKYCOYSA-N 481.553 0.416 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1F 1780111606 SMQIHKYIODMTBA-DEOSSOPVSA-N 499.499 0.758 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccn(C)c1=O)CCO2)NC(=O)NCc1ccccc1 1780969802 ONSHRURWLUXYKT-VWLOTQADSA-N 496.568 0.175 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CN3CCCC3)CCO2)C1)NC(=O)NCc1ccccc1 1780970408 XTKKQXNQEICCEL-DEOSSOPVSA-N 472.590 0.258 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2 1781383333 KZMZUXVINSAZDT-WIYYLYMNSA-N 480.986 0.156 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)cc3O)C2)C1 1781528315 VDQKQNHCXJWZDS-FQEVSTJZSA-N 483.363 0.971 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/C(=O)NCc1ccccc1)C2 1782210103 FEPLPHOTKMROSZ-ZUKJMEDHSA-N 499.612 0.746 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)s1 1782212135 JIBWTVCHPWZCDL-WZONZLPQSA-N 494.614 0.964 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)CCC(=O)NN(C)C)C3)c2n1 1782214111 CRZDOPBEADSSOZ-NTKDMRAZSA-N 485.589 0.847 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c(O)cccc34)C2)C1 1782503751 KAWYCZXCRGWALF-XMMPIXPASA-N 461.283 0.378 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1 1783543566 QVPSXYBDAZNZPZ-MUEKUWCCSA-N 490.520 0.039 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1783712289 NSQIVGCDWLBBCX-VFNWGFHPSA-N 455.556 0.103 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1 1783841275 RXWKVIYBBRJEDV-ZJSXRUAMSA-N 450.300 0.204 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3cc(O)ccc3n1)CCO2 1783935048 ODSWEQJIXJBLST-HSZRJFAPSA-N 455.515 0.757 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783947583 XVOPTEPLMOEEAA-KPZWWZAWSA-N 454.351 0.896 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784085118 CFPRCBHJFCMJJM-GGUVTUNTSA-N 477.986 0.494 50 20 JCGD Cn1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]3C2)n1 1785075651 UZFFXWYJYHSJEZ-AJNGGQMLSA-N 470.958 0.541 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N(C)C)o3)[C@H]2C1 1785886629 OUAPHSPDNBVAJM-SKIHNHESSA-N 471.518 0.468 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(Cl)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786984604 RJRZPMGGDCYJDF-JQFCIGGWSA-N 459.695 0.028 50 20 JCGD CC(=O)O[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1)C(C)C 1787508815 VUJKCQTXUFDEGU-GTXJVYCPSA-N 475.546 0.688 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc[nH]c4c3)C[C@@H]21 1788611230 PLISIYXVSWQFKS-VHFSOBRXSA-N 463.498 0.469 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1n[nH]cc1I 1788899563 IBXVSSLEWAJLFB-QSFUFRPTSA-N 482.706 0.207 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4cccnc4)[nH]n3)[C@H]2C1 1788934704 AYLRMUGHIQDDQV-XERREHJYSA-N 490.524 0.377 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc(=O)nc2cccnn12 1789198228 UQDDCLSZNHDZHX-XALPAYFRSA-N 468.283 0.373 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21 1790963207 OMYZWVJULGIQBR-AYDFFVQHSA-N 478.347 0.856 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21 1791057291 SCRCIULZIPIXLD-HNRKBYSSSA-N 483.363 0.756 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr 1792870764 LCGNITJRSYFFCB-JMWBNMSQSA-N 463.325 0.102 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)[C@H](O)C1 1792981316 JJLKDZRQUXUNFK-UNPPPGBBSA-N 489.997 0.184 50 20 JCGD CCc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1794376784 UMMGUKAKNSTZAZ-IHBLFXCCSA-N 452.515 0.981 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795737688 JVPTZBOPBCBUES-HCBXPFHNSA-N 452.316 0.382 50 20 JCGD CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)c1cccc(Cl)c1 1795739919 QPPUWTIQQJIYAQ-GMQQQROESA-N 499.760 0.100 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccncc1)C2 1796439456 GGXLNSJFHHDWPJ-FFZFCVPESA-N 470.555 0.897 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cn1)C2)[C@@H](F)Br 1799347398 JQNJNCARSKOAEF-DLTLXFJOSA-N 471.327 0.812 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C 1799366016 DKOSCVHRVMMTFI-JAAXMTQOSA-N 478.384 0.635 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2 1800757443 LPWIDUXXGSRBIU-MBMVNNNZSA-N 465.348 0.864 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1804347461 CSYSDINHRYZMDH-QJZXMWHDSA-N 452.309 0.469 50 20 JCGD CN1CCN(CCC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CC1 1806916543 QXPSUOISZFENFV-YKSBVNFPSA-N 473.622 0.098 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362625 MOMRZSPBQVNPAC-XLIONFOSSA-N 486.297 0.143 50 20 JCGD COc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc1 1807363007 OARFWPIOUMTSIM-XMSQKQJNSA-N 460.299 0.798 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)ccn1 1807375083 LHEPZPTVXFLDKS-NZQKXSOJSA-N 487.325 0.748 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccn3c(O)nnc23)[C@@H]1c1cccnc1 1808194915 SBHMPCFBELSZOT-UZLBHIALSA-N 480.529 0.523 50 20 JCGD N#Cc1c[nH]c(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1 1810303869 ZNPXWSYGJWLUJX-OXJNMPFZSA-N 458.482 0.913 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1 1811194261 UGDSONWMRUFLRE-FXAWDEMLSA-N 461.482 0.347 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1C 1811629401 UOTDIFPANSSYSH-DYESRHJHSA-N 463.303 0.137 50 20 JCGD COC(=O)CSCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1815223975 PAHSFROMXZYTHI-HNNXBMFYSA-N 475.531 0.620 50 20 JCGD O=C(Cc1cnc2ccccn12)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336009 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Cc1ccc(=O)n(C(C)(C)C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n1 1827051751 CSYUFEDZTOYIFK-QFIPXVFZSA-N 494.401 0.900 50 20 JCGD NC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1 1827500765 JHYZLRRPMSGVCK-INIZCTEOSA-N 464.312 0.461 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)N(C)C)CCN2C(=O)OCc2ccccc2)C1 1828936801 YSVKYOFXOVFRIE-MBSDFSHPSA-N 494.976 0.781 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COCCO)CCN2C(=O)OCc2ccccc2)C1 1829231149 ATFLFSNYRNLUAK-WMZHIEFXSA-N 497.976 0.701 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1 1830546706 VPFKUJXSBVQJIX-IFXJQAMLSA-N 456.337 0.817 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1831645689 CZVLXCWUIXNMJW-YWZLYKJASA-N 451.911 0.912 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1831865157 IWWUMCXDEPSZAN-FDDCHVKYSA-N 475.546 0.534 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cncnc3)C2)C1 1832549632 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O=C(NC1CCN(C2CCN(C(=O)c3[nH]nc4ncccc34)CC2)CC1)c1cccc(B(O)O)c1 1834799883 BFNVXKKBXBKJBM-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1835045847 OCFCFQCCLSFBSH-DLBZAZTESA-N 477.002 0.043 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccoc3C(F)(F)F)C2)C1 1835928161 GJDFCDLPPVKQFK-HXUWFJFHSA-N 482.220 0.362 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccc4cc(O)ccc4n3)C2)C1 1835928355 MGZCIIFXOHBABD-RUZDIDTESA-N 491.309 0.004 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1 1835986445 SQFIZNIAMFKQIH-HNAYVOBHSA-N 457.369 0.840 50 20 JCGD NC(=O)c1nccnc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1836050208 JWMNIZMOXLTJAW-OAHLLOKOSA-N 471.331 0.451 50 20 JCGD O=C(CCN1Cc2ccccc2C1=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836589929 HJUHDLSTCOVAJN-GCJKJVERSA-N 465.934 0.089 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1 1837153065 KZHUUAGNQSRGCA-DYESRHJHSA-N 451.907 0.254 50 20 JCGD Cc1cccc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)[nH]c12 1837458976 GZBWBZFJFAPTNP-RUZDIDTESA-N 492.536 0.859 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1 1837653612 IQRMHXYCKLUVRH-KRWDZBQOSA-N 462.385 0.921 50 20 JCGD O=C(CCBr)N1CCC(OC2CCN(C(=O)CN3C(=O)C=CC3=O)CC2)CC1 1837654780 VUYLIGBEPMLLST-UHFFFAOYSA-N 456.337 0.695 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838499021 LIMVIKZJOFJGKT-VFNWGFHPSA-N 463.922 0.567 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)nn1 1838829526 CULNOMKQGCHVSE-KUHUBIRLSA-N 471.352 0.976 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COCCOCCOCCOC)C2)C1 1839149104 TWJQVMSKLJSCID-RXVVDRJESA-N 480.986 0.156 50 20 JCGD CCOc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1 1839198101 SYMIHAZMIRQKPZ-RHSMWYFYSA-N 461.288 0.636 50 20 JCGD CCC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)COC1 1839776878 KVPJWSXSABBHFE-ZHNJOBQTSA-N 461.519 0.003 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)cnc2s1 1840032603 DDVUIRLAUCNZEE-BFUOFWGJSA-N 499.387 0.918 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccoc4C3)C2)C1 1840182821 VOVYDQWMWXYQPJ-FDDCHVKYSA-N 462.547 0.214 50 20 JCGD CO[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccccc1 1840184092 RFMPCGZOHNBVAX-JTHBVZDNSA-N 462.547 0.204 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185409 PRUPXFKIZDYDCX-QHCPKHFHSA-N 496.992 0.721 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840895268 NHTDJLCEZBCMBZ-SJCJKPOMSA-N 494.433 0.334 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2 1840951151 HHMRGIDJWWQTES-LEWJYISDSA-N 458.506 0.561 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)Cc2ncccn2)C1)NC(=O)NCc1ccccc1 1842111090 BCWQSRVZQCRTMD-UHFFFAOYSA-N 451.531 0.569 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C[C@H]2C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1846157705 HMEPDZGEHNTYPW-YADARESESA-N 483.374 0.831 50 20 JCGD O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)CCNS(=O)(=O)c2ccc(Cl)cc2)C1 1846277323 SLYKAOYQFRXVQF-OAHLLOKOSA-N 464.371 0.812 50 20 JCGD C[C@H](S)C(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1846368358 XSHXCMYPHHWQQP-YJBOKZPZSA-N 491.419 0.324 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN1CCC[C@H]1C(=O)N(C)C 726277253 KJZJEUZCQRSUOC-HNNXBMFYSA-N 467.596 0.175 50 20 JCGD COc1ccc(C(=O)NNc2nc(-c3ccncc3)no2)cc1S(=O)(=O)N1CCOCC1 726377139 KPHUEAXCPRQEFQ-UHFFFAOYSA-N 460.472 0.918 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)c3cc(F)ccc3Br)cnc2n(C)c1=O 728549531 NTCZYKKUAVVFPQ-UHFFFAOYSA-N 450.224 0.609 50 20 JCGD Cn1c(CCC(=O)NNC(=O)CN2CCCC2=O)nc2cc(S(=O)(=O)N3CCCCC3)ccc21 789857285 QXLMNBUVNULNLC-UHFFFAOYSA-N 490.586 0.450 50 20 JCGD O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 912642861 AIHHDANBLBUSSJ-YXUGBTPSSA-N 472.523 0.039 50 20 JCGD O=C(NCc1nnc2n1CCCCC2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 915915596 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O=C(c1cc(=O)nc2cccnn12)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1780059724 GFADUPYIWXJEIK-WMLDXEAASA-N 454.256 0.224 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1cncn1 1780968472 CTGLXAUMMKCKGW-MBSDFSHPSA-N 484.561 0.015 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)on1 1780968808 FRNDBNDTCWEWAC-HSZRJFAPSA-N 470.530 0.773 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970093 RNYQISGKYXTURP-DEOSSOPVSA-N 488.589 0.031 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1782169569 SXSKAFBQBFNQFD-HSZRJFAPSA-N 469.546 0.392 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1 1782602180 RRLCGMQIBIITPG-WCBNNDDYSA-N 491.552 0.717 50 20 JCGD O=C(Cc1cccc(OC(F)(F)F)c1)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1783010239 AJSWRNVKBWIBIH-JOCHJYFZSA-N 492.259 0.951 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)C3(O)CCC3)[C@H]2C1 1783513870 WNCYNEYATRAIPW-WXUVAUSPSA-N 459.547 0.651 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1783940684 YVIKMASESOKZOQ-SNXGKTBFSA-N 462.503 0.020 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(N4CCOCC4)cn3)[C@H]2C1 1785724759 MELYGGJZUONROU-CAIZAGQASA-N 466.966 0.765 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981861 NGELATXJBNJXKP-BPXKWBHBSA-N 484.308 0.970 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOc3ccc(F)cc3)C[C@@H]21 1788607723 BFGWSAGRGGIKBC-JHVJFLLYSA-N 485.516 0.887 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1cc(=O)nc2cccnn12 1789198227 UQDDCLSZNHDZHX-GPMKHBRKSA-N 468.283 0.373 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1 1789923138 UBXVEKAVJNMSRU-BCJGNJTBSA-N 472.315 0.791 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1793647851 YRXMYQGUQAESGN-RIUYPTKQSA-N 459.971 0.965 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cc1O)C2)c1ccc(B(O)O)cc1 1795735862 GTWWJGLZGACGGH-HBCWATKFSA-N 489.131 0.352 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCNC1=N 1796024692 UKQYCEGQFSHBMD-QDMKHBRRSA-N 458.475 0.612 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncc1C(F)(F)F)C2 1797750543 GWBUJQNPKYZMIC-DPIQGUFMSA-N 478.431 0.616 50 20 JCGD Cc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)ncc1[N+](=O)[O-] 1798440099 AIUWFWUTHOJOJI-BTTYYORXSA-N 453.459 0.862 50 20 JCGD COc1ccc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1799019493 LJBVQHXBSMTWNI-DBWKPXFBSA-N 473.917 0.864 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1799354769 VTKQSNKQYDIQDG-RNJOBUHISA-N 454.351 0.655 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)no1)C2)NC(=O)NCc1ccccc1 1799869861 SFZGJQXBLSVHTN-BJWYYQGGSA-N 456.503 0.978 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCCO2)[C@@H]1c1cccnc1 1802588480 MIIGAIAPTRPJPE-UXPWSPDFSA-N 452.515 0.969 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1807022889 BLESGBPFCCJFJG-XNRPHZJLSA-N 477.296 0.843 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)Cc2ccccc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807366950 ITXVCNGTQGXTGY-XWGVYQGASA-N 473.338 0.685 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1807372282 DCKMHNXBENHMIY-ICSRJNTNSA-N 465.315 0.424 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2C[C@H](O)CN2)[C@@H]1c1cccnc1 1807678727 BQHNDUXGIYSPAU-VMXHOPILSA-N 496.008 0.942 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2nc(CO)[nH]c2c1 1809112223 LXWQRVUAANERFO-CYFREDJKSA-N 499.336 0.763 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnn3cccnc23)[C@H]1c1cccnc1 1809743754 VSEYYBJYOWKZEV-OXQOHEQNSA-N 485.508 0.756 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NC(=O)c2cnccn2)[C@@H]1c1cccnc1 1810441684 SFQYKYMDQBZDPN-RUENVJTFSA-N 474.949 0.950 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1 1811452473 ZMRJFZXCHIHLON-XMLBAGAUSA-N 476.497 0.619 50 20 JCGD CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1 1811621513 SDTXZAMMQOSQDZ-AVRDEDQJSA-N 475.314 0.584 50 20 JCGD CN1CCN(CCC(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CC1 1813070163 DJLOYZVQOSYNLP-RDPSFJRHSA-N 473.622 0.098 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2=NN(C)C(=O)CC2)[C@H]1c1cccnc1 1813071558 URTYGJKPWIFVEQ-IERDGZPVSA-N 457.535 0.069 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2c(O)cc(O)cc2O)[C@H]1c1cccnc1 1813073414 PJPKAPSRLSOARS-QRQCRPRQSA-N 471.514 0.891 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc3n(n2)CCNC3=O)n[nH]1 1816627135 YLORCFZTYKMTHJ-OAHLLOKOSA-N 471.522 0.029 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3ncccc23)[nH]n1)c1ccc(B(O)O)cc1 1817471559 IJABVZYOAYOAOZ-IBGZPJMESA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccncc1O)CC2 1819798136 YQHHSVMKJZHKHJ-SNVBAGLBSA-N 453.484 0.782 50 20 JCGD Cn1cccc1C(=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819801416 MAIXOKVMRGWKSE-NSHDSACASA-N 467.511 0.589 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccnc4c3OCO4)sc2C1 1821235280 FOVJZHMKTCFGHR-NSHDSACASA-N 460.516 0.866 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3ccccc3-n3nccn3)sc2C1)c1ccc(B(O)O)cc1 1823547953 KRXBVSCRCJUPQK-INIZCTEOSA-N 488.338 0.943 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCS1(=O)=O)CC2 1826089903 PVEXHYNYOAXYNX-SMDDNHRTSA-N 457.578 0.005 50 20 JCGD C/C(=C\c1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1829700407 DXMYLCDDUHHAFW-ILAWTMEDSA-N 470.356 0.601 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1830543600 VQMUVFMSHIMZLT-YWZLYKJASA-N 480.363 0.759 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830544304 UMFWDKJPRSJBKJ-YLJYHZDGSA-N 495.411 0.544 50 20 JCGD O=C(c1cc2ccc(Cl)cc2nn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830727765 DFTNCUXMCXQHJY-YLJYHZDGSA-N 469.325 0.953 50 20 JCGD CC(C)[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1830862456 ZHSXEMUPLHFDDL-CKJXQJPGSA-N 477.986 0.592 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1 1831204944 BZZBXEHHBIYZCV-BEFAXECRSA-N 462.385 0.923 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1831645958 FIXDFHIYKIBLQI-VQIMIIECSA-N 466.000 0.276 50 20 JCGD CC(C)c1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)no1 1832790540 AOTZLCNZSFCRKN-PBHICJAKSA-N 463.304 0.882 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n1 1833338880 AKQQQLYKVKHFCG-DJJJIMSYSA-N 469.336 0.893 50 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HDDIYLIFGPGHJM-VWLOTQADSA-N 466.343 0.378 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1 1835935734 ONVQCXJNYZWEML-QFIPXVFZSA-N 470.312 0.558 50 20 JCGD Cc1occ(C(F)(F)F)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835937193 RPSADPGFAFWUQU-OAQYLSRUSA-N 496.247 0.670 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cc(C)cnc34)CCO2)C1 1836950207 QDPDIUKKGJAISW-UZLBHIALSA-N 451.911 0.362 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837341962 OTDWBLXDHMJESB-WZONZLPQSA-N 461.563 0.316 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CS[C@@H]1CCCCO1)CCO2 1837510154 CYAUWLDMCZEXMF-RTWAWAEBSA-N 472.608 0.076 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)n1 1837657039 MFLWVPUNCKADQK-HXUWFJFHSA-N 485.379 0.528 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1838568663 JTBHYIKHYUYCBT-OXJNMPFZSA-N 458.870 0.440 50 20 JCGD O=C(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)Nc1ccc(F)cc1 1839028647 NZOYNQHAVHBQNA-OXJNMPFZSA-N 457.886 0.210 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839044921 FUHONGDFTJFVOX-UZLBHIALSA-N 471.341 0.815 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839153770 RWHZJLRMJVXZLA-BVGQSLNGSA-N 453.367 0.387 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)CCO2 1839395864 IXOZBEIWNMSGLT-RUZDIDTESA-N 490.325 0.140 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(=O)Nc3ccc(F)cc3)C2)C1 1840154367 VOOJGZGFUHHONQ-UTKZUKDTSA-N 471.913 0.865 50 20 JCGD COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1C 1840644477 VBFZDNIDHLADMS-XMMPIXPASA-N 483.525 0.386 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCN(S(C)(=O)=O)CC2)c1 14287656 ZNDOBFXNDFHSOY-UHFFFAOYSA-N 460.578 0.150 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@@H](CCSC)NS(=O)(=O)CC)c2ccccc2c1=O 105565554 VJWVQDMNBTXPAT-OAHLLOKOSA-N 469.589 0.629 50 20 JCGD CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2S1(=O)=O 728848493 QVCUFJGKBRURHT-UHFFFAOYSA-N 472.527 0.707 50 20 JCGD O=C(Cn1ccc2ccccc21)NNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 729511071 QUJLERTWPROPQG-UHFFFAOYSA-N 460.472 0.858 50 20 JCGD COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCN(C(C)=O)CC3)cc2)cn1 729692580 LNBIPTYUGOQCRX-UHFFFAOYSA-N 492.583 0.574 50 20 JCGD O=C(COC(=O)c1cc(F)ccc1N1CCOCC1)NNC(=O)[C@@H]1COc2ccccc2O1 730864552 ATJJNQBJOZLIPL-IBGZPJMESA-N 459.430 0.807 50 20 JCGD CCS(=O)(=O)Nc1ccccc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 743737953 MFEBDQBSROHRHL-UHFFFAOYSA-N 454.530 0.773 50 20 JCGD CS(=O)(=O)c1ccc(N2CCN(C(=O)NNC(=O)[C@H]3Cc4ccccc4O3)CC2)c([N+](=O)[O-])c1 748342746 WOAAJSVYGHBEOE-LJQANCHMSA-N 489.510 0.865 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cc(Br)c[nH]1 748464694 IQLMXUFGPCGWHB-UHFFFAOYSA-N 464.324 0.855 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NC1CCSCC1 750331831 KBCANFZKRLFMSV-UHFFFAOYSA-N 456.590 0.866 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)NNC(=O)CNC(=O)c2ccco2)cc1 751207444 XSQMSJKZSAUBDV-KRWDZBQOSA-N 476.511 0.603 50 20 JCGD COc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C 789856214 ATDRQYXRONMZLW-HOCLYGCPSA-N 466.560 0.936 50 20 JCGD COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc(OC)c1OC 913415719 VNIKEQQTLWUUOD-UHFFFAOYSA-N 480.499 0.410 50 20 JCGD CN1C(=C(C#N)C(=O)COC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)N(C)c2ccccc21 914653452 KEZLBTVOFGMVJJ-GJZGRUSLSA-N 472.523 0.456 50 20 JCGD CN(C)C(=O)N1CCC(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1 915058860 ZAQCMBMZTKUVBN-UHFFFAOYSA-N 451.549 0.626 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)N[C@H]1CCS(=O)(=O)C1 915880726 XLHGXXDVGXJUAT-INIZCTEOSA-N 466.541 0.296 50 20 JCGD CN1CCN(c2ccc(CNC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cn2)CC1 916245528 GKKQUVUMDCLLRO-UHFFFAOYSA-N 480.617 0.876 50 20 JCGD CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1 918725221 HAPIURUNHAZSCC-UHFFFAOYSA-N 474.586 0.300 50 20 JCGD CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc(C(C)C)nc21 919889627 QFVLISZSQHYOSU-LLVKDONJSA-N 466.520 0.162 50 20 JCGD COc1ccc2cc(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)[nH]c2c1 1777769736 RVVYHKNHGPSTGR-DEOSSOPVSA-N 463.299 0.614 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1 1777781292 LAZGNODCUWVCQK-JKJLQIMHSA-N 493.528 0.319 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1777993568 QVWLEIPAIWORQT-QNFHRHJVSA-N 489.997 0.736 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccnc1)C2 1778091020 COBOYJPMPLBHNF-IINOVHIQSA-N 455.519 0.531 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCCNC3=O)C1 1778918499 HNDZYFRHQRHJBT-OWDMVUQNSA-N 482.379 0.928 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)c1cccc(Cl)c1 1780929459 NOQNYBDGIXKCTG-QKLQHJQFSA-N 458.342 0.947 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)COc3cccnc3)CCO2)C1)NC(=O)NCc1ccccc1 1780968763 JPKPTROJGRVVFL-RUZDIDTESA-N 496.568 0.637 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)C1 1781332902 GDISYHQDXWFXPS-UPRAQXHNSA-N 494.358 0.879 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1 1781472871 OTQOCXCRWQPVFH-HXUWFJFHSA-N 454.911 0.568 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1782868001 XFMUFTZKZSMLLJ-DWVIIIMKSA-N 476.480 0.853 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCSC2)C1 1783202077 CDTMKEFDCVCAMZ-QXATTWAWSA-N 461.588 0.956 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)=NO2)C1 1783452043 IVWGXKYJUISPRX-MGPUTAFESA-N 486.953 0.182 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)CCO2 1783527542 CVDFMPJGEFOWOK-VEVIJQCQSA-N 464.357 0.485 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2 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475.354 0.667 50 20 JCGD COc1ccc2oc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)cc2c1 1797350501 SWVAJZCWJVTQQQ-FAQVEIGNSA-N 464.283 0.638 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2ccnc2c1 1797445804 RFMOVSGDXVDTRC-KEMUROEHSA-N 463.498 0.672 50 20 JCGD Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c2cccnc21 1797751590 KNKVBWKNLBCOKK-HBCWATKFSA-N 463.498 0.089 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c(C#N)c1 1799237487 OURQYUCTNHCMJZ-UQCYYEOYSA-N 492.536 0.833 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1OCC1CC1 1799698306 FMEXYEOBKLEGOY-IRJINJETSA-N 494.353 0.681 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1800191524 DSEFZUHYINKZCA-REGYPHIPSA-N 452.515 0.162 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)C2 1800976994 FJDRWCZPQJBQCK-PHPOFCCKSA-N 475.970 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50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cc1)C2)c1ccc(B(O)O)cc1 1795735922 KDKPLOBCJTUIND-HGKCTWBKSA-N 460.242 0.485 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc3ccccn13)C2 1796439420 BUODADLZUBTSOY-HNAUYISWSA-N 477.525 0.600 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)c2nncn2c1 1797691052 ZUYSTHYCXUPVLJ-ZJOAGLHVSA-N 498.931 0.720 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)(Cl)Cl)C2 1797753811 GEGCPJACANOSCY-BZBKMWRSSA-N 450.710 0.259 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)C1=O 1799350129 RGFNOSHBULWCQL-KTBFAXTASA-N 454.252 0.715 50 20 JCGD N#Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(Cl)c1 1799749481 VLOLGKAYDZAFMG-CWPLJXCYSA-N 453.691 0.408 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)C2 1800644080 HUIUCGNWNZZALZ-GWCDLVAZSA-N 470.368 0.220 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3ncccc3c1)C2 1801010591 KEGBMWCFDMKJTA-NHKMSHSESA-N 453.543 0.740 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C#N)nc1C(F)(F)F)C2 1801013312 MUEJGVKRZSTOLM-IVWMJMPLSA-N 482.463 0.548 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(-n3c(O)nnc3O)cc2)[C@H]1c1cccnc1)[C@H](O)CCl 1803140817 IKGUKQYQNGVQET-JQHSSLGASA-N 486.916 0.993 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803148602 VFZSQKPCMPUSSP-FXECBMLZSA-N 459.934 0.901 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C2=NN(C)C(=O)CC2)[C@H]1c1cccnc1 1804119487 IHSPDXFERZDCEC-FIMQGSNUSA-N 492.540 0.830 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)CC1 1804126272 NMTQWFBGADFTQL-BCDXTJNWSA-N 451.568 0.866 50 20 JCGD CC(C)(NCCC#N)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807146278 XJLDZXVLARKXGA-FPOVZHCZSA-N 463.347 0.363 50 20 JCGD O=C(COc1ccc(O)cc1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809967780 LSMLEQBPJIETTQ-UHFFFAOYSA-N 452.316 0.996 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810301995 FPYQPINDXRARJE-APWZRJJASA-N 477.529 0.886 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)/C=N/O[C@H]2CCCCO2)[C@H]1c1cccnc1 1810302539 KSOQYAJMMNOSTA-XAXFQHHPSA-N 495.540 0.929 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1nc(O)n2c1CCCC2 1810591025 VCYASNNEUKWQTD-AVRDEDQJSA-N 489.341 0.633 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1cc(=O)n2[nH]cnc2n1 1815330405 OGTYVMGWJKRGCM-KBUNVGBDSA-N 470.284 0.790 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815335748 NTOWAOMBOSKBAZ-WFASDCNBSA-N 488.375 0.962 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc3cn[nH]c3cn1)CC2)c1cccc(B(O)O)c1 1815356342 CWDJRXZXHUSJJM-CQSZACIVSA-N 462.300 0.634 50 20 JCGD CCN1CCC(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1 1815364172 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1832163035 VPCXWYJAVJYGLJ-XDTLVQLUSA-N 451.211 0.447 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4c(c3)CCC4)CCO2)C1 1832507331 USGGCDJTKXBDLQ-AREMUKBSSA-N 493.564 0.487 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccccn1)CCO2)NC(=O)NCc1ccccc1 1833988566 WKRQXJCMBIPTGV-VWLOTQADSA-N 496.568 0.498 50 20 JCGD COc1cncc(CCC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834797545 XFRLALSNVAGLHU-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798473 ZQPQGUXLGFMVEG-UHFFFAOYSA-N 461.444 0.403 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799105 OFMGLEUTZQKOER-IBGZPJMESA-N 480.212 0.725 50 20 JCGD CCN(CC)C[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738290 SRAKFVAAAWAJSJ-SFHVURJKSA-N 487.649 0.848 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1835843212 MSCPIWXONGDGAY-QGZVFWFLSA-N 461.401 0.494 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1nc3ccccn3n1)CCO2 1836393328 UGFHLLLBLKNIER-SFHVURJKSA-N 452.309 0.584 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ncsc13)CCO2 1837076216 RPYDCDBKWZPWKB-QFIPXVFZSA-N 475.571 0.739 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CCOC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)ccc21 1837713313 VKPXYACZHOMSGP-QHCPKHFHSA-N 490.633 0.799 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1 1839583905 CQCCZEBEZPPUCO-BFUOFWGJSA-N 455.353 0.762 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1 1839625552 ZYLXKKFQIVRQRL-KZULUSFZSA-N 470.299 0.722 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)c2n1 1839626874 ZVFMLVISYFMWTR-VWLOTQADSA-N 492.341 0.015 50 20 JCGD CS(=O)(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839743429 QGPTYGKMGMITFU-ZXSWEOGUSA-N 483.493 0.373 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3C1)CCO2 1839990692 BISKQPKMOUDTTB-GJZUVCINSA-N 478.354 0.242 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1 1840033121 UYWOUPFVKWGJSX-FYINFDKHSA-N 466.376 0.941 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840039278 MYHCBOHERZXVRC-AERDPVEMSA-N 487.981 0.442 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1C 1840070413 QPXMBSAPVNMDOZ-VWLOTQADSA-N 497.552 0.315 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)ccc(O)c3F)C2)C1 1840185206 NNBDCCYUSFKYNY-NRFANRHFSA-N 470.473 0.113 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CC1=O 1841915790 LAXLJDQUYDSIFR-HXUWFJFHSA-N 475.354 0.853 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(F)cc1 1845005840 WSSDFEGTHOZMLT-FQEVSTJZSA-N 453.279 0.200 50 20 JCGD Cc1nc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)c(=O)[nH]c1C 1845038558 SJKZTJDPDPWBQY-UHFFFAOYSA-N 481.557 0.550 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=S)N[C@H](C)C1CC1)c(=O)n2Cc1ccccc1 727270379 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CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)C1 1784014188 XNYXEYVIVWPSKX-MJXNMMHHSA-N 494.358 0.879 50 20 JCGD Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(C(F)(F)F)c1 1787711422 PPNJZTHTXNLKKE-QOKNQOGYSA-N 479.264 0.631 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccc(Cl)cc4n3)[C@H]2C1 1788084672 QZDHUNZKWOGJGL-ZVZYQTTQSA-N 476.965 0.954 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)no1 1788668676 XJPRCTLEDIXVHQ-DSRCVFDASA-N 471.352 0.724 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csnn1 1793497285 BNTAFTYFZGUUKG-OPDFLTKYSA-N 459.956 0.873 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(CC(C)C)nn1C 1796016216 HBNOTEZTKGTUFT-AOSNRDAWSA-N 483.573 0.956 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(F)(F)C(=O)O 1796350690 AJGFTMVGEHTFCQ-DPIQGUFMSA-N 485.396 0.833 50 20 JCGD 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Cc1cc(C)c(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C)c1 1831166935 AAEQNQNOYZIPJZ-SANMLTNESA-N 496.369 0.441 50 20 JCGD O=C(Cc1ccc(Br)cn1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833107030 TWZXRKDMZLTXBB-CRAIPNDOSA-N 476.755 0.443 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc[n+]([O-])c3)CCO2)C1 1833270953 IXWQFERBAMRAAA-HTAPYJJXSA-N 498.964 0.522 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)ccn1 1833369421 XXXJWOWNHIZUEP-RUZDIDTESA-N 481.358 0.443 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc[nH]3)CCO2)C1 1834104872 RTIPGFKUNWBTRU-OAQYLSRUSA-N 473.442 0.627 50 20 JCGD N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccc(Cl)c1 1834731322 UDMWPMGIVFYXME-HSZRJFAPSA-N 498.820 0.905 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3coc(Cl)n3)CC2)CC1)c1ccc(B(O)O)cc1 1834797467 LPOGQVLYTCKEHS-UHFFFAOYSA-N 460.727 0.507 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4cncn4c3)CC2)CC1)c1cccc(B(O)O)c1 1834801316 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C[C@H](Nc1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837483705 XOOPHILDSFNDEL-QEORTHHSSA-N 460.304 0.424 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1837605660 FGCLIWVTQKVJLI-YCRPNKLZSA-N 467.954 0.316 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1 1838513467 TWVDARMALYGCGK-UGSOOPFHSA-N 455.924 0.410 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1838808959 LKVWDKWSVGQXOW-DEOSSOPVSA-N 484.362 0.090 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C)c1 1839023951 NHOGTNPAWKTUSR-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD Cn1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c2c1CCC2 1839200443 HTCKHSBNPHGHDH-YJBOKZPZSA-N 459.316 0.669 50 20 JCGD CC(=O)NCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1839886221 OMZRRERZHWDJMS-DENIHFKCSA-N 496.402 0.975 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1 1840033125 UYWOUPFVKWGJSX-XERREHJYSA-N 466.376 0.941 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182726 RDIAVRRFQVWLLY-FDDCHVKYSA-N 478.615 0.997 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)COCc3ccccc3)C2)C1 1840183931 ILKSSNYYCWNIJY-QHCPKHFHSA-N 462.547 0.033 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1 1840185463 QUFLBFFPCMMHIN-OAQYLSRUSA-N 481.481 0.177 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1841580215 LJTRWSQNYGRAAB-KBPBESRZSA-N 481.015 0.650 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H]1CCCS1(=O)=O)C2 1844693269 NTKJWPBMRQWZIY-QGZVFWFLSA-N 465.484 0.914 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1nc3ccccn3n1)C2)NC(=O)NCc1ccccc1 1845038777 RXDAUJXNLSSLTR-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD C[C@@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2 1846179974 ISJZUQYAYFIVFA-NEPJUHHUSA-N 461.357 0.742 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)OC(C)(C)C)c(=O)n2Cc1ccccc1 10099301 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CCc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nn1C 1780969006 RTRQVCCLIWFLDZ-RUZDIDTESA-N 497.600 0.772 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1[N+](=O)[O-] 1781303933 OQNJLVXWFRIFBE-QHCPKHFHSA-N 467.287 0.269 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1783103893 ZBHNERSKWWHEFB-NTKDMRAZSA-N 489.378 0.409 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@]34C[C@@H]3CCN4C(=O)OC(C)(C)C)C2)C1 1783558698 RXPWEAATLDSRNI-VWMXVWASSA-N 493.605 0.589 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCNC(=O)c3ccccc3)C2)C1 1785329469 NMYPOKCZNWNZAM-MJHSOURCSA-N 494.552 0.770 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786983604 OIJIDLPMGZWHFZ-DBXVSBKESA-N 452.316 0.427 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Nc3cnccn3)C[C@@H]21 1787508479 KHYIWSFRDIAHAY-LFQWILQFSA-N 482.545 0.391 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4[nH]ncc4c3)C[C@@H]21 1787508656 MZGUHKAIMIDLQY-UHFGEYHKSA-N 478.513 0.685 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nc(CO)[nH]c4c3)[C@H]2C1 1787874446 UBMYCDRMZQTTTC-XSWJXKHESA-N 450.923 0.902 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C3\C(=O)Nc4ccccc43)[C@H]2C1 1788533837 PDBZBAHOEYDDQM-KKHBGXIRSA-N 469.542 0.375 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCOC3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726689 MYWLRRQIKGBANO-WOZUAGRISA-N 473.574 0.349 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CNC(=O)OC(C)(C)C)[C@H]2C1 1792347038 ZHOPFWYMGBFXEM-BZSNNMDCSA-N 497.637 0.890 50 20 JCGD COC1(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CN(C(=O)OC(C)(C)C)C1 1792981218 GPTYENDCVVOXEQ-IVSAIRAKSA-N 475.970 0.202 50 20 JCGD COc1ccccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1793150386 JHYPHQDERNYPQO-FAQVEIGNSA-N 467.526 0.530 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc(Cl)c1)C2)c1ccc(B(O)O)cc1 1795732646 GTCFRGJNNYBFHV-VPTLXERWSA-N 458.707 0.302 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CS(=O)(=O)C2 1795929837 LQWLABPSYVXAHH-ZYYNGRNUSA-N 465.359 0.278 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nc[nH]c13)C2 1796440541 OZLXDCYMPGHBSQ-UTRJNVLQSA-N 463.498 0.900 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3[C@@H]1O)C2 1797748467 DXIQNMNOCNRSLH-VLGZMJLESA-N 479.537 0.184 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1800056560 HTHYRESRUBVDRF-REPLKXPHSA-N 475.351 0.160 50 20 JCGD CN1CCC[C@H]1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803940477 VEIXCWFHWYCOMM-LSTHTHJFSA-N 451.531 0.494 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363739 PLLXJHLZSUPHCM-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807376459 ZSDXIAYAKLUWMM-WGGBDISSSA-N 474.326 0.944 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccnn2)[C@H]1c1cccnc1 1808416520 AZHSBXJUABAUAR-PWCMAEROSA-N 463.502 0.513 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1810156848 IRTGEOANWZDWCM-JIHPZKSYSA-N 462.359 0.421 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C1(O)CCC1 1810294275 JBWMFROHFYRJKS-WRWLIDTKSA-N 466.542 0.951 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1C 1810302034 DXKJCQASLAHWPG-YWZLYKJASA-N 478.513 0.456 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810474887 FKLRUVQFIAXYJY-LKUPVBHCSA-N 462.319 0.009 50 20 JCGD O=C(CCN1CCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1814265320 OECPPBYVGAMYGC-NZQKXSOJSA-N 450.348 0.567 50 20 JCGD O=C(CNCP(=O)(O)O)Nc1nc2c(s1)C[C@@H](NC(=O)CCBr)CC2 1814763130 JLHJUANSQMEURI-QMMMGPOBSA-N 455.271 0.565 50 20 JCGD C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1 1814783815 UGAQXWXIPCXLDN-ZFWWWQNUSA-N 460.373 0.719 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343662 IDNUQMBQMVSOMA-HNNXBMFYSA-N 488.375 0.962 50 20 JCGD CC(=O)N[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(C)(C)C 1815350163 HBHHQLOUZRBDFM-QAPCUYQASA-N 472.376 0.600 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1 1816077202 AIPYJUDEKHFWFF-MRXNPFEDSA-N 477.485 0.522 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)c2ccco2)[nH]n1)c1cccc(B(O)O)c1 1817475588 UUBWLWVYQGNVKZ-KRWDZBQOSA-N 465.275 0.418 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)Cn2ccccc2=O)CC1 1827096371 BXFXITMNMXCWBG-OAQYLSRUSA-N 451.332 0.462 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829051756 BAFUSHZVVKPKIF-CDMIOBSGSA-N 497.955 0.566 50 20 JCGD CN1CCC(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CC1 1830005614 XRSCQVPMALIMPL-AEFFLSMTSA-N 450.349 0.865 50 20 JCGD O=C(CCOc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830254892 ZFNOCYSFRBLHEE-XMMPIXPASA-N 486.305 0.045 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1 1830534499 AORANWNPDSMWLE-LIRRHRJNSA-N 462.385 0.636 50 20 JCGD COC[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831620776 LKWVEDFVAOZGMC-VWKPWSFCSA-N 477.986 0.857 50 20 JCGD O=C(Cc1ccc(F)cc1Cl)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832274902 PKCRFRCUGVTIFK-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD C=CCSCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1832453277 SKNVABKJCMLIGN-UYSKRRQASA-N 463.560 0.496 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c2ccccc21 1833310108 ITQSBPDXMUROPW-HXUWFJFHSA-N 477.993 0.511 50 20 JCGD O=C(c1cnc(OCF)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1833573247 ZHAVKLMKRQAZIY-CJNGLKHVSA-N 465.251 0.543 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1833766754 VGABJWKDORQZAI-KUHUBIRLSA-N 462.378 0.392 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(Cl)cc3)CCO2)C1 1835059212 LDFBHUSYSJKSDJ-QHCPKHFHSA-N 487.944 0.651 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnn4c3CCC4)CC2)CC1 1835738116 FEKRYBGSQNWEHA-UHFFFAOYSA-N 480.573 0.327 50 20 JCGD O=C(c1ccc2occc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930178 AKJYYYHFDYMPOA-XMMPIXPASA-N 464.283 0.496 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835938298 RRKQKJVQOBAWER-JYFCICGUSA-N 468.315 0.441 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C\C(=O)NC3CC3)CCO2)C1 1837253855 PDPZDSMIWFZEAU-RVBASHTNSA-N 458.353 0.451 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccsc3)C2)C1 1837457931 XBOKUHJOEJMAEJ-QFIPXVFZSA-N 473.555 0.449 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1 1837658937 HFSKUMQHNRIMBM-LEWJYISDSA-N 489.400 0.980 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1837711834 SEHISRJIRFQXLW-HXUWFJFHSA-N 463.567 0.356 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(-c3ccccc3)no1)CCO2 1837996784 WBDIOOHKLIBADC-VWLOTQADSA-N 491.309 0.405 50 20 JCGD Cn1ncnc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839743299 IMKQPSIBBUUGSQ-XXFFJTNUSA-N 472.452 0.770 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)=O)[nH]n3)C2)C1 1839963270 GHGMTPUDVFVWSS-FZKQIMNGSA-N 457.325 0.856 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)[C@H]3SC(=N)NC3=O)C2)C1 1839964649 YBKNFWNHBRHCIE-JWXAPSBJSA-N 491.408 0.419 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840032636 FYYPTEZXUVVAOQ-DJJJIMSYSA-N 466.336 0.891 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1 1840034105 AGPBQZBJJPBLNS-GTNSWQLSSA-N 470.349 0.940 50 20 JCGD CC(C)c1csc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)n1 1840183547 LQGGYUWRXWCSLW-OAQYLSRUSA-N 467.592 0.710 50 20 JCGD Cc1ccccc1NCC(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183798 AXPRPUOBSAXGOE-HSZRJFAPSA-N 461.563 0.236 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840189715 IGQNVHCRLODSQK-KRWDZBQOSA-N 463.274 0.017 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1cccs1 1840378212 LHCAYUBBZWROAM-IIBYNOLFSA-N 452.577 0.681 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)COc1ccc(O)nn1)C2)NC(=O)NCc1ccccc1 1845039354 HLHZABHHTVLKSR-UHFFFAOYSA-N 483.529 0.111 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(CC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)=NO2)C1 1847562344 BZYHBGPFOACNER-OSAWLIQMSA-N 470.954 0.944 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CNC(=O)c1cccs1 1848220416 YVNUIFHQIBTVJK-LISPERENSA-N 456.528 0.814 50 20 JCGD O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1)C(=O)NC1CC1 9890016 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WOBHCUAMORGBJP-MRXNPFEDSA-N 465.532 0.699 50 20 JCGD CC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 915907485 RHTHNSBZIOJKCJ-UHFFFAOYSA-N 469.527 0.901 50 20 JCGD COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 916034348 DUAWWYIRGLKHAZ-FQEVSTJZSA-N 493.538 0.571 50 20 JCGD CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CC1 916133389 KTGYUQQJCNSUAB-UHFFFAOYSA-N 480.996 0.590 50 20 JCGD CC(=NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 916350363 ZLOMOJDGWHTPRM-UHFFFAOYSA-N 455.500 0.837 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 916560273 FOXBITOXUMNKQD-UHFFFAOYSA-N 486.554 0.426 50 20 JCGD CCN1C(=O)c2ccc(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)cc2S1(=O)=O 917518966 DUCVNGHYBHQFAS-UHFFFAOYSA-N 463.468 0.952 50 20 JCGD COc1ccc(C(=O)NCCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 918222518 WPUUASPMHMRTTJ-UHFFFAOYSA-N 489.554 0.854 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2c[nH]n3c2nc(=O)c2ccccc23)cc1OC 919465966 NBOKZTLQWLRJLZ-UHFFFAOYSA-N 465.422 0.811 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(N3CCNC3=O)c(C)c2)cc1 919689643 AZMNBFJBUJTQHM-UHFFFAOYSA-N 459.528 0.915 50 20 JCGD O=C(COC(=O)[C@@H](CO)NC(=O)c1cccc(Br)c1)NNC(=O)c1cccs1 920652308 BRDYVCGOKNYIIE-GFCCVEGCSA-N 470.301 0.606 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1778314405 UVBVTSZWCKSLCQ-DEOSSOPVSA-N 487.362 0.067 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2C1 1778368194 DWOAZZFOFDPXDF-QVKFZJNVSA-N 498.968 0.072 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc(C(F)(F)F)n3)CCO2)C1 1779029312 VRDMIABEAUXQDQ-OAQYLSRUSA-N 492.458 0.785 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Nc3ccccn3)C2)C1 1779328199 VINBKUUWPHHWIW-NKWWSUEVSA-N 467.530 0.846 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@H](O)CC1)C2 1779376164 YYKCSIHFEGVQFF-ZYFHCTRVSA-N 459.547 0.364 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2 1779554704 AQEUAPZLVJRSAZ-VVWQDTPRSA-N 452.379 0.888 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc(O)c4ccn(C)c34)C2)C1 1779977900 SPXYIXAJKFUVSR-SJUCLPJRSA-N 493.524 0.856 50 20 JCGD CC(=O)NCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1783187257 NYZFTVHTBOUQTH-OAQYLSRUSA-N 462.459 0.490 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@]3(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)C2)CC1 1783209590 IITOKCZMKPKKPY-XOBRGWDASA-N 473.954 0.902 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(=O)c2ccccc2o1 1783824162 OCRSOUOOJNPMNC-NVVBAYIOSA-N 476.294 0.380 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1)CCO2 1783884035 NPFKSGKZUDVXAV-MRUHUIDDSA-N 475.970 0.706 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C)CCO2 1783938062 RDFKJFFYELGWGE-QMHKHESXSA-N 495.577 0.115 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc4[nH]ccc4c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786982996 FMJHDXZKWOOLDI-BVSLBCMMSA-N 476.342 0.469 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)n(C(F)F)n1 1786984864 RWPFORMLMUULPJ-ZVZYQTTQSA-N 462.262 0.174 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(=O)c3cccs3)[C@H]2C1 1787511850 CHDHNTUNSAPEOO-TZTOCFSCSA-N 483.550 0.779 50 20 JCGD Cn1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc2ccccc21 1787790683 DOJVUGKWRJBXEC-LEDOBFOHSA-N 461.327 0.765 50 20 JCGD Cc1cc(C)n2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cnccc5C(=O)NN)C[C@@H]43)c2n1 1787907380 VCPRTQYCAMKJAO-YSSFQJQWSA-N 492.540 0.252 50 20 JCGD Cc1nc(F)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609901 BSHKEARROORXEZ-KKXDTOCCSA-N 456.478 0.435 50 20 JCGD CN1CCN(C2(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]4C3)CC2)CC1 1789871901 HKZFPUDXFGYHTG-OGNFBWPZSA-N 461.434 0.982 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)nc1 1789922866 WMZXZEBLVGLXFV-HQRZJTNHSA-N 478.340 0.769 50 20 JCGD CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1790255753 ZPKZSVPEMGYIKW-GQGQLFGLSA-N 494.397 0.905 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nn[nH]c4c3)[C@H]2C1 1790537850 HNUZOXCQERBEDZ-NRJQGIQSSA-N 478.513 0.685 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)[C@H]2C1 1791108578 WSJDXXIAZDPYCB-RFSXOUPVSA-N 489.997 0.590 50 20 JCGD Cc1ccn2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]4C3)cnc2c1 1791293764 IHHFXJIGDHFPDA-LNLFQRSKSA-N 456.547 0.609 50 20 JCGD COc1c(Cl)cccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1792022262 OYCYJULRXWJUPG-QSFXBCCZSA-N 472.734 0.936 50 20 JCGD CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794108990 XKVAZSMNCACCKJ-NFFDBFGFSA-N 452.939 0.847 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3[nH]ncc13)C2 1796440459 MQVXOPQPABRQMK-DPSMYSLWSA-N 463.498 0.900 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3scnc3c1)C2 1797751535 DOBIMSSMVGXBLL-HBCWATKFSA-N 466.523 0.812 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798522949 HHSNGZZWHOLJSE-IJDPYKPMSA-N 462.459 0.248 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(=O)Nc1ccc(F)cc1 1799034237 BVIGOQFYJRTMEP-GFENJXEQSA-N 484.488 0.056 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc2cccnc2cc1F 1799242804 PSCOVJCHQZWZDM-MRSFGVLCSA-N 471.533 0.879 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)NC(=O)NCc1ccccc1 1799865714 KCNRUWUJDOIFPH-XMTFNYHQSA-N 451.955 0.571 50 20 JCGD CN[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1)C(=O)O 1800436556 YCLGVCANINLFAJ-KMOPNRPKSA-N 482.375 0.645 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1Cl 1801012166 JWGOLOJMQLKTQZ-YVWYUNDQSA-N 452.939 0.925 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2 1801013120 WCMPVLSJHWRVLG-DBWKPXFBSA-N 473.490 0.047 50 20 JCGD Cc1cc(CC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1C 1803292317 NUVVSSIGTBWWKW-WZONZLPQSA-N 455.563 0.745 50 20 JCGD CC1CCN(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1803389170 VQCVHAHXGMFATR-XUZZJYLKSA-N 464.375 0.813 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1 1804195623 FYTDUCNJAMTUGY-GDBMZVCRSA-N 463.387 0.622 50 20 JCGD CN(C)c1ncc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1 1807365641 ZEWGRYYLSMPYNX-YLJYHZDGSA-N 463.303 0.449 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995501 ZLDFMSMIWNRKMM-IIBYNOLFSA-N 462.271 0.201 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807996646 XZBPGMOYIOYZML-VLIAUNLRSA-N 477.481 0.520 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc(O)n1 1808334529 XUVUZVWFISIUTB-PGRDOPGGSA-N 460.299 0.804 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1808722870 WFJKWKNUFQXXMT-YLJYHZDGSA-N 456.551 0.947 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cn2ncccc2n1 1809355496 HUZVJOMHCCULRT-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc(-n2cccn2)nc1 1810994342 LURPTWDHXOFSAI-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813070088 GCFHRKUJWMUVQS-PGRDOPGGSA-N 471.562 0.617 50 20 JCGD COc1nccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1F 1815354693 QCWNXKUEAWMSSJ-ZDUSSCGKSA-N 470.291 0.905 50 20 JCGD COc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n(C)n1 1816136714 YVQWSPJHAJWTPX-HNNXBMFYSA-N 467.490 0.770 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)C1 1817474184 PDYRQVGWYHMIAU-FRQCXROJSA-N 468.319 0.985 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819452329 KBGXDJPDBNVANF-MYHAECLISA-N 469.307 0.924 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)NC(=O)c3cnccn3)sc2C1 1820027335 ZDRZYUGZSALOJL-TUAOUCFPSA-N 466.951 0.917 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1 1821096542 BOYPGENABRLENF-YBGGJHSQSA-N 468.499 0.999 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(-n4ccnc4)ccn3)sc2C1)c1ccc(B(O)O)cc1 1821686882 JXHADUGBLKHRAP-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCNC(=O)c2ccc[nH]2)[nH]n1 1822410181 BCCGKELXFWQFCF-KRWDZBQOSA-N 472.550 0.923 50 20 JCGD CN(CC(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=N)N)CC1)NC(=O)NCc1ccccc1 1826827324 ACVDOJCSSVPSED-HXUWFJFHSA-N 486.621 0.435 50 20 JCGD CCCNC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827049472 TYKMTYORLTTXGZ-OAQYLSRUSA-N 457.380 0.906 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828873091 WVINNYDTCFLUNF-UZLBHIALSA-N 458.368 0.307 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829056575 NFUFQXDBTKHZSM-VDNWNZSNSA-N 482.940 0.696 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COCCO)CCN2C(=O)OCc2ccccc2)C1 1829231150 ATFLFSNYRNLUAK-XXBNENTESA-N 497.976 0.701 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C#CC(=O)O)CCN2C(=O)OCc2ccccc2)C1 1829334309 HPNQPZQITAYJHU-JPYJTQIMSA-N 491.928 0.780 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830533701 SAOLQJKBDKQVCX-NEPGBVGISA-N 458.353 0.332 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1 1830543261 OGSNIYVCQAXBRD-JLTOFOAXSA-N 468.348 0.887 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1830545220 IIMXHSPQQUWZRS-YVEFUNNKSA-N 494.433 0.334 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1F 1831314462 VNERIEFYKJBRRF-RUZDIDTESA-N 484.333 0.517 50 20 JCGD Cc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c(=O)[nH]c1C 1831872109 ONMVPGHQCMZOLH-GOSISDBHSA-N 460.579 0.993 50 20 JCGD Cc1nnc(CCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1833832534 RKLYVOHBTBTNLY-UHFFFAOYSA-N 485.419 0.344 50 20 JCGD CC(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)no1 1834496696 CLSXQLWUAABUCI-QFIPXVFZSA-N 472.502 0.180 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnn4c3CCC4)CC2)CC1)c1ccc(B(O)O)cc1 1834799071 NCKCELCFSBCCIP-UHFFFAOYSA-N 465.363 0.008 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccc3)CCO2)C1 1834839400 WGUQVNNPDLZJEW-DEOSSOPVSA-N 467.526 0.388 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835449738 QYDNOAWUPJCYKQ-LPHOPBHVSA-N 462.385 0.339 50 20 JCGD Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)[nH]1 1835737182 SQIYMMCQKIEBHR-UHFFFAOYSA-N 454.535 0.216 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1 1835837999 VUPLVKKUPOAQOR-OAQYLSRUSA-N 492.697 0.880 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4cccc(Cl)c34)C2)C1 1835930597 OQPDNETYRVUNFX-XMMPIXPASA-N 497.744 0.885 50 20 JCGD O=C(c1cncc(C(F)(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931350 NMIXTFMAEPRYHX-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD COc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ccc(F)c1F 1835939679 XQXYKUGXDIUOLB-HSZRJFAPSA-N 490.268 0.037 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3ccnn3)CCO2)C1 1836212474 MFNZQGZGOQMTPC-IXNCKXOBSA-N 472.452 0.620 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1836258156 UUQSHIMLLHAFSZ-ROUUACIJSA-N 495.385 0.144 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3c(F)cccc13)CCO2 1837057457 JPKJQLRBLNGXNX-HSZRJFAPSA-N 497.487 0.084 50 20 JCGD Cc1ccc(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1837199396 BQDQVKTVASHPQT-UHFFFAOYSA-N 465.359 0.925 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)nc1C 1837456814 NKVVHHBQKDQYMV-QHCPKHFHSA-N 468.514 0.081 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457006 VRELZPSUILLLHP-OXQOHEQNSA-N 453.927 0.163 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837635923 LFTLXBIRNNWWPC-XYXUZSOXSA-N 479.606 0.760 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3Cl)CCO2)C1 1837777388 VLSADBBYWNPYCO-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD CN1CCC[C@H](C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1 1837920208 RCMWENVCZJPBMI-IBGZPJMESA-N 457.380 0.320 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1837921036 UHKYHDYVDZLELM-GOSISDBHSA-N 468.363 0.745 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C)nc1O)CCO2 1838670564 NPYIRJPFOSSGLF-LRULAXNGSA-N 484.513 0.300 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nn(C)c(C)c3Br)CCO2)C1 1838770386 CEBFKRFCZWMSLV-ACJLOTCBSA-N 493.786 0.815 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1C 1838988810 PQTVXSGGVBBWMN-QHCPKHFHSA-N 462.547 0.447 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839044367 BUMDPZBWGQAQTD-SFHVURJKSA-N 477.370 0.152 50 20 JCGD O=C(c1cnc(OCF)cn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839197713 GLKBXAJOKBELKE-CJNGLKHVSA-N 465.251 0.543 50 20 JCGD O=C(c1cc2n(n1)CCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200484 IHLFJPWDMRSIJE-QAPCUYQASA-N 459.316 0.980 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(N)=O)C2)C1 1839744179 SRGXXZQRIOMQSL-NAVGAYGYSA-N 462.453 0.594 50 20 JCGD O=C(Cn1nccn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802481 XXKQKANIRPWHNM-WIYYLYMNSA-N 492.374 0.741 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1839964870 HFABWIZXAKFWFZ-KDOFPFPSSA-N 462.341 0.459 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)nc3C(F)(F)F)C2)C1 1840153272 JICHTPIIJWLFSG-SUMWQHHRSA-N 468.860 0.763 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3Cl)C2)C1 1840183671 STVNPDIAQCFOKL-QFIPXVFZSA-N 466.966 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(Cl)c3)C2)C1 1840187306 RTSBLUZBPRQLHA-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD C[C@@H](Cc1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840471236 SCYWPTRLKCFCOL-QMHKHESXSA-N 471.514 0.227 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840806261 OYOZNZCIXBZQHZ-HXOBKFHXSA-N 499.609 0.119 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C[C@H]1COc3ccccc3O1)C2 1844263528 NQNJVNGVVAAFQL-HNNXBMFYSA-N 451.483 0.732 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1844284819 SMNSGPRDDWUSKT-JKSUJKDBSA-N 489.953 0.817 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(S)nc3c2)c1 16594229 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CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnc(Cl)n2)C1 1779681829 MIDFCCHOCLSJGZ-FOIQADDNSA-N 452.943 0.631 50 20 JCGD Cc1nn[nH]c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559650 ZCLCRVNCVJHGTE-NTKDMRAZSA-N 498.588 0.587 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1781490456 ICXIIZJHDLYBRU-RGZWJVDOSA-N 488.589 0.087 50 20 JCGD COc1cc(C)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1OC 1781896366 XCOKTBYRSZXPII-XMMPIXPASA-N 483.525 0.768 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1 1781997914 NUXFJKHLETWSMG-NALNUFGESA-N 477.352 0.779 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783022741 NRNNKEPKHYANPS-TWFHAPMSSA-N 466.376 0.545 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1783535649 BBXLYDFQWOELFV-XIKOKIGWSA-N 450.293 0.316 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@](C)(O)CN3C(=O)OC(C)(C)C)C2)C1 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O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1nccc2nc[nH]c12 1808133008 ZXOCMUUCRRFODO-VGOFRKELSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccn2c(O)nnc12 1808190516 SJYCTJQSQVZNGW-FXAWDEMLSA-N 486.297 0.143 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809980037 FJMFPCQQHUMNCI-JWGURIENSA-N 479.342 0.981 50 20 JCGD CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810293329 CQZAAVMGNJNXFU-UTKZUKDTSA-N 467.530 0.268 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810309097 OZOGJCAGXVNJLL-UZLBHIALSA-N 475.509 0.621 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1 1813176275 WPCCLIIVKDTHKY-RQHOZGTDSA-N 491.508 0.146 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1 1814321890 CFLFHPVDNLYQBL-MOSLJXCSSA-N 466.545 0.234 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1 1818110406 FKHWRTFYCFGOBC-CBFMJHRQSA-N 470.490 0.988 50 20 JCGD O=C1Cc2cc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3ccc(B(O)O)cc3)CC4)ccc2N1 1818923831 LZGWTYVQSFNEOC-INIZCTEOSA-N 476.323 0.857 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1 1819529032 DUVKZFCDMNVVGU-FOQNGQEVSA-N 469.527 0.202 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1ccnc1 1819792748 ADGAFUOMPNVPRU-VXGBXAGGSA-N 454.516 0.825 50 20 JCGD C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825640534 AXNYLLRPHVMIHG-BXKDBHETSA-N 452.139 0.832 50 20 JCGD COc1nn(C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050310 MFWBXEOOWXBAAY-FQEVSTJZSA-N 454.336 0.656 50 20 JCGD O=C(NCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccco1 1827054957 QCEPCMSBWHQVFD-HXUWFJFHSA-N 467.331 0.623 50 20 JCGD COc1cnc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1 1827055053 SOFPSVVOMQBWNR-HXUWFJFHSA-N 452.320 0.712 50 20 JCGD O=C([C@@H](O)CCl)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H]3C[C@@H](O)C3)C2)C1 1828550992 FQIVZVBRZAYKPN-QPXQOZNCSA-N 479.961 0.809 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc3nncn3c2)CC1 1828642566 NXPAVUBUNFXREL-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD C#CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCN2C(=O)OCc1ccccc1 1829134317 ZGUYDYUDOYIVPM-RUZDIDTESA-N 490.520 0.384 50 20 JCGD COC(=O)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829381216 DOFUTDMHZOWRFM-JTSKRJEESA-N 496.948 0.394 50 20 JCGD COC(=O)C12CC(C(=O)N3CCOC[C@]4(CN(C(=O)[C@@H](C)CBr)CCO4)C3)(C1)C2 1830544444 YRNVXYMTURZFPY-XHNVJUCFSA-N 473.364 0.817 50 20 JCGD O=C(c1nn(-c2ccccc2)c2c1COC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830723875 SMKHDKQKJMIRSU-XXBNENTESA-N 490.944 0.572 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1830730453 ALQMMRIBAVJLPH-WIYYLYMNSA-N 453.923 0.244 50 20 JCGD 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CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)C1 1839109246 YRXZHHIFHRWRMJ-XGKMFUNXSA-N 479.933 0.205 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/O[C@@H]3CCCCO3)C2)C1 1840033291 ABBOJINJIDHCCF-FZTBZWDOSA-N 462.341 0.755 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)C1 1840151174 XAZBGSBKLGUTPX-PGRDOPGGSA-N 482.965 0.242 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185081 IDJQKYGALIZRDY-FDDCHVKYSA-N 461.563 0.090 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CS[C@H]3CCCCO3)C2)C1 1840185310 JXFFVFIKSPHMQW-SFTDATJTSA-N 472.608 0.076 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)n2)C1)NC(=O)NCc1ccccc1 1843358373 KLDCYSYZOZIWRO-UHFFFAOYSA-N 469.502 0.051 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1843953586 HKYUOBIOAXUBBR-HSZRJFAPSA-N 475.326 0.533 50 20 JCGD CCCC[C@@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 14044446 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)Cn3cccn3)CCO2)C1 1780097074 OSGHMPIQOAYAGK-OAQYLSRUSA-N 457.443 0.860 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969673 PBWHDFSEZZHHOV-NLFFAJNJSA-N 497.600 0.695 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(O)n1)CCO2)NC(=O)NCc1ccccc1 1780970292 UFAIMPHYQXNRIC-XMMPIXPASA-N 482.541 0.577 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)[C@@H](O)C1 1781113001 XWLJSNPOKRTRIZ-AVYPCKFXSA-N 490.395 0.829 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@H]1NC(=O)NC1=O)C2 1781901525 PDVDGEFNAVSIQP-JJFYZRJRSA-N 459.341 0.272 50 20 JCGD N#Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(Cl)c1 1781967618 NXUROTZHRNMZJW-QFIPXVFZSA-N 453.691 0.649 50 20 JCGD COc1ccc(-c2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)n[nH]2)cc1 1783934331 DJZTVOQRPAXYTQ-XMMPIXPASA-N 484.557 0.902 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nnc(Br)n4c3)C[C@@H]21)[C@H](O)CCl 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AFTXEEGJVPBKOE-CSFFLVESSA-N 455.914 0.846 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCCOCCOCCOC)C2 1799270812 ZHQTUZAECZLUJB-ZMMAXQRCSA-N 450.960 0.290 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-c2ccc(O)nn2)cc1 1799841944 CKBSQGJJJIAAJC-FEJSZKPUSA-N 482.541 0.425 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1[C@H]3CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C3)C2 1801421420 NUSDHJCGZNGSJS-FFGOWVMKSA-N 494.357 0.254 50 20 JCGD COc1cc(F)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801647599 IMMFXUUPSWVVIP-DBWKPXFBSA-N 457.462 0.350 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803136646 DIQSHMICVMQHCY-MKCNHSFFSA-N 488.972 0.867 50 20 JCGD Cc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803821917 FYPJEFTYXAUFCK-OXJNMPFZSA-N 462.514 0.755 50 20 JCGD CCc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n(C)n1 1807363320 ZHURWUYZFOMJHJ-GCJKJVERSA-N 461.331 0.691 50 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CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CNC(=O)OC(C)(C)C)[C@H]1c1cccnc1 1812811949 JXIVCAHORXSYFQ-LAUBAEHRSA-N 476.578 0.985 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813073614 NADMXYDXBZRMSQ-MDYRTPRTSA-N 461.567 0.168 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](O)c3ccccc3)sc2C1)c1ccc(B(O)O)cc1 1814369813 HBKVBLVICWZGRE-APWZRJJASA-N 451.313 0.782 50 20 JCGD CC(C)n1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1C(=O)O 1815337983 YPUQUPNIJPXGPY-CQSZACIVSA-N 497.342 0.838 50 20 JCGD COCCn1nccc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826086206 MKNJXAXPYUCZAX-ZDUSSCGKSA-N 463.564 0.585 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C=C\C(=O)NC2CC2)CC1 1828924545 YMLJKOWVTBPKDG-HCZHMGAMSA-N 468.558 0.753 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1 1828990350 NSUNMESRGUIIMX-RADWXHQJSA-N 497.955 0.566 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(Cl)c1 1830726598 RMAQOYJZXRUYIK-XLIONFOSSA-N 461.342 0.947 50 20 JCGD O=C(c1cc(C(F)(F)F)ccn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732808 WAHDXJAHJSFGDC-PBHICJAKSA-N 451.829 0.770 50 20 JCGD CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830733083 DWJZHWCPPDXBGY-FSTVOOFJSA-N 492.013 0.982 50 20 JCGD CNC(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1831279243 GTFLBECIKCMQDP-AGBQBWRISA-N 462.453 0.464 50 20 JCGD CN1CCC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1832057265 RZAMRNJMUZZVKU-HOIFWPIMSA-N 489.013 0.669 50 20 JCGD O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832250986 CBAQBNJSYJYEMR-LBPRGKRZSA-N 455.188 0.602 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1 1833263031 GSKYGSAIHZWQKG-RDTXWAMCSA-N 475.428 0.740 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccnn3)CC2)CC1 1833727060 YJRCQGWTNBRDKQ-SFHVURJKSA-N 498.028 0.982 50 20 JCGD Cc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1833864251 SSPSYHBISQTGNN-UHFFFAOYSA-N 464.375 0.498 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2 1834825244 URRRZBNJZIZALG-SFHVURJKSA-N 457.325 0.356 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737832 FWSOBOSGMCXSKL-HXUWFJFHSA-N 472.590 0.443 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)/C=N/O[C@H]3CCCCO3)CC2)CC1 1835768910 OQHFJFIKEOJBHO-HHEUTOACSA-N 480.610 0.460 50 20 JCGD Cc1ccc2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)ccc2c1 1835928349 LWWATTVLXJIIPH-AREMUKBSSA-N 489.337 0.607 50 20 JCGD CC(C)(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)[nH]n1 1835937560 SJEYKMYWQSDQFX-UHFFFAOYSA-N 481.406 0.886 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837949370 OWZYHDSSRWMWNS-KDOFPFPSSA-N 471.308 0.418 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1 1839137107 XAFXBQBDOZINGP-IIBYNOLFSA-N 485.921 0.856 50 20 JCGD O=C(COc1ccc(O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198483 FMPIIYRWGHLFBI-WMZOPIPTSA-N 461.284 0.918 50 20 JCGD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200540 JWDXHWCDLGCNAT-FXAWDEMLSA-N 497.321 0.926 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1 1839578429 BUEIPMIKAZVBIS-VLIAUNLRSA-N 484.962 0.450 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839744242 WGGDDDFYZRNRDS-WMWQNKLISA-N 476.480 0.853 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)N3CCN(C)CC3)C2)C1 1839966183 WUPSKJUDUNBJPW-UWVAXJGDSA-N 475.428 0.252 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1 1840154460 XECWLAHDGFDIET-UGSOOPFHSA-N 455.924 0.410 50 20 JCGD Cc1ccc(COCC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1C 1840183795 AQEDXIYJGPNAKS-VWLOTQADSA-N 490.601 0.649 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185049 KHZJHBVJYBOUGH-VGOFRKELSA-N 479.603 0.392 50 20 JCGD COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1F 1840794769 VCUYOEGNUWRNRF-JOCHJYFZSA-N 466.510 0.277 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840798232 HEVTTZPOJUUDMZ-MDOVXXIYSA-N 496.026 0.299 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2csc(N)n2)C1)NC(=O)NCc1ccccc1 1842965035 YGHAHDIUXKZOLK-UHFFFAOYSA-N 457.560 0.889 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2ccc(O)nc2)C1)NC(=O)NCc1ccccc1 1844766304 VWFCEUJKNDKBBJ-UHFFFAOYSA-N 452.515 0.950 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCN(C)C3)C1 1845726657 OBLOWTJFJGAYDA-PCLIKHOPSA-N 466.546 0.670 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)c2ccccc2c1=O 17397947 QYYKGXFQKDPNJZ-UHFFFAOYSA-N 484.538 0.845 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1 725740675 GIMWPGIVXOEYHE-HIFRSBDPSA-N 450.517 0.607 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNc1ccccc1[N+](=O)[O-] 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XSZKYFFGULRPSU-UHFFFAOYSA-N 451.530 0.575 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1)C(=O)N1CCCC1 748246582 CSORNVWVLNUWOK-CYBMUJFWSA-N 487.376 0.620 50 20 JCGD COCCCOc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cn1 750715841 FPDSOWYLCHBHGX-UHFFFAOYSA-N 450.517 0.887 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccccc2)n1 758158496 IKKGZFCKBIAZKI-MRXNPFEDSA-N 480.568 0.928 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)cc1C 761689744 WUUXZHATCIDJPU-UHFFFAOYSA-N 463.516 0.063 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)c2ccccc2c1=O 790060229 HLHVERNUHJHWGD-UHFFFAOYSA-N 477.524 0.091 50 20 JCGD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2ccccc2)c1 793916187 XUORDEIBANEHJH-UHFFFAOYSA-N 469.903 0.883 50 20 JCGD CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 807135131 KZEFLUHMKMIGLK-UHFFFAOYSA-N 472.531 0.634 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2cccs2)c1 845944449 RHFXEUHNQRNIBN-UHFFFAOYSA-N 453.498 0.624 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccccc2F)cc1 913455177 PAZQNOWJZHKJEI-UHFFFAOYSA-N 453.448 0.507 50 20 JCGD CC(C)(C)N1C[C@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1=O 914710874 JBBRACIUWDOQRJ-QGZVFWFLSA-N 480.587 0.435 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)nc1 916253158 UWIWQZGWTXKCRU-UHFFFAOYSA-N 462.598 0.647 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccnc(-n4cccn4)c3)nc2)CC1 916394361 PVMCYTGVKHPUAV-UHFFFAOYSA-N 471.547 0.425 50 20 JCGD O=C(NC[C@@H]1Cc2ccccc2O1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916515930 COLWZVINTLEHCA-KRWDZBQOSA-N 460.512 0.655 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCO3)cc1C 916562683 SCQQWEFGRDZABT-UHFFFAOYSA-N 490.538 0.919 50 20 JCGD CNC(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 916603349 MAFWQYTXDGQMGY-UHFFFAOYSA-N 459.528 0.975 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC3(F)F)C2)C1)NC(=O)NCc1ccccc1 1778151255 QTYZRMCRVCTVFY-DYESRHJHSA-N 465.501 0.818 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)nn1C(F)F 1779032495 LQZRXYNNZRAXNR-FQEVSTJZSA-N 463.445 0.342 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(Cl)ncn1 1779897393 FSDPRKIWQDGDEH-DYESRHJHSA-N 458.711 0.251 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[n+]([O-])cc2)C1 1779943044 LINIPMJASTXNQS-LVGVVDSRSA-N 468.514 0.582 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780939329 PJJBOJRRYZAQPJ-HSZRJFAPSA-N 482.733 0.582 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1781233196 QXMIGKNRNZXIQN-ROUUACIJSA-N 461.302 0.823 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc[nH]n3)C2)C1)NC(=O)NCc1ccccc1 1782794900 JZKQROYQOXSDFV-HSZRJFAPSA-N 469.546 0.128 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n1 1783533683 FGVQGBWTHZNZKN-IFXJQAMLSA-N 455.353 0.900 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21 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496.336 0.976 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N3CC[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)c21 1807362599 VZEYHJSJRDENEY-PGRDOPGGSA-N 499.336 0.987 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807367983 PFRKCNIFGVEFFO-BSIFCXSSSA-N 496.373 0.994 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1 1808414887 OEBHUQBNGBJDTH-RKRZQOSRSA-N 491.508 0.934 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1808762384 YKHIPGUFEZSAEZ-QSFXBCCZSA-N 465.514 0.021 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CNC(=O)c2ccco2)[C@@H]1c1cccnc1 1810302157 HGOHXCJNCNDWOK-IIBYNOLFSA-N 491.508 0.423 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)[C@H]1c1cccnc1 1813073041 LCALXNZMGFVDIH-VDGAXYAQSA-N 492.577 0.304 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1 1813574013 DSQNVSGGRUQCIH-MFWRVWTKSA-N 488.570 0.656 50 20 JCGD CCn1nc(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815340396 MQDWEFJHBWJGNI-OAHLLOKOSA-N 453.333 0.887 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1 1815672064 BFAVWFHLZSJPJP-IUODEOHRSA-N 480.360 0.823 50 20 JCGD Cc1cc2nnc(C(=O)N3CCCC[C@H]3c3cc(NC(=O)c4cccc(B(O)O)c4)n[nH]3)c(C)n2n1 1817476134 HFLWUKFHJOSJNA-SFHVURJKSA-N 488.317 0.764 50 20 JCGD COCCn1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)n1 1817610608 JTEUYXKFCLZECH-HNNXBMFYSA-N 469.332 0.205 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1820991986 TXMRGVWLKDKGJX-LJQANCHMSA-N 450.308 0.978 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@](C)(Cl)CCl)CC2)C(=O)C(=O)O 1824673184 BFLSDMKBKTUSTK-VPTHRUTESA-N 451.332 0.834 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525557 SFMWMTGDYIFXET-IERDGZPVSA-N 453.923 0.767 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923606 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C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1833263369 KGTIHTQLXKCTSI-CYBMUJFWSA-N 494.394 0.634 50 20 JCGD Cc1cc(Br)cnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1834550563 KFPYZYQSOZVWQU-KDOFPFPSSA-N 476.755 0.822 50 20 JCGD CC(=O)O[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(C)C 1835650631 SQLYDURZSVMXPV-OAQYLSRUSA-N 488.589 0.458 50 20 JCGD C[C@@H]1CCc2c(C(=O)N3CCC(N4CCC(NC(=O)c5cnccc5C(=O)NN)CC4)CC3)n[nH]c21 1835738107 SYFBECDHUHRCTA-OAHLLOKOSA-N 494.600 0.957 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)n[nH]3)CCO2)C1 1835855795 AZLHSRJVACQPLP-NRFANRHFSA-N 489.441 0.333 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4[nH]ccc4s3)C2)C1 1835930787 ZPTGFFUBYZRKBC-QFIPXVFZSA-N 469.328 0.293 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3C(F)(F)F)C2)C1 1835938175 OPINFBHSQIGNOP-NRFANRHFSA-N 493.247 0.164 50 20 JCGD Cc1ccc(F)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1835939034 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1838832036 CVSNVVPNIDGANJ-ACJLOTCBSA-N 457.325 0.729 50 20 JCGD O=C(c1cc(Br)ccc1O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838889981 VADDNGCDYNPHID-QAPCUYQASA-N 477.739 0.824 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839951357 RVZSMFVFCLNLEP-XDHUDOTRSA-N 483.525 0.223 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCS1)CCO2 1840576694 VHQPBWZCYKEQLO-WPWRZWQBSA-N 463.560 0.472 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCCNC(=O)OC(C)(C)C)CCO2 1840907366 VPSCNNXMEBEVMR-QHCPKHFHSA-N 499.609 0.121 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)c2ccccc2c1=O 21204173 ILRIFGDUGWYZEP-UHFFFAOYSA-N 482.522 0.648 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 27601556 BTEPTPSOZDVFAI-FQEVSTJZSA-N 490.538 0.375 50 20 JCGD Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cn1C 116495186 WWHAKOSPWMKWHJ-UHFFFAOYSA-N 494.537 0.716 50 20 JCGD CC[C@@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(S(N)(=O)=O)c1 729231787 YIAWBDCXJNRIEP-MRXNPFEDSA-N 454.530 0.833 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2CCC(C)CC2)c(C(=O)NNC(=O)C(=O)NC2CC2)c1 744463485 GXTYOMIVCXJXHD-UHFFFAOYSA-N 479.603 0.993 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)N[C@H](C)CCN(C)C)N(S(C)(=O)=O)CC2 744865058 AZGBRXCGUHIPHQ-PBHICJAKSA-N 485.607 0.623 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNC(=O)N2CCOCC2)c([N+](=O)[O-])c1 745996371 VEZBXXXERTWJEV-UHFFFAOYSA-N 459.481 0.077 50 20 JCGD Cc1ccc(S(=O)(=O)N2Cc3ccccc3C[C@H]2C(=O)NNC(=O)C(=O)N2CCCC2)cc1 748240137 AKNUNPPMWQCCEJ-FQEVSTJZSA-N 470.551 0.880 50 20 JCGD O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1csc(N2CCOCC2)n1 788876467 XNTWRYIRRLOJND-WHOFXGATSA-N 454.578 0.467 50 20 JCGD COc1cc2ncn(CCCC(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)c(=O)c2cc1OC 790240005 XJUHVSYZEPGFKD-AWEZNQCLSA-N 452.533 0.686 50 20 JCGD CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNc2nnc(C)c(O)n2)cc1 817282098 CLIFFMJVSPDFMW-CQSZACIVSA-N 456.550 0.828 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@@H](C)NC(=O)C(C)(C)C)N(S(C)(=O)=O)CC2 875695141 XZRYMNNVJNMPEU-CZUORRHYSA-N 498.602 0.651 50 20 JCGD O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 916233402 WRANCEDUHIEOKJ-UHFFFAOYSA-N 499.527 0.587 50 20 JCGD NC(=O)c1cn(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2ccccc12 917392302 XIKIHHMNMKIMGF-UHFFFAOYSA-N 485.522 0.222 50 20 JCGD CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc(C(C)C)nc21 918209217 MKVXSYJTOHLSGP-NSHDSACASA-N 451.505 0.226 50 20 JCGD COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)N[C@H]4CCS(=O)(=O)C4)cnc32)c(OC)c1 919886797 VDNFVMPUFXHANO-INIZCTEOSA-N 488.526 0.628 50 20 JCGD C[C@H](O)[C@H](NC(=O)c1cc(Cl)ccc1F)C(=O)OCC(=O)NNC(=O)c1ccccc1 920263163 JMXAUEZEYMTAKO-GTNSWQLSSA-N 451.838 0.963 50 20 JCGD Cc1sc2ncn(CCC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c(=O)c2c1C 928984394 WPZUSVBFBGXZJW-MRXNPFEDSA-N 486.506 0.996 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc2c1OCC2 1778449474 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NCZKDJGNFOXOFF-QVKFZJNVSA-N 456.503 0.580 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1)C(Cl)Cl 1813075365 CIJPYOOHGWHTBT-GDBMZVCRSA-N 463.387 0.622 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)C[C@H](N)c3cccnc3)sc2C1 1815178945 YPYVJOGWQFQTPY-CJNGLKHVSA-N 480.554 0.853 50 20 JCGD CC1CCN(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1 1815335706 LYAZDSGBSCMGEC-QGZVFWFLSA-N 456.377 0.781 50 20 JCGD COc1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815354779 CZWGXDSTFOIPEY-AWEZNQCLSA-N 452.301 0.766 50 20 JCGD C[Si](C)(C)OCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1 1819592157 YUMLUTGBVNJGIA-INIZCTEOSA-N 471.656 0.984 50 20 JCGD Cc1cc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)no1 1819800882 BZUVIHCBFYCKGZ-LLVKDONJSA-N 455.500 0.907 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1 1821735302 PHRYVSXRJJRLFM-JSGCOSHPSA-N 452.855 0.772 50 20 JCGD CN1N=C(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CCC1=O 1827050198 IHBQRFWVVTWBDU-FQEVSTJZSA-N 454.336 0.208 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1 1828967190 MLUQODLTNSGGLM-QKQINCMDSA-N 488.589 0.391 50 20 JCGD COc1nccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830536035 XAHIDTOLROCUJI-UGSOOPFHSA-N 457.325 0.586 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(N(C)C)o3)C2)C1 1830538168 XHOGJVNAULHLAD-FZKQIMNGSA-N 459.341 0.842 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](C)CBr)CCO4)c(C)n2n1 1830538874 SPYYCZPJGDITFK-ZUOKHONESA-N 495.378 0.842 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725541 JLWOWOWPQHCYNI-KBXCAEBGSA-N 465.856 0.699 50 20 JCGD CN(C)[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccc(Cl)cc1 1830735267 FQOCVSPPOBHBGP-LQWHRVPQSA-N 474.385 0.999 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830743750 SYCMYISCBXKQJF-STXHMFSFSA-N 463.959 0.203 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(O)n3)C2)C1 1832549034 CCBMJLYOCBBTBY-AOMKIAJQSA-N 498.964 0.989 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1833565449 LLXFUTRMKUTGCR-QAPCUYQASA-N 463.915 0.231 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3C(=O)CNC3=O)CC2)CC1 1833679162 PFLXGWWZLQGMBF-OAHLLOKOSA-N 472.384 0.283 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1 1834800166 VWSKNRRTPRFQKS-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834824871 OGMPGFXQCABQNM-DYVFJYSZSA-N 451.314 0.789 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)C)CCO2)C1 1834942657 LMYABMWCKOFRMX-NRFANRHFSA-N 464.475 0.152 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1 1835812865 MZAQAOVPEACITM-SFHVURJKSA-N 467.998 0.458 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cn4c(Cl)cccc4n3)C2)C1 1835928078 CYFKAMOGEWRUSK-HSZRJFAPSA-N 498.732 0.051 50 20 JCGD O=C(Cc1ccc(Cl)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934012 KDTNCPFXIWAZBV-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)ccc12 1836254449 YYEOFGHXTQPDSA-VGSWGCGISA-N 494.932 0.181 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836890873 DNSWIOAOBWLMKZ-YWZLYKJASA-N 461.563 0.704 50 20 JCGD Cc1cnc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1837443163 QRXQFOMZHNIGIH-UHFFFAOYSA-N 452.320 0.391 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461515 WYQTZLDBESOXNK-SSOJOUAXSA-N 492.536 0.696 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837638360 DAFHFZLNSJZOFG-BQYQJAHWSA-N 458.320 0.098 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1837715670 CVTBOXVIMOESFS-QHCPKHFHSA-N 476.650 0.691 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)cn2[nH]cnc(=O)c12 1838469040 YVZQNCKMXSLVNJ-OAQYLSRUSA-N 465.938 0.666 50 20 JCGD Cc1nnc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1 1839197587 BKZVDWVGTUYCAH-ZBFHGGJFSA-N 465.345 0.926 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839224779 OPANTHOPIPDBNM-ITSXBRTRSA-N 476.534 0.378 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839964319 NNTJHXMKWMEMRG-MELARPHDSA-N 498.378 0.750 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)Br)CCO2)C1 1840037395 ZDPJKXONMOGWTG-ZFCANOHDSA-N 473.364 0.982 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840045940 HNGVJRALHSVXEZ-VWKPWSFCSA-N 475.970 0.442 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)[S@](=O)c1ccccc1 1840186084 ZGRAZGRSDCCWHY-DMYXBQNASA-N 494.614 0.012 50 20 JCGD Cc1cc(Cl)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840697823 VVAUXEORXWOWTF-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD Cn1ncc(I)c1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841350915 FXURDKNSLKZZDG-SNVBAGLBSA-N 452.680 0.441 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)C1CC1 1841410563 KPHRHSZZVZXMSC-LJQANCHMSA-N 471.363 0.877 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(Br)nc2F)C1 1842141131 UUTZEICJTSJZCU-UHFFFAOYSA-N 462.084 0.794 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2n[nH]c3c2CCc2ncccc2-3)C1 1844663895 LJXDEHHFNVEHLU-UHFFFAOYSA-N 451.531 0.760 50 20 JCGD Cn1c(C[C@H]2CCS(=O)(=O)C2)nnc1SCC(=O)NNC(=O)c1cccc(Cl)c1 729992660 PDZIIPXEKWEQLB-LLVKDONJSA-N 457.965 0.999 50 20 JCGD CC(=O)N1CCN(C(=O)CCNC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)CC1 730819992 ADIYYXJQPSMJMC-CYBMUJFWSA-N 484.351 0.628 50 20 JCGD CC(C)(C)c1ccc(C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)N2CCOCC2)cc1 745988067 PPGHSMVSWPUYDO-QGZVFWFLSA-N 468.576 0.590 50 20 JCGD CCOC(=O)c1sc2[nH]c(CSCCC(=O)NNC(=O)C(=O)N3CCCC3)nc(=O)c2c1C 748246470 ANKYQDXZVYEKJE-UHFFFAOYSA-N 495.583 0.863 50 20 JCGD COc1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1S(=O)(=O)N(C)C 760944424 FBYFIPNTOSIIAK-UHFFFAOYSA-N 470.529 0.257 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)c2ccccc2c1=O 786273861 PAOAUZFVHBHYAL-QGZVFWFLSA-N 498.927 0.895 50 20 JCGD CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)CN1CCCC1=O 789856911 NEOTYYCUFGSKPF-INIZCTEOSA-N 475.365 0.522 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H]1CC1(Cl)Cl)c(=O)n2Cc1ccccc1 811968733 MCECMEZESOZYKH-ZDUSSCGKSA-N 479.324 0.769 50 20 JCGD COc1cc(C(=O)NNC(=O)COc2nsnc2N2CCOCC2)cc(OC)c1OC 914686495 ZHLFREUKLGXJJO-UHFFFAOYSA-N 453.477 0.241 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)cc1OC 914935589 NYSDNHDJNMWLOC-UHFFFAOYSA-N 485.497 0.833 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3nncn3-c3ccccc3)nc2)CC1 916580515 IBYDHACMIDEFMO-UHFFFAOYSA-N 471.547 0.425 50 20 JCGD O=C(CN1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 917132697 XDAOWDXWZFHQBP-UHFFFAOYSA-N 472.483 0.123 50 20 JCGD O=C(COc1ccccc1F)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O 918552356 QQDAMNZZDCBEGE-CQSZACIVSA-N 477.470 0.989 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)cc1 920297958 UZIGRZSDRDGSFV-LBPRGKRZSA-N 470.529 0.195 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2nccn2c1 1778700901 GUXGSVPELJEEQW-HYBUGGRVSA-N 462.315 0.455 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779036241 ZFWNSWMBJICELJ-QHCPKHFHSA-N 466.498 0.401 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3cncc13)C2 1779372192 ABSGJZUURHPLLE-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1 1779595095 GLSGZJYAVVYQQD-RUZDIDTESA-N 474.326 0.369 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1780891932 HCQPREWQJAGVRY-VWLOTQADSA-N 490.325 0.493 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1C 1781913369 CNYAPGLZSXTERS-QHCPKHFHSA-N 459.547 0.770 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1783771562 QMDWMSJLKOTURQ-UZUQRXQVSA-N 481.594 0.659 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(-n3cnnc3)cc1)CCO2 1783933813 HOTXSPGBYXQWQR-JOCHJYFZSA-N 455.519 0.084 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)CC1CN(C(=O)OC(C)(C)C)C1)CCO2 1783939350 DDDSRZJXZYFYNJ-QHCPKHFHSA-N 481.594 0.446 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@H]1CCc2ccccc2[C@@H]1O 1784148495 LQFVORJPXDNCFK-NHKCCNDQSA-N 478.354 0.256 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1)n1cnnn1 1784603889 SKBINMHCTOORRJ-FLQJBOFYSA-N 457.441 0.949 50 20 JCGD COc1ccc(C(=O)CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1786428420 JBLZDLJVKVICTF-APTRMMRNSA-N 494.353 0.631 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3CNc4ccccc4O3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979632 FXEDPFLSGRBCJR-UDSSINMLSA-N 479.342 0.223 50 20 JCGD CCOc1ccccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610259 SUXFUXVVWCTGJR-ZRCAFCQKSA-N 467.526 0.991 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611000 IBNIXRHXAOJPOJ-LNMJFAINSA-N 468.514 0.141 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788611479 ZWLCSZPNJCKUQL-YYWHXJBOSA-N 494.552 0.294 50 20 JCGD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)[C@H]1SC(=N)NC1=O 1788632405 CBIIJFKUOXHHNO-FZKQIMNGSA-N 480.355 0.917 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(C)c3C(F)(F)F)C[C@@H]21 1791291215 OWAAFYRCCHAFHO-IHRRRGAJSA-N 474.484 0.405 50 20 JCGD Cc1ccc(OCCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1792709488 SBXJMLBAZLPAHH-BBIADKPPSA-N 452.316 0.347 50 20 JCGD 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COc1ccc2[nH]cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)c2c1 1797405344 ISPJHAWMDIOLBJ-MFKICJERSA-N 463.299 0.373 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCCC1(F)F)C2 1797748699 VJSXARKCJNSUTH-RMHZUWNSSA-N 451.474 0.714 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(C(F)(F)F)n1 1798085961 BVVGEQUMFUKTAU-IVWMJMPLSA-N 457.453 0.677 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(c1)NC(=O)CO3)C2 1798440354 JHKYZDGLCHIRIL-QDMKHBRRSA-N 464.482 0.582 50 20 JCGD COC[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095472 ZPVJUFOCGUSTDT-RDPOXOKHSA-N 461.563 0.205 50 20 JCGD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(-n2nccn2)c1 1799345372 AYSLZHFACPISMI-ACDBMABISA-N 459.315 0.821 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1800640069 UGBWOMSGSRUQGE-QPPBUOOMSA-N 475.365 0.215 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)C2 1800644081 HUIUCGNWNZZALZ-IMPMIVQMSA-N 470.368 0.220 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2 1800759634 YWFFCIFLCSIUMO-ZUMXRPEOSA-N 465.348 0.713 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3ccc([N+](=O)[O-])cc31)C2 1801010769 VJCAROGUMYFKSF-GPVSGQMNSA-N 486.529 0.512 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C/N=C/c2ccco2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361783 UEWPCKXGIFYIHR-JZUGSGHOSA-N 460.299 0.793 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCc2cncnc2)[C@@H]1c1cccnc1 1807502232 CUMDCBQQKKOLEK-GCJKJVERSA-N 474.525 0.823 50 20 JCGD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc1 1808895630 TWHPRJGZDMABLR-GCJKJVERSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@H]1CC(c2ccccc2)=NN1 1812305913 DYGKRKKFRNXCSX-GPUOULLFSA-N 497.364 0.847 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1813071097 NCZKDJGNFOXOFF-VFNWGFHPSA-N 456.503 0.580 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1 1813176273 WPCCLIIVKDTHKY-OAZQVZORSA-N 491.508 0.146 50 20 JCGD Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)s1 1815576452 LKVJNBCXLNNZOH-ZDUSSCGKSA-N 457.346 0.451 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CSc2nc[nH]n2)[nH]n1 1819404509 OJEAYCBWOVQBJJ-AWEZNQCLSA-N 470.519 0.625 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800946 DVMNOZFDLSKMRF-WBMJQRKESA-N 473.559 0.672 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2ccc(O)nn2)n[nH]1 1821638898 BWQGWYNNIWLRIE-INIZCTEOSA-N 458.523 0.903 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3CC(c4ccccc4)=NN3)sc2C1)c1cccc(B(O)O)c1 1824435250 ZFKHQPWUYKFSGQ-FXAWDEMLSA-N 489.366 0.815 50 20 JCGD Cc1nc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)no1 1825179612 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COc1cc(N2CCC(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)CC2)ncn1 1830957511 LCPARZUCSVBBCX-RXVVDRJESA-N 485.944 0.692 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)CC1 1831870964 JKZAATQSNQUBIH-KRWDZBQOSA-N 472.550 0.024 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)c2cccnc2)CC1 1831871604 VFSZSLLZQSPQIO-FQEVSTJZSA-N 472.590 0.804 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)no1 1831873588 PGLNRQNQHVLSTK-IBGZPJMESA-N 476.578 0.706 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OC)cn3)CCO2)C1 1834531937 JHDGDUXSQFZRBG-SCLBCKFNSA-N 457.325 0.729 50 20 JCGD Cc1cc(/C=C/C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)no1 1834801190 PQYXKRUUTACKJQ-AATRIKPKSA-N 466.347 0.561 50 20 JCGD CCCNC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836820949 JEPKBCVDUUWPBI-UHFFFAOYSA-N 473.379 0.285 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1839153482 ZLAKPIOWJGDBDK-VQTJNVASSA-N 488.372 0.323 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1839717940 SSEKFIOWEZOVRZ-FQEVSTJZSA-N 470.910 0.478 50 20 JCGD CC(=O)NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1839883155 RMGUNQTVKMNSMS-KKSFZXQISA-N 490.985 0.101 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1 1839999553 IZOPJVQPDZVZFR-GCJKJVERSA-N 452.935 0.874 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)nn3C(F)F)C2)C1 1840154326 SIDUKLPUAIYFQY-FZKQIMNGSA-N 450.870 0.910 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1840277533 AYWAJZNWJHHELA-UWJYYQICSA-N 454.907 0.072 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2 1840362292 MQTHARFFERZZEP-AUUYWEPGSA-N 455.353 0.756 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1840435665 JJMYWNNYBWPDFR-LJQANCHMSA-N 457.369 0.821 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1840857165 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VORLSUJGOSWZFW-CYBMUJFWSA-N 455.489 0.822 50 20 JCGD CC1(C)NC(=O)N(CCCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1=O 17515245 JZTYENNYMUQWDN-UHFFFAOYSA-N 465.532 0.343 50 20 JCGD C[C@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1=O 17633280 ARKLUFHIYNVIDV-XMMPIXPASA-N 488.508 0.870 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCCCN1C(=O)NC2(CCCCC2)C1=O 725872859 HYEXWAWYHCMVJI-UHFFFAOYSA-N 450.521 0.453 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(S(=O)(=O)N(C)C)c1 727608959 FMCYVXWPOMFKFA-CQSZACIVSA-N 497.599 0.892 50 20 JCGD CCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C(=O)O 727720837 YZKREALCSSARBP-UHFFFAOYSA-N 471.513 0.657 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCc3nc(O)c4cnn(C)c4n3)cc2)CC1 728214981 WNVZIIMCVGQOTR-UHFFFAOYSA-N 474.547 0.081 50 20 JCGD CC(C)NS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1F 728323174 VSZBHXYVYGEXJN-KRWDZBQOSA-N 495.485 0.657 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1 729275849 SESXBDTZJBBIIS-CYBMUJFWSA-N 460.578 0.339 50 20 JCGD CN(C)CCOc1ccccc1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 746977056 KAPQVJRUFRDJQD-UHFFFAOYSA-N 491.618 0.784 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 807118446 KDTXMEMUONYAJP-UHFFFAOYSA-N 475.263 0.479 50 20 JCGD NC(=O)[C@H]1CC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)=NN1c1ccc(F)cc1 913471153 GDEDHUYPPGAEFL-MRXNPFEDSA-N 451.418 0.598 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1c(C)n[nH]c1C)c(=O)n2Cc1ccccc1 915949909 VDGGQEFJCFIGKV-UHFFFAOYSA-N 478.513 0.545 50 20 JCGD O=C(COc1ccc(F)cc1)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916515901 AQTJRDAOQXGLEA-UHFFFAOYSA-N 480.522 0.082 50 20 JCGD CCCCS(=O)(=O)N1CCC(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1 917278540 ACCPEWUSUCSMRV-GOSISDBHSA-N 483.543 0.359 50 20 JCGD CN1CCN(c2ncccc2CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1 921248062 QJHVNRCDOFSWCD-UHFFFAOYSA-N 480.617 0.876 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779033863 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C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccccn1 1782637049 HJRCJOLPVIYGDR-XVWGUNQUSA-N 451.332 0.693 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C1)CC2 1782986041 BBEISIYQPYRUGG-FQRUVTKNSA-N 478.354 0.624 50 20 JCGD COc1cc(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1[N+](=O)[O-] 1783934580 IVJLXNGBYYTQQW-QFIPXVFZSA-N 477.518 0.349 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C2)C1 1785613011 UNBMPIYDEVKGPT-PDSXEYIOSA-N 477.986 0.734 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C3CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979739 CMFKYZPWNBEFBT-XIRDDKMYSA-N 456.333 0.002 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(C)c1 1786986560 LGHWYWAQDDLZSY-NYVOZVTQSA-N 480.326 0.369 50 20 JCGD CC(C)Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)n(C)n1 1787210831 UPTUVFTZFSJEQV-XJABCFGWSA-N 468.363 0.206 50 20 JCGD 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O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ccc4c(n3)OCCO4)C2)CC1 1810755860 DTZGQGSTFKYLMW-UHFFFAOYSA-N 465.315 0.691 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)c3ccccn3)sc2C1 1815016521 PSCXLQLTFDVCCN-DIFFPNOSSA-N 466.527 0.462 50 20 JCGD C=C(CC(=O)OCC)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343815 QIEFBOCVSYYGNG-OAHLLOKOSA-N 457.317 0.558 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1cc(=O)n2[nH]nnc2n1 1816673770 HOFITGILSOKPEW-XUOSJQGZSA-N 471.272 0.185 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3[nH]nc4ncccc34)sc2C1)c1ccc(B(O)O)cc1 1816870861 MBFRUNDWHNVRJD-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)n(C)n1)CC2 1817277602 ZGLMVDANBRBUBW-IVWJEFBKSA-N 470.515 0.942 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCNC(=O)C1)CC2 1817283101 UZQLNFUJIKNBPK-JATIBWBUSA-N 471.543 0.715 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)[C@@H]1SC(=N)NC1=O 1817471955 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)nc1)CCO2 1829509600 IZPHXEDGKLZCDH-WGLQLPMYSA-N 488.932 0.939 50 20 JCGD Cc1ccc(F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1830079528 MOVCVONYAGRZDH-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccc(Cl)cc1 1830261781 ZGMKTUHXDHVQDR-XDHUDOTRSA-N 486.761 0.894 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1 1830737127 ATHMXKWMTPAGFC-LIRRHRJNSA-N 461.943 0.100 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832252117 QVFKKGJXXAIUCP-ZANVPECISA-N 479.221 0.581 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1 1832586176 VFZVPAKWJYRMTR-UWJYYQICSA-N 455.939 0.733 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1833263800 SXZJGVPSDCACKS-GFCCVEGCSA-N 495.382 0.029 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1 1833617442 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnn1C(C)C)CCO2 1838021687 MUAVCRMWELSDTF-NWJFTTBMSA-N 485.545 0.668 50 20 JCGD O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838480497 ASBLFBLJDSCELN-VGOFRKELSA-N 475.933 0.240 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)CCO2 1839032789 SONFVQPWDZIVLM-DEOSSOPVSA-N 498.621 0.574 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1839444219 ABGBTUCSCKPLCY-UWJYYQICSA-N 454.907 0.533 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1839934113 JTNVVIFLHZIYEC-VWLOTQADSA-N 466.343 0.296 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1840030209 DNRSVXGQMCCHTR-NOZJJQNGSA-N 479.221 0.581 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1 1840036358 JDGYWIBWAVONSF-CKFHNAJUSA-N 455.353 0.754 50 20 JCGD O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)[C@@H]2C[C@H](O)CN2C(=O)OCc2ccccc2)C1 1847000777 WBFYJLJNGDPOLG-BZSNNMDCSA-N 465.934 0.562 50 20 JCGD O=C1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)CN1Cc1cccs1 1848145744 LJYFLRKMHCBZMY-UXPWSPDFSA-N 467.356 0.292 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1)C(=O)NC1CC1 11711127 FGFCSDIEFYXAKM-CYBMUJFWSA-N 459.322 0.028 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)cc1 25875334 VHKRBRXJFVUHJE-UHFFFAOYSA-N 455.439 0.946 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 105281444 OUICSPNBNJANNW-INIZCTEOSA-N 461.496 0.990 50 20 JCGD O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)c1n[nH]c(=O)c2ccccc12 108114159 PAUWEHBTDSXVEW-UHFFFAOYSA-N 450.274 0.938 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)NC3(CCCCC3)C2=O)cc1OC 781761792 ZOEDEHJAAIXDGS-UHFFFAOYSA-N 462.459 0.263 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)cc1 818581016 SUYUDVFCAWYEMD-UHFFFAOYSA-N 454.530 0.651 50 20 JCGD Nc1nc(Cl)c(C=NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(N2CCOCC2)n1 874081399 CRMFIVNGLUJMLF-UHFFFAOYSA-N 474.330 0.614 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1csc(N2CCOCC2)n1 912852069 LBTOSTHAMSCCSS-UHFFFAOYSA-N 459.937 0.373 50 20 JCGD CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 915789065 BYZKCXVUKNVOFY-UHFFFAOYSA-N 481.339 0.624 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCCN2C(=O)c3ccccc3C2=O)ccc1Cl 915789074 DSYSIFVDXRNJEJ-UHFFFAOYSA-N 464.887 0.825 50 20 JCGD CN(C)C1(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CCCCC1 915890481 JBSZBAPYGZVBTH-UHFFFAOYSA-N 467.592 0.916 50 20 JCGD CC(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CCOCC1 916254317 UQEHNGIKXVHLHL-LJQANCHMSA-N 483.591 0.008 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(S(=O)(=O)N(C)C)cc1 916646703 JDTRZZYEHNOZQY-UHFFFAOYSA-N 482.588 0.683 50 20 JCGD O=C(NNC(=O)c1c[nH]c(C(=O)N2CCCC2)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1 916726627 QDUOQRMAEMOGNR-UHFFFAOYSA-N 475.527 0.346 50 20 JCGD CNC(=O)COc1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1OC 919690294 QDVRBVAXLVVYQR-UHFFFAOYSA-N 478.527 0.210 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(=O)n1C)C2 1778090987 AXWXOIWFJBJKDS-CAAOGRNVSA-N 482.541 0.647 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C[C@@]1(F)Cl)C2 1779374681 CENWJOBVRTVJRP-BWMZKYQQSA-N 453.902 0.737 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3csc4c3c(=O)n(C)c(=O)n4C)CCO2)C1 1781218724 SCTARLRAWIWBEQ-QKKBWIMNSA-N 482.990 0.689 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)cn2[nH]cnc(=O)c12 1781334924 RMAGIIKCJULDSA-CXAGYDPISA-N 456.272 0.465 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OC(C)(C)C)CCO2 1783878824 KDBOCPJIIXBCAU-HOIFWPIMSA-N 499.996 0.929 50 20 JCGD CC1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)CC1 1784316672 BNOPUWLRCSNCDH-VDGAXYAQSA-N 458.563 0.010 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21 1784444228 IKVOOULERSDONK-PEDHHIEDSA-N 454.387 0.077 50 20 JCGD COc1cccc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786983650 OQTHEPZNMZUIMH-ZMIBLHLHSA-N 464.327 0.682 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncn(-c4ccccc4)n3)[C@H]2C1 1787584817 UUUPQBWPDDHPBO-YSSFQJQWSA-N 490.524 0.173 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4[nH]ncc4c3)[C@H]2C1 1788273658 JXTOUPVJELCCEP-UHFGEYHKSA-N 478.513 0.685 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)C(=O)c1ccccc1 1788607838 NHTVFEOWOHZUCB-YYWHXJBOSA-N 494.552 0.051 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C[C@@H]21 1791293775 IVBNCKBRUNMLND-QIJZPMMNSA-N 470.574 0.105 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(O)cc2)CC1 1793025583 RGEKBASMJMNBBO-UPHUGPLXSA-N 450.300 0.007 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1793118240 HVEIUYQLGJFYSI-FZDIXFNVSA-N 459.352 0.779 50 20 JCGD COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)n1 1793986583 TUDRMUCYOJEMKF-GYGSIYFNSA-N 468.514 0.356 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNCP(=O)(O)O 1795962975 SOTHIPFIBBXQEI-CRWXNKLISA-N 482.902 0.482 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796189023 NFEKHCCKXGJQKJ-OBKDMQGPSA-N 489.353 0.966 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccc(Cl)cc2nn1 1796244940 UVIYNCVDCIUBGP-VTEUUUEMSA-N 495.927 0.799 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)no1 1796867647 HBNCNWMOBMNVRK-BTTYYORXSA-N 455.475 0.262 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)c(F)c1)C2 1797753119 UAFZGQVMQIOEKO-IVWMJMPLSA-N 461.881 0.995 50 20 JCGD CCOC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)CC1 1798443479 AIMDJMDJUWVYOY-BJWYYQGGSA-N 472.546 0.805 50 20 JCGD COCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799346547 CJWZJDFOEZINPB-XRGAULLZSA-N 455.321 0.336 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2 1800755940 APKRPZUONWPVPD-VFFTVRQLSA-N 451.321 0.953 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1804193398 ACKJWNIGUCWZHN-GHTZIAJQSA-N 482.679 0.669 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(=O)OC(C)(C)C 1806722504 WDMJZSZCCQNUOW-KNQAVFIVSA-N 496.373 0.948 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2cnc3ccccn23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359410 ITMNMAFRAWNLND-CJFMBICVSA-N 483.337 0.971 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cn2ncccc2n1 1809355494 HUZVJOMHCCULRT-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD Cn1nc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cc1O 1810299424 PSSFCSYSYPNQBD-AUUYWEPGSA-N 464.486 0.153 50 20 JCGD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn2[nH]cnc(=O)c12 1811310726 MKPYJFATQDCHED-HTAPYJJXSA-N 494.556 0.419 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1C 1811629403 UOTDIFPANSSYSH-UTKZUKDTSA-N 463.303 0.137 50 20 JCGD O=C(Nc1cccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344256 QIAPXRKDVZRWEM-AWEZNQCLSA-N 465.300 0.082 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cccn2c(O)nnc12 1817966291 SJEAFVSBGDMTOY-QGZVFWFLSA-N 475.274 0.458 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nc3ncccn3n2)n[nH]1 1818621456 YSINUGBNCRIXDB-AWEZNQCLSA-N 454.495 0.526 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)[nH]n1 1819403259 BCVXLVFBBZPFMB-OAHLLOKOSA-N 451.447 0.111 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nc2ccc(F)cn2n1 1821597076 KTYVPQQEXXCTOJ-KRWDZBQOSA-N 477.265 0.891 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CSc2nc[nH]n2)n[nH]1 1822713173 UHSKZJBAUKQAEM-AWEZNQCLSA-N 470.519 0.625 50 20 JCGD Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)nc2nccn12 1824116356 ZXJLVYLOXPZVED-HNNXBMFYSA-N 476.327 0.714 50 20 JCGD Cc1ccc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1 1828271427 NAFNMKPRVBHUOQ-GOSISDBHSA-N 492.366 0.787 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C(=O)N(C)C)CCN2C(=O)OCc2ccccc2)C1 1828936803 YSVKYOFXOVFRIE-WZONZLPQSA-N 494.976 0.781 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C)COC1)CCO2 1830033594 OFQJWVICEVHLTM-JOCHJYFZSA-N 477.470 0.627 50 20 JCGD Nc1nc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2s1 1830723551 PNNRPLCWQLSXIL-AUUYWEPGSA-N 454.936 0.548 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)CCO2)C1 1830747161 ALSSOTHTLHEGNL-WHSLLNHNSA-N 477.986 0.857 50 20 JCGD Cn1nncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1833234886 PWFCUSXBJBWFAD-XXFFJTNUSA-N 472.452 0.770 50 20 JCGD COC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1834856531 PKYMLTORXOOBHU-JOCHJYFZSA-N 493.469 0.543 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2 1835682459 KQPJPJAARLWGJA-BEFAXECRSA-N 459.385 0.898 50 20 JCGD Cc1ocnc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737871 KCSWYBQFNILCGA-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1 1835798372 VHJHCWOMIRSDAQ-CABCVRRESA-N 495.422 0.950 50 20 JCGD Cc1ccc(COCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1C 1835928034 BOFVZWYDCLCDLK-AREMUKBSSA-N 496.369 0.270 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3cnccc13)CCO2 1837032770 VDJOVVDQLQROEG-RUZDIDTESA-N 475.310 0.298 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n[nH]3)CC2)CC1 1837902478 FBGVMIZYZJTTQU-ZVHZXABRSA-N 471.518 0.862 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)C3)CC2)CC1 1838102989 JOEPGOQQTSZPDT-WBILBPDKSA-N 472.546 0.255 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cnc4[nH]ncc4c3)CC2)CC1 1838306427 OYCZODUCUNKECL-UHFFFAOYSA-N 471.562 0.943 50 20 JCGD NC(=O)c1nccnc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1838508280 HTLNGXWVPAJIOL-OAHLLOKOSA-N 472.315 0.878 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)cc3nn[nH]c13)CCO2 1838620026 MXHOBQDXNPOPMK-NRFANRHFSA-N 493.952 0.054 50 20 JCGD O=C1CSc2ncc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCBr)C4)C3)cc2N1 1839577005 FWMICQWCRFHLEM-LJQANCHMSA-N 499.387 0.981 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c3c(nn1C)CCC3)CCO2 1839582535 DYHDGDMDGOPNAH-RGXRWQALSA-N 497.556 0.113 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1 1840034104 AGPBQZBJJPBLNS-DIFFPNOSSA-N 470.349 0.940 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1840034698 UMDLXZCXDGFDSI-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1 1840155903 JSKOVJKICGEJDO-MDAIXWLXSA-N 496.004 0.332 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(C(=O)OC)cc3)C2)C1 1840156590 WNYHFXGUWWQFQH-PGRDOPGGSA-N 468.934 0.726 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3c1CCCC3)CCO2 1840720664 DVOVTVKMTNQHKD-AREMUKBSSA-N 478.354 0.629 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1[N+](=O)[O-] 1840759183 VEUNMELXIQTAIE-JOCHJYFZSA-N 493.517 0.046 50 20 JCGD COc1cc(CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc(OC)c1OC 1841784502 NOPNETYBTMLHIU-UHFFFAOYSA-N 468.315 0.452 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1845147008 ZBXGDVOFPGLTIO-INIZCTEOSA-N 497.593 0.409 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CN1C(=O)C3(CCOCC3)c3ccccc31)C2 1846385610 ZATPDRWINASKKY-UHFFFAOYSA-N 497.596 0.658 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)c1 1847383351 VDPDDSNIBNKWSA-ROUUACIJSA-N 457.512 0.218 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)CC1 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O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3c(Cl)ccc4c3OCO4)C2)C1 1777799613 ODCQTNQPSXERNT-QFIPXVFZSA-N 472.690 0.506 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)CC1 1778351508 FEASJNMMOWPALA-BEFAXECRSA-N 459.385 0.011 50 20 JCGD CN(C)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779032697 RVAWSPWHPCSGNW-QHCPKHFHSA-N 452.515 0.508 50 20 JCGD CN1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)CC1 1779371317 ONBLAZCMYHIQIA-AUSIDOKSSA-N 458.563 0.154 50 20 JCGD COc1ncccc1CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371536 XVDKMLKXQYJPJL-CJFMBICVSA-N 496.568 0.849 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1ccnn1 1780967949 FKIHZBNKVYPBKJ-WZONZLPQSA-N 484.561 0.015 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)CCO2 1781220109 VINYPTIIEDZHRS-CJXDPKRBSA-N 472.995 0.014 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1781382969 DVPJNWZVNNORJN-IEBWSBKVSA-N 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O=C1NCc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)ccc21 1837152530 RSOLGEKRLHJFGE-HNAYVOBHSA-N 470.295 0.691 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@]3(F)CCCC=C3F)C2)C1 1837461780 AZZHKEUKGFJRKJ-YADHBBJMSA-N 479.484 0.501 50 20 JCGD O=C(Cc1ccc(F)cn1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919379 KTFRLQKZXJABBF-UHFFFAOYSA-N 469.322 0.755 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1 1838030786 BMHXASFHOMDJEQ-HRAATJIYSA-N 463.922 0.796 50 20 JCGD Cc1ccc([C@@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1839948698 FBZDLKPIMIRYGW-DVECYGJZSA-N 460.575 0.928 50 20 JCGD O=C(c1cccc(N2CCOCC2)n1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840187445 BFXODRQWPXIPDY-FQEVSTJZSA-N 473.357 0.792 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)C3=COCC3)CCO2)C1 1840561742 AOQGJOIYPQEUQM-JOCHJYFZSA-N 475.454 0.894 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1ccccc1)CCO2 1840902742 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COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)C(=O)Nc3ccc(C)cc3)C2=O)cc1 726276278 PJZDXXZWJRSGHS-QFIPXVFZSA-N 453.455 0.557 50 20 JCGD CCOc1ccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1C(=O)O 727720681 UYLIRIQSVYXKPB-UHFFFAOYSA-N 485.540 0.722 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1ccc(NC(=O)c2ccc(Br)o2)cc1 729274485 MRUBOAJMNJBZBU-JTQLQIEISA-N 487.332 0.922 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)c(Br)c2)n1 729299954 YFHTZTMGQDPUEA-UHFFFAOYSA-N 458.338 0.974 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1 807148898 NPJWMVUDRBCYFZ-UHFFFAOYSA-N 475.325 0.743 50 20 JCGD Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cnc21 879341024 NRUWZRKAJZQWAX-UHFFFAOYSA-N 451.487 0.007 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNS(=O)(=O)c1cccs1 915187978 CYWVDTXRGNZRKO-UHFFFAOYSA-N 451.574 0.386 50 20 JCGD CCOc1ccc(C(=O)NCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1OCC 915789135 QBISHGTYHYFENS-UHFFFAOYSA-N 498.945 0.976 50 20 JCGD CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)c1nn(C(C)C)c(=O)c2ccccc12 916580094 DONQVOZSVBIOHD-UHFFFAOYSA-N 452.537 0.593 50 20 JCGD O=C(COC(=O)c1ccc(CN2C(=O)CCC2=O)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 921181102 AHEFVFHMJPCSKL-SFHVURJKSA-N 467.434 0.480 50 20 JCGD COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 1317690606 RZNLZCDLFNVSNN-UHFFFAOYSA-N 468.557 0.922 50 20 JCGD O=C(CCN1CCOCC1)NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl 1328384534 OQFDJZDTMXFGEP-UHFFFAOYSA-N 492.023 0.401 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091016 JWOSLGOWTGXGOU-HZIOGEERSA-N 488.589 0.939 50 20 JCGD O=C(/C=C/C(=O)c1cccs1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1778096594 AOWUGCURRLXXFP-YANKAQCJSA-N 482.367 0.995 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnn3c1)C2 1779374185 IYLDGZZXHZDXMN-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncon1)C2)NC(=O)NCc1ccccc1 1780559262 GUBJMNFVUWTOSL-WZONZLPQSA-N 485.545 0.543 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2)N1CCN(C)CC1 1780639269 YLNGPXKTXHTYLZ-WOIUINJBSA-N 454.688 0.988 50 20 JCGD C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[S@@](=O)c1ccccc1 1781500944 RPMPZQFIVPOADB-KRIMLYLISA-N 498.410 0.690 50 20 JCGD COc1c(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc(F)c1F 1781847058 PLZSLIQMEALTDM-NRFANRHFSA-N 454.474 0.790 50 20 JCGD CN1CCCn2nc(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)cc2C1 1782562778 UGCMAWVLKPKOBD-LJQANCHMSA-N 454.369 0.947 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C1)C2 1782852891 PWXFRMWAQXEZMI-OWZDWXTDSA-N 456.902 0.987 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc3cc(Cl)ccn13)CCO2 1783933627 BDIDFJNUQFEHNL-OAQYLSRUSA-N 462.938 0.804 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1783933857 JQORFAMNHHUSPS-DEOSSOPVSA-N 476.574 0.839 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)[C@H](O)C1 1784084470 TUJPIUKPJNQJKP-WEVKCVHISA-N 489.997 0.184 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1784428590 BUXAMNXOYLIRET-OLCDPMAZSA-N 478.354 0.772 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785347122 ZGOLUQLPNXSFDK-WZONZLPQSA-N 475.351 0.113 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c2cc(O)ccc2n1 1786984188 OZSHRZPUMVFRBC-OWSXEPHWSA-N 489.337 0.836 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnoc3)[C@H]2C1)NC(=O)NCc1ccccc1 1787573115 GVQOTVSIAWCSAQ-IHPCNDPISA-N 470.530 0.614 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC4(CC3)OCCO4)C[C@@H]21 1788609710 CFIHUHFMHPDUKS-VDGAXYAQSA-N 487.557 0.212 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ncn3)[C@H]2C1 1789057150 FIPLKRBHFZCWHV-IOMCNPASSA-N 473.921 0.857 50 20 JCGD CC#C[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(O)cc1 1791333007 GSNZOEYGUKQRFP-NBMBROAQSA-N 490.365 0.863 50 20 JCGD CCSc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1792397374 KAFRJJLUIRLNCP-ZSBFGKGUSA-N 470.555 0.709 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccccc2[C@@H]1O 1793036419 ITOMTGLUJDCSGZ-JRYVQNIKSA-N 458.559 0.245 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)cc1 1793145521 JJXALNGJHCQULK-RPUYLAQPSA-N 457.980 0.900 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1793858929 AZXFDLBNNXESDV-BCDXTJNWSA-N 459.352 0.922 50 20 JCGD COc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)cn1 1794949609 BYLLALRTHPCMLV-OPMZPASUSA-N 497.556 0.035 50 20 JCGD O=C1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)N1 1795289375 XSPOFKXZQIHBNY-OREBXVKISA-N 464.360 0.861 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796189768 YERVJZUNZNOFIK-DQEVTTJGSA-N 459.352 0.779 50 20 JCGD CCn1c(-n2nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)cc2C)cccc1=O 1796391222 MKNNWVKXXCLTTR-REPLKXPHSA-N 497.600 0.987 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)N1C[C@H]3C[C@H]3C1)C2 1796441914 GTAXIESWWFWXGQ-BYSCXRCNSA-N 456.547 0.050 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc3cnccc13)C2 1797751899 XUCHYBVWJBMIOX-YVWYUNDQSA-N 461.482 0.145 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754059 RFPMJUKIHORBER-JLUCKKNBSA-N 454.325 0.062 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)n1nc(C)ccc1=O 1797909012 QOSZSZCFQMOWQA-XGTIQQAESA-N 497.556 0.010 50 20 JCGD COc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)ccc(F)c1F 1799675682 USIVLJJDUHPYQT-HBCWATKFSA-N 460.242 0.170 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OCC(F)(F)F)n1)C2 1801009428 HMAUUOWKLSNCQY-HBCWATKFSA-N 487.479 0.599 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803141703 TVANDBMRTKAAGP-OWSLCNJRSA-N 484.981 0.963 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1805301416 NLSFLYXBCZHXMR-FXAWDEMLSA-N 463.303 0.137 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365290 XJZNIAQNWPLMKO-JTSKRJEESA-N 470.298 0.666 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375992 ROCLNVBPRYMKHZ-BRALQCHUSA-N 463.347 0.553 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1 1808416528 BBZSQIKQRIHBRL-ODZZAOHFSA-N 476.497 0.619 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1 1810302203 GJBMKUXZBQRTHB-KKSFZXQISA-N 485.508 0.756 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(-n3cnnc3)cc1)CC2)c1cccc(B(O)O)c1 1815354608 LNGCRRDFMCXARO-QGZVFWFLSA-N 488.338 0.943 50 20 JCGD O=C(Cn1nnc2ccccc21)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815549845 YKGIWXIKWICARM-IBGZPJMESA-N 473.302 0.840 50 20 JCGD O=C(CCN1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1817178114 HUTWHIAZJMAEPC-LJQANCHMSA-N 455.324 0.118 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819560607 DACYTWJOSNNOPE-KSSFIOAISA-N 455.324 0.700 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)c2ccco2)CC1 1827184939 CMMAPJQYCQWWBH-LJQANCHMSA-N 482.541 0.941 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828521228 WYMRXDWSQVWWFP-VFNWGFHPSA-N 498.374 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCCCC2=O)CC1 1828925130 DRVODIGBACWNTD-HXUWFJFHSA-N 470.574 0.931 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CNC(C)=O)CCN2C(=O)OCc2ccccc2)C1 1829303159 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Cc1nn2cc(CC(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)nc2s1 1833631380 QZRHSPOWFKWTSG-KRWDZBQOSA-N 469.011 0.813 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3nccn3C)CC2)CC1 1835118406 ZDJBZBAZPGOIHT-JVWAILMASA-N 468.562 0.739 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C3(Br)CC3)CC2)CC1 1835738244 OPPWZNHNKBEBKX-UHFFFAOYSA-N 493.406 0.798 50 20 JCGD Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n[nH]1 1835786845 IXUPEXSKBKIBGT-UHFFFAOYSA-N 468.562 0.145 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3sc4nccnc4c3N)CCO2)C1 1835880766 HCZNVCHIJLHUKL-BLVKFPJESA-N 469.951 0.597 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1836399891 PWLTZKZQOJDJDN-ICSRJNTNSA-N 465.422 0.445 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837348818 VSIMIVDHHKGOAB-LDBYXDLTSA-N 453.923 0.306 50 20 JCGD CN(C)c1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459583 KYBZRKYDAKGWTM-XMMPIXPASA-N 482.541 0.135 50 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CMSBKBQFMPLRMO-UHFFFAOYSA-N 460.399 0.807 50 20 JCGD CN(C)N(C(=O)CNC(=O)c1ccccc1I)[C@H]1CCS(=O)(=O)C1 728180693 WGKUTJZXABXBNE-NSHDSACASA-N 465.313 0.513 50 20 JCGD O=C(Cc1csc(N2CCCC2=O)n1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 747406235 YNKZREQHXYALOO-UHFFFAOYSA-N 493.567 0.295 50 20 JCGD O=C(COC(=O)CCS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1 913218781 AARAGEVHGATWQS-UHFFFAOYSA-N 453.404 0.902 50 20 JCGD CC1(C)NC(=O)N(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)C1=O 913430538 RQTGXBATKYTMDN-UHFFFAOYSA-N 473.511 0.257 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)C1CCCC1 914849359 YCJWCACJYMUURW-IFCKCIONSA-N 457.574 0.718 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)Cc1ccc(S(N)(=O)=O)s1 914961235 GWXAXCOKNAYZKT-UHFFFAOYSA-N 461.905 0.604 50 20 JCGD Cc1c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nnn1-c1ccccc1 917529202 PMQQLPXVGQDDAC-UHFFFAOYSA-N 470.511 0.671 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(Cl)cc1O 918358741 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COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](COC(C)=O)OC(C)=O)C1 1779406246 BVRLMFSNJRANRI-MIALQEHNSA-N 462.927 0.249 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c(=O)cn2)C1 1780121020 AQBGIBYZNVXTAY-RTPDHJCFSA-N 469.502 0.031 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1 1782480327 CMNHKXOIZMUEBF-JOCHJYFZSA-N 452.251 0.139 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1 1783535029 VWDCQDCDEJESFA-FZKQIMNGSA-N 474.377 0.853 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)CCl)[C@H]2C1 1783856085 OQNSOQSBNYKLTA-OWLYRPNTSA-N 453.971 0.702 50 20 JCGD Cc1ncc(Br)cc1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935668 BNACODPWZCKZPB-FQEVSTJZSA-N 482.379 0.969 50 20 JCGD C=C1C[C@@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)N(C(=O)OC(C)(C)C)C1 1784089067 NTFZDMRFFQTJJT-QYWGDWMGSA-N 457.955 0.982 50 20 JCGD 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CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1802149709 ATVJREBOTJQVCM-ZWUHOBOKSA-N 491.383 0.130 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1806341041 VRBFOTJQUQGOIB-LPHOPBHVSA-N 460.137 0.866 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C2CCOCC2)[C@@H]1c1cccnc1 1806703382 UOFOVHNMEHPRBU-XLIONFOSSA-N 452.515 0.826 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807363120 BDVGMUNSJFOVLU-DENIHFKCSA-N 461.331 0.745 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373116 NATCRLVJAWGYEY-RXVVDRJESA-N 482.346 0.606 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCc2cncnc2)[C@@H]1c1cccnc1 1807502228 CUMDCBQQKKOLEK-AVRDEDQJSA-N 474.525 0.823 50 20 JCGD Cn1c(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)cccc1=O 1807995496 RHBXHNLIPRCWFN-UHFFFAOYSA-N 452.515 0.542 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)CC(N)=O)[C@H]1c1cccnc1 1808407543 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O=C(/C=N/O[C@H]1CCCCO1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344037 CXDGMBUCEZUXOP-XQGSKJQDSA-N 472.332 0.578 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)c3ccco3)sc2C1 1815652984 RLDAOEZPQCFBMR-NSHDSACASA-N 483.510 0.390 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)[nH]n1)c1cccc(B(O)O)c1 1817474746 YTWINHIXADDZPT-CYBMUJFWSA-N 486.187 0.751 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1cc2n(n1)CCCNC2=O 1818910265 LXMCRZIQMPTKPI-RNCFNFMXSA-N 452.924 0.299 50 20 JCGD Cc1noc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n1 1819402908 NHIBDVKVSGXTOI-OAHLLOKOSA-N 453.463 0.648 50 20 JCGD CN(C)C(=O)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828921792 AVINTQHCUAOUFZ-GOSISDBHSA-N 459.551 0.190 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCC(N)=O)CCN2C(=O)OCc2ccccc2)C1 1829306146 LWKGZMMUZQFDJW-JPYJTQIMSA-N 494.976 0.958 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)CN)CC1)NC(=O)NCc1ccccc1 1830165329 BWLUGTZCCDNZHI-SFTDATJTSA-N 473.622 0.238 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(S(C)(=O)=O)c3)CCO2)C1 1830182706 PRPNZHZPKRWQAX-IFXJQAMLSA-N 489.388 0.944 50 20 JCGD O=C1C[C@@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CN1Cc1ccccc1 1830726850 UORYBZPKHUUYLJ-SELNLUPBSA-N 479.961 0.091 50 20 JCGD O=C(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)Nc1ccc(F)cc1 1830733810 UDRKCRSNXMPFAZ-JXFKEZNVSA-N 457.886 0.210 50 20 JCGD C[C@@H](CC(N)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831598898 WUDFFPNCOPKDAV-VFCRVFHLSA-N 490.985 0.086 50 20 JCGD Cc1cn(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)c(=O)nc1O 1832774685 PCGVBSAVDIDYDV-LJQANCHMSA-N 497.556 0.189 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCC(=O)NC3)CC2)CC1 1833121245 ZYVIIPZHUBVYBW-TXMABLNQSA-N 485.589 0.218 50 20 JCGD O=C(C[C@@H]1CCCCO1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833680837 RPIAPEKSZWDMIJ-QFIPXVFZSA-N 457.380 0.511 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC1CCN(C2CCN(C(=O)C#CC(=O)O)CC2)CC1 1833728081 VICUXAGUCXCHLR-KRWDZBQOSA-N 484.981 0.778 50 20 JCGD Cc1c(F)ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1N 1834797862 FKYQAGWCDZJOLX-UHFFFAOYSA-N 482.365 0.895 50 20 JCGD Cn1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)c2c1CCC2 1834821174 AEXGKYOPEYOOTR-IBGZPJMESA-N 455.353 0.764 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834822986 CGQPRRLQTGNHGQ-SFHVURJKSA-N 455.309 0.262 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3n[nH]c4c3CS(=O)(=O)C4)CC2)CC1 1834913719 SUBOKEQDHXMYBZ-UHFFFAOYSA-N 497.694 0.875 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@](C)(O)C(F)(F)F)CC2)CC1 1837018784 PRTAZLAFHSTLJK-IBGZPJMESA-N 466.501 0.671 50 20 JCGD COc1cccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1837350155 QVIIDMJGNXFZHE-UHFFFAOYSA-N 467.331 0.696 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3[nH]nc4ncccc34)CC2)CC1 1837919365 JHGDXBDZNBNEAF-UHFFFAOYSA-N 477.330 0.564 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCN3CCOC3=O)CC2)CC1 1838273439 SDSJVHNNUKKRNH-UHFFFAOYSA-N 467.567 0.200 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn(C)c1Cl)CCO2 1838308014 IHXPGHKUUHJASR-PFRKPPGBSA-N 491.936 0.278 50 20 JCGD CC(C)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054057 DXIDMUGAFLIVJG-QHCPKHFHSA-N 461.563 0.445 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839153902 VRJUAZJNOIKKQK-GDIGMMSISA-N 460.362 0.970 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCCC3=O)C2)C1 1839155369 RTKMPNKIURZATJ-RBUKOAKNSA-N 450.363 0.692 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)n1ccccc1=O 1839200670 OYWJGSRIXWVULK-DDUZABMNSA-N 460.300 0.556 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4cc(C)ccn34)CCO2)C1 1839602315 ACYDRACEOXTJHD-IIBYNOLFSA-N 450.923 0.967 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839652091 MXJDWXFESNWBJL-WBVHZDCISA-N 461.288 0.262 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Cc1ccncc1)CCO2 1839658756 NWXZLEZKPLKIAT-ZKFLJLHASA-N 496.568 0.851 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1839963824 XNCUYNQDWQYYDK-VQIMIIECSA-N 462.385 0.339 50 20 JCGD CCOc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nn1 1840034714 UYTOOQMHHHLGAN-UGSOOPFHSA-N 457.325 0.729 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1840035331 NHILAZGYLUTPLJ-BLVKFPJESA-N 499.387 0.979 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(F)cc3)CCO2)C1 1840054374 UTZGECSBWZEFOC-DEOSSOPVSA-N 485.516 0.527 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1 1840156054 MPNPXAHDTBGJMK-TXKCWOHGSA-N 477.945 0.607 50 20 JCGD Cc1cccn2ncc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c12 1840185410 QKJWAVYPPQIDIK-HSZRJFAPSA-N 472.546 0.086 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840239869 QGTLZARDKBGMCP-DEOSSOPVSA-N 470.306 0.127 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1 1840855200 ABUHDQJSTWVOJQ-BXWFABGCSA-N 462.385 0.921 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265617 WLEYYANGEXQTHT-UHFFFAOYSA-N 460.535 0.807 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038275 LNMXCYPOWJSCIQ-KRWDZBQOSA-N 479.603 0.217 50 20 JCGD O=C(c1ccc(F)cc1)N1CCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1847519533 IRBBSMKJMXRMRF-FKBYEOEOSA-N 479.317 0.626 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)c2C1 1847559614 PPSMAGZIQBEPCC-KCQAQPDRSA-N 468.942 0.444 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)COCCOCCNC(=O)OC(C)(C)C 1847645442 AJXMNDOFGUFJAU-IKGGRYGDSA-N 477.986 1.000 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccoc1)c(=O)n2Cc1ccccc1 10161660 NFCDAUSTBRKIEQ-UHFFFAOYSA-N 466.454 0.109 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1)c1ccccn1 104780821 ZIWBUIXQOAXZNZ-UHFFFAOYSA-N 475.527 0.014 50 20 JCGD NC(=O)[C@H]1CC(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)=NN1c1ccc(F)cc1 728209975 NJHGZPCGUARMIJ-GOSISDBHSA-N 460.491 0.830 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)CNC(C)=O)c2ccccc2c1=O 728512915 ZBRGGNLHRBERMM-GOSISDBHSA-N 470.530 0.475 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cn3ccc4ccccc43)c2)CCN1 729451261 QMLDTUMQBXJYHP-UHFFFAOYSA-N 455.496 0.223 50 20 JCGD O=C(NNS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)N[C@H]1CCS(=O)(=O)C1 731178789 RDNCTZCJXDLPSL-QMMMGPOBSA-N 457.284 0.037 50 20 JCGD C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)C(C)(C)c3ccccc3)CC2)C[C@H](C)O1 731222479 QSUXTXKHEHCGNT-IRXDYDNUSA-N 467.592 0.677 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)C1CCN(S(=O)(=O)c2cccnc2Cl)CC1 751209553 RTCDSIQQHPYNBT-UHFFFAOYSA-N 485.975 0.775 50 20 JCGD NC(=O)[C@@H]1CC(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)=NN1c1ccc(F)cc1 913198190 CZAZSWBYHHWPTE-INIZCTEOSA-N 461.837 0.904 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)c2ccccc2c1=O 916728180 IWTNHTLCCUBNOE-UHFFFAOYSA-N 490.524 0.959 50 20 JCGD Cc1cccc(-n2nnc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)c2C)c1 917391768 IGWUWASKNBEUAT-UHFFFAOYSA-N 484.538 0.980 50 20 JCGD CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)n[nH]c1C 917717471 GMWRYRZZNWDFAH-UHFFFAOYSA-N 485.544 0.303 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ncccc23)C1 1777948875 MTCGCBWTJKOLQM-XMSQKQJNSA-N 457.535 0.230 50 20 JCGD CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1778077067 FAZCKQOYLGMVAB-WHSLLNHNSA-N 475.970 0.442 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779037350 WSKOPIMHZNNURJ-HJPURHCSSA-N 452.515 0.402 50 20 JCGD C[C@H]1Oc2ccc(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2NC1=O 1780181634 XUVPTGJJEVESAQ-CMJOXMDJSA-N 473.530 0.223 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)C1 1781049776 UGHATKZFTWAFFA-NOAAKOMESA-N 463.959 0.597 50 20 JCGD COc1cc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1[N+](=O)[O-] 1781190648 UZNNSOMUWMEMRR-HSZRJFAPSA-N 498.496 0.288 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3cccc(F)c23)C1 1781425747 NNSHIGGZJKDARF-NTKDMRAZSA-N 495.515 0.913 50 20 JCGD CN(C)CC[C@](Cc1ccccc1)(C(=O)O)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1782802235 FIRPCLTWXXVRQQ-WUMKDDEVSA-N 496.004 0.681 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1 1783882033 PISUNKUWABBOKY-DJJJIMSYSA-N 454.936 0.823 50 20 JCGD CCn1c(-n2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)cc2C)cccc1=O 1784090196 TXSVFRKBXCFBCC-DKKFBQAASA-N 491.976 0.555 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)c3ccccc3)[C@H]2C1 1784901011 DEYNODFXIHVLFO-MVJPYGJCSA-N 455.490 0.989 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccon3)[C@H]2C1)NC(=O)NCc1ccccc1 1786219456 KJENFWXQMXPGPN-BJLQDIEVSA-N 470.530 0.614 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)[C@H]1SC(=N)NC1=O 1787495963 WERXPRHLXOARNG-SMSYFYOWSA-N 456.641 0.620 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)c3nccnc3C(N)=O)CCC2)cc1 1789520991 GLFVNYLKFJZQRB-UHFFFAOYSA-N 474.481 0.636 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790960391 FLZJZMUULWUURU-KSYCFECVSA-N 468.352 0.452 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCS3(=O)=O)C[C@@H]21 1790963397 ACZSRSVZGLKXCW-RMEBNNNOSA-N 451.383 0.717 50 20 JCGD COc1ccccc1OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791286370 DTAOMGNIVNWPFY-ZWOKBUDYSA-N 462.547 0.427 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791287882 AHFABYYDFSIZMX-XSLAGTTESA-N 483.610 0.500 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1792225009 ZYJSOORRFONJAQ-GZERKGCBSA-N 475.546 0.689 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2 1792868988 XOTDPLQPGFXLSM-IBEHDNSVSA-N 492.411 0.883 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1793088798 RCKYPHSEPMSOSU-YALNPMBYSA-N 481.949 0.668 50 20 JCGD CN(C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)c1ccccc1Cl 1795741298 SSCQRZSJEHQQNA-WOSNLTMFSA-N 485.777 0.526 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(n1)NC(=O)CC2 1796106708 JQDDJZPYHGUJHA-YGSHXTJESA-N 451.321 0.953 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)C1 1796192367 DNFKQAHYKBHFCY-IYWMVGAKSA-N 487.362 0.254 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2[nH]ccc2s1 1797109873 KBHLIXFXNMUJAT-KSPBDQMDSA-N 454.512 0.745 50 20 JCGD COc1ccc2c(c1)CC[C@H](CC(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C3)C2 1797214503 QXJLSFNRWCSIFA-CJQNEGCDSA-N 492.381 0.773 50 20 JCGD CC[S@@](=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1797608835 WVKZLYIUQUHBGQ-ILNGJMQFSA-N 481.527 0.882 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)cc1)C2 1797754061 RHDABCVRXWQFCD-VPTLXERWSA-N 455.490 0.660 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnnc1O)C2 1798524520 FEWGYWVYHLPJTG-IVWMJMPLSA-N 471.426 0.533 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccccc1F 1799405132 LXSIGIPACKLKOD-MPZKKPTJSA-N 455.914 0.366 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCOCC2)c1 1799611857 JOMBGHCIYBVBLB-PIKOESSRSA-N 451.951 0.980 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCOC1=O)C2 1800332251 JZUYNZRPPYUPTE-AHHPBITISA-N 460.437 0.914 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2 1800756246 JQQPIDYMVGZRPU-ZIEJDFEHSA-N 474.377 0.613 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(Br)n1)C2 1801011494 QDURJXRIGAQKEO-QHBPRCKVSA-N 474.381 0.482 50 20 JCGD O=C(Cc1cnc2ccccn12)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1803099291 NRSHFVAKVODXGX-NBGIEHNGSA-N 483.337 0.971 50 20 JCGD Cc1noc(C)c1CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365383 XJQIWHGXBPNAPR-WMZHIEFXSA-N 462.315 0.929 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC(c3ccccc3)=NN2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368134 ZIVQBHWDLPDJQJ-GVXSCFBNSA-N 497.364 0.847 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374103 XUPLUNCKQWZNGQ-TZIWHRDSSA-N 496.373 0.994 50 20 JCGD C[C@@H](C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)N1CCN(C)CC1 1807903355 OSPXCKWAHOYRCY-JXHRLWIKSA-N 473.622 0.096 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnn3ccncc23)[C@H]1c1cccnc1 1809385449 CEMWSHFCZGLKLA-IIBYNOLFSA-N 485.508 0.756 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1 1809912364 YOKWLHADXKYHSA-JTSKRJEESA-N 464.530 0.817 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810302796 NBFGXYOBNZIDDT-VPWRUGTASA-N 472.571 0.558 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812716549 BDGFHKMTDFABOP-HQRMLTQVSA-N 461.390 0.610 50 20 JCGD O=C(CCN1CCOCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1817178829 SZNGACBGQLWHGK-IBGZPJMESA-N 455.324 0.118 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470568 DVGAISUESHWMNI-KRWDZBQOSA-N 462.275 0.203 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)COC(=O)C(F)(F)F)n[nH]1 1819315860 BAXWSPAGNPRWCH-GFCCVEGCSA-N 462.429 0.880 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)COc2ccc(O)nn2)n[nH]1 1821668907 SIYFHAPMZXPJOI-CQSZACIVSA-N 460.495 0.349 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccncc3=O)sc2C1 1824533253 FXDQGJJLFKARBR-PKCARXMOSA-N 482.526 0.446 50 20 JCGD CNC(=O)CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCN2C(=O)OCc1ccccc1 1829341129 XNZOQOYFCBMLOK-WZONZLPQSA-N 494.976 0.828 50 20 JCGD O=C(c1ccc([N+](=O)[O-])o1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1829488848 VKCZNBLNEGPTOW-WFASDCNBSA-N 450.217 0.948 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1830544271 SVCWSVSEPWSMHN-IIBYNOLFSA-N 498.422 0.820 50 20 JCGD CC[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830733942 XCCVCVJPMPJKLW-ZOCZFRKYSA-N 477.986 0.736 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2n1 1830736028 PWWWNSPENZLTOU-DYESRHJHSA-N 450.923 0.621 50 20 JCGD CCOc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1OC 1830738838 VPJYCEYTTDDXJU-HTAPYJJXSA-N 470.950 0.693 50 20 JCGD COC[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1831629517 JVGBECJISKXUHV-NYHFZMIOSA-N 479.486 0.873 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1 1832647511 OCKWMFZNCBDRGB-LKXKCEHUSA-N 469.498 0.883 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1coc(Cl)n1)CCO2 1833555229 FNKLJWARCZUYKP-FINLKQIMSA-N 478.893 0.532 50 20 JCGD COc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)cn1 1834525855 SXAZNIWKMORPFH-ACJLOTCBSA-N 457.325 0.586 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cscn3)CC2)CC1)c1cccc(B(O)O)c1 1834800917 ASCXARMMEQJYFN-UHFFFAOYSA-N 456.377 0.251 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835116689 XRBKLEWNRROSED-HXLYRSSUSA-N 487.605 0.607 50 20 JCGD CC(C)O[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738171 WLUIQMLDBOBZDX-INIZCTEOSA-N 460.579 0.684 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1)[C@H](F)Br 1836412322 DTDIPPDNRUVHEZ-HNNXBMFYSA-N 484.330 0.293 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n(C)n3)CC2)CC1 1837270990 JRJMLZZDAGHMMS-UHFFFAOYSA-N 450.540 0.111 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837434224 RFEMODGWXFTRIF-IERDGZPVSA-N 453.923 0.072 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837677892 IRQVVOQQAILPRK-MRRJBJDNSA-N 452.321 0.438 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H]3Cc4ccccc4CN3)CC2)CC1 1837919314 GJCUFQLXKAVSJU-RUZDIDTESA-N 491.397 0.693 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838426438 UFKLWIJQSIQBMQ-QGZVFWFLSA-N 467.611 0.663 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(-n2nccn2)c1 1838631692 NQVXCOHAMJVUMU-DEOSSOPVSA-N 499.572 0.019 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(N(C)C)c1)CCO2 1838925447 UPMXKLGSXPCIFZ-HSZRJFAPSA-N 461.563 0.196 50 20 JCGD C#CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054714 JTBMCMRXCANEHY-DEOSSOPVSA-N 471.558 0.202 50 20 JCGD O=C(Cn1nccn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839238119 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1840184715 CAKDHASYXHJOHS-NTKDMRAZSA-N 460.575 0.928 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1 1840185262 NIEKHIFSMVGIGH-DCLXLUIPSA-N 458.559 0.620 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(F)cc3)C2)C1 1840185939 UMHGOWJOUWIZMP-QHCPKHFHSA-N 464.538 0.588 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCS(C)(=O)=O)CCO2)C1 1840551073 JLHUYTHLTOJVGR-XJKSGUPXSA-N 455.371 0.051 50 20 JCGD CC(C)(CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)NC(=O)OC(C)(C)C 1841371307 MFJIHNSCYIENJS-UHFFFAOYSA-N 459.352 0.877 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCC3)C1)NC(=O)NCc1ccccc1 1844109713 NDBAQMUZJPTKII-UHFFFAOYSA-N 465.558 0.993 50 20 JCGD Cc1cc(CC(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n[nH]1 1844324748 MYTRECMQCSHKMJ-UHFFFAOYSA-N 453.547 0.810 50 20 JCGD CC(C)C(=O)Nc1nc(O)c2ncn(CC(=O)N3CCCC34CN(C(=O)[C@@H](F)Cl)C4)c2n1 1845884500 SCXPOIRQIPXBKN-CYBMUJFWSA-N 467.889 0.864 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CC(=O)N(Cc3cccs3)C1)C2 1846384141 JSROMUKDZAIOHP-INIZCTEOSA-N 461.588 0.673 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1847013588 BRNXERKJCZIQHC-OAQYLSRUSA-N 467.306 0.070 50 20 JCGD CCOC(Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)nn1)OCC 109698455 LMUHFPPGBCZDDB-UHFFFAOYSA-N 480.547 0.537 50 20 JCGD COCCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 727098066 GPIKETOZONHBTF-UHFFFAOYSA-N 460.556 0.991 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)C1CCN(c2ncccn2)CC1 728846279 WWDGCTWHARYOSA-MRXNPFEDSA-N 466.498 0.665 50 20 JCGD O=C(CCOc1ccccc1)NNC(=O)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1 747108274 UXEGAEJTFLCUDO-UHFFFAOYSA-N 457.512 0.963 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(F)c(NS(C)(=O)=O)c2)c1 751289876 HETDNURBWJJMPS-UHFFFAOYSA-N 458.493 0.522 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)n1 759789947 MWTVVSAAZMBDKK-NSHDSACASA-N 474.948 0.705 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1 760385588 HQODBOHHCATPLY-UHFFFAOYSA-N 468.557 0.670 50 20 JCGD Cc1ccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1C 778144862 IKCWFHGUFLVINY-LJQANCHMSA-N 491.522 0.502 50 20 JCGD Cc1cc(F)ccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 873912691 MCRFBQCEFVJEPT-UHFFFAOYSA-N 457.505 0.778 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CSc1nnnn1C1CCCC1 906485921 BMMMNOIKUWCQCP-UHFFFAOYSA-N 452.566 0.943 50 20 JCGD COC(=O)c1c(S(=O)(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)n[nH]c1C 912521627 MMTABJATHZXGJI-UHFFFAOYSA-N 499.552 0.990 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)c1csc(N2CCOCC2)n1 913471100 OWEVLGZMMSPPAJ-UHFFFAOYSA-N 479.584 0.814 50 20 JCGD O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1 916647602 HRNZWUAOOQVWAY-UHFFFAOYSA-N 470.515 0.591 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)NCc1ccco1 920856444 KFDFWDYQGRBCMY-UHFFFAOYSA-N 463.516 0.423 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1 1778186949 SXCACOCMLSCBJB-XMMPIXPASA-N 471.558 0.235 50 20 JCGD O=C(CS[C@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779409036 PCXLYHCIRWOJPZ-UNWVZKJWSA-N 476.404 0.754 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CNC(=O)C2)C1 1781778340 RDDCMFULNKGBJW-FCORRRHLSA-N 488.497 0.784 50 20 JCGD CNC(=O)CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783018838 QPQXMUSYIUUAEF-OXJNMPFZSA-N 452.349 0.959 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)n4[nH]cnc4n3)CCO2)C1 1783341484 FIUNXRGKDLFWTR-GTNSWQLSSA-N 453.297 0.035 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1787421789 QRUHOAIWIZLJDH-VIQHNZTISA-N 475.970 0.202 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3ccccc3=O)C[C@@H]21 1787508723 PSBUUJFBBQILPL-MVOWZPSLSA-N 482.541 0.523 50 20 JCGD CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(S(C)(=O)=O)CC3)[C@H]2C1 1788109348 JJHOFWPJQMIXOD-ULQDDVLXSA-N 464.028 0.903 50 20 JCGD Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c(C(F)(F)F)n1 1788611273 SCNUJYPCTXZFLW-PJODQICGSA-N 495.462 0.345 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cc(Cl)ccn3)[C@H]2C1 1788730163 VURCYAXYHZWCBQ-XIRDDKMYSA-N 467.954 0.467 50 20 JCGD COc1c(Cl)ccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789339958 ZGWOQMFRSXRUTO-ZVZYQTTQSA-N 473.722 0.331 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21)[C@H](F)Br 1789922796 TYIDPVQKWMNGMA-XBQZJTFMSA-N 487.326 0.663 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c([N+](=O)[O-])c1 1790286270 JOXBQQLINIXNDU-CSFVBSKPSA-N 469.878 0.574 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4nc(C)sc4n3)C[C@@H]21 1791249501 LGWRRTGGQICHJX-TUUVXOQKSA-N 455.968 0.875 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C[C@@H]21 1791254026 LVPQLAVYBWQERS-XSWJXKHESA-N 450.923 0.902 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]4C3)cc2)C(=O)C1 1791290922 SEAUYUKHRZKINO-JBACZVJFSA-N 498.584 0.766 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1 1791292281 MQGUTDRYRXJPHS-IHPCNDPISA-N 490.557 0.205 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)CC2=O)c1 1792971407 JAGTZUBVHXARRN-GFYLYECJSA-N 465.934 0.237 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 1795895172 QDXRSFBHGAJHTK-FQMQPWHVSA-N 475.970 0.200 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2c(C)cc(C)nc12 1796921261 NYKSNEMZNGZXNO-GYRAMXJVSA-N 492.540 0.683 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1noc3ccccc13)C2 1797750514 IRTNLTFPAUUBHC-GFENJXEQSA-N 464.482 0.272 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cnccc3n1)C2 1797750774 PUVDJTRSLWKCFV-YVWYUNDQSA-N 461.482 0.145 50 20 JCGD Cc1ncncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798200456 SVFDKGODMSVVNI-HATOLVCRSA-N 481.557 0.334 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1nc(C)no1)C2 1798522364 REYLULJJEXALDM-VTEUUUEMSA-N 473.442 0.657 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCNC3=O)C2 1800639305 NOKUTWZRLBQRJO-NWJSVONSSA-N 454.325 0.003 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)[C@H]2C1 1800739959 NRBADVSIJSCNTE-QOVIGXIDSA-N 475.945 0.992 50 20 JCGD C[C@@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1801966903 USHIGBYQRZQIHU-JSLGZRHDSA-N 487.420 0.588 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc(O)n3c2CCCC3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359740 DFHUNVYYMWQBEN-XMSQKQJNSA-N 489.341 0.633 50 20 JCGD 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CN1CCCn2nc(C(=O)N3CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3c3cccnc3)cc2C1 1813074811 SXFLVLFZUGYWPG-YADARESESA-N 496.616 0.806 50 20 JCGD N[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1ccccn1 1815339558 GSCOGVWYMJBWDT-RDTXWAMCSA-N 451.317 0.144 50 20 JCGD CN1CCC(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1 1815347701 LEQAKSYHNXHERY-QGZVFWFLSA-N 456.377 0.781 50 20 JCGD COc1nccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354711 BMUJAOUHPKVYAD-CYBMUJFWSA-N 453.289 0.161 50 20 JCGD O=C(Cn1nnc2ccccc21)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815549438 OJLSMPFUQVPOJR-IBGZPJMESA-N 473.302 0.840 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cccn4c(O)nnc34)sc2C1)c1cccc(B(O)O)c1 1816964647 RUAFYKXUKWGSTB-CYBMUJFWSA-N 478.299 0.111 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)N1C)CC2 1817282248 ZFYLUDRHUIJFTO-JBGLZKNHSA-N 471.543 0.810 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476336 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)c(C)nn1C)CCO2 1833705429 DBZSQDLCKHJGIU-BHSKHCGUSA-N 489.508 0.072 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1834732161 GTJIAFGINIIGRN-CZUORRHYSA-N 460.417 0.182 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3Cl)CCO2)C1 1835012314 LAIHMXWEYUOSOL-HSZRJFAPSA-N 487.944 0.651 50 20 JCGD CNC(=S)NCCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835741954 UPYVWFDUHJELOB-OAHLLOKOSA-N 466.421 0.733 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)NC=O)CC2)CC1 1836107421 LPHLWJJPMYOKSX-OAHLLOKOSA-N 489.529 0.840 50 20 JCGD Cc1cc2cccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c2[nH]1 1837460017 ZHZPLVNXJVBZFC-VWLOTQADSA-N 492.536 0.859 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837921044 UZWJFLGSQDIKEX-GOSISDBHSA-N 468.363 0.511 50 20 JCGD Cc1n[nH]c(C)c1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921239 PBNWYMAJBDXTRF-UHFFFAOYSA-N 454.336 0.632 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cn4cccnc4n3)CC2)CC1 1838314971 FJGGMMNAAXJCNY-UHFFFAOYSA-N 492.540 0.654 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)CCO2 1839042644 GTIFWYYKXGDAAS-HSZRJFAPSA-N 494.539 0.826 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1 1840153536 RZMVSOSDSWHUFQ-YWZLYKJASA-N 454.886 0.797 50 20 JCGD O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1840186503 NTJPTOYELYYCMJ-WLRWDXFRSA-N 475.329 0.253 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CSCC(=O)O)CCO2)C1 1840193981 SBRSPDMPTDYZBI-BLLLJJGKSA-N 453.355 0.434 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Cn1ccnc1)CCO2 1840430689 MCWGPVBVYLPKLF-VPDCDGNCSA-N 485.545 0.110 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc(OC)c1C 1840756159 LFJVSITVYTVWKO-XMMPIXPASA-N 492.573 0.455 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1840854811 NZQMOHUIXHNQRZ-ZYSHUDEJSA-N 452.379 0.984 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c[nH]c1C 1843010421 NRZQOFSTPXWCHS-UHFFFAOYSA-N 467.331 0.629 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)no1 1845038711 LDPPNYGMFMLTRZ-UHFFFAOYSA-N 497.556 0.861 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@]1(C)CN(C(=O)OC(C)(C)C)CC[C@H]1O)C2 1846383540 IPSSQTCYYUPIMJ-HXOBKFHXSA-N 495.621 0.571 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1nc3c(Br)cc(F)cn3n1)C2 1846385898 IXICQACKNOWYQI-UHFFFAOYSA-N 496.341 0.821 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1846923706 WXVTWCWUJWZXEX-UHFFFAOYSA-N 450.499 0.518 50 20 JCGD Cn1cnc2c1c(=O)n(CC(=O)NNC(=S)Nc1cccc(Br)c1)c(=O)n2C 16108259 MFQLTDXXBMQPIP-UHFFFAOYSA-N 466.321 0.214 50 20 JCGD CCCOc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)cc1OC 16201437 FSSJTYSEAGPNMO-UHFFFAOYSA-N 480.543 0.918 50 20 JCGD CC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 725906929 ICOWGNXECSAVJO-GOSISDBHSA-N 466.560 0.046 50 20 JCGD Cc1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1S(=O)(=O)NCC#N 726884023 RNQHRNVTCRMNRG-UHFFFAOYSA-N 454.468 0.119 50 20 JCGD CN(C)N(C(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1)[C@@H]1CCS(=O)(=O)C1 728178934 MPEORCLAFLNGRO-CQSZACIVSA-N 465.544 0.858 50 20 JCGD CNS(=O)(=O)c1ccc(CCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 728213032 BNBXMXDDTZWXJN-UHFFFAOYSA-N 495.627 0.607 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1[C@@]1(C)NC(=O)NC1=O 728510317 GTIAPQBDHDGNKE-LJQANCHMSA-N 484.437 0.975 50 20 JCGD CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)[C@@H]1c1ccccc1OC 729275096 KYLGMOPHTKBLNZ-ALKREAHSSA-N 468.576 0.860 50 20 JCGD CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1Br 729299834 WHLRVDWXQWSELQ-UHFFFAOYSA-N 494.331 0.750 50 20 JCGD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)c1csc(N2CCOCC2)n1 731689137 FQCAKTAMDNNZRM-UHFFFAOYSA-N 462.444 0.075 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1ccc(Br)c(S(=O)(=O)N2CCOCC2)c1 745993052 VHIJCUBCAZKOOK-UHFFFAOYSA-N 477.337 0.157 50 20 JCGD CCS(=O)(=O)N1CCC(C(=O)NNC(=O)CNC(=O)c2ccco2)(c2ccccc2)CC1 751204469 IJUMXTNRXUESCD-UHFFFAOYSA-N 462.528 0.540 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1 789852786 KTFCKMVNIFPPFU-UHFFFAOYSA-N 457.468 0.520 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccc[nH]1 822066081 IGKNOFAYYULWCR-OVHOFWQVSA-N 454.530 0.169 50 20 JCGD C[C@]12CCC(=O)N1[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCC3)c1)CS2 912642988 YLQWPXFSTQFERB-KXBFYZLASA-N 452.558 0.686 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)C[C@@H]1CCCO1)N(S(C)(=O)=O)CC2 915639821 WYIWKSTWILZQGE-GOEBONIOSA-N 455.533 0.669 50 20 JCGD COCCNC(=S)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 916125688 SZCADPKTZCWMQM-CQSZACIVSA-N 460.578 0.094 50 20 JCGD O=C(NNC(=O)c1nc2ncc(Br)cn2n1)c1cccc(S(=O)(=O)N2CCCC2)c1 919807398 HAFRLJOUWZKTNR-UHFFFAOYSA-N 494.331 0.746 50 20 JCGD CNC(=O)Cn1cc(NC(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)cn1 920855207 ZAWAQUNKVCIPEZ-SXGWCWSVSA-N 476.497 0.922 50 20 JCGD CN(C)N(C(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O)[C@H]1CCS(=O)(=O)C1 1251172873 SCXBZENLMONUQY-GJZGRUSLSA-N 471.557 0.116 50 20 JCGD O=C1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](Br)Cc2ccccc2)CCO3)=NN1 1778942908 NGWUGYXECUEGNJ-MGPUTAFESA-N 463.332 0.698 50 20 JCGD Cc1cnc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)cnn2c1 1779019937 RHGQTOJDWXQUGN-HYBUGGRVSA-N 477.330 0.159 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)C[C@@H]3OCCc4ccccc43)CCO2)C1 1779028890 KQFMTFACYZHRPW-OFVILXPXSA-N 479.537 0.833 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)c2cc(C)on2)C1 1779434613 LBCIJLYLICOSFZ-YYFZDKIDSA-N 456.927 0.481 50 20 JCGD O=C1CC(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)=Cc2ccccc2N1 1779985630 NZJJQZOCOSVSKX-VWLOTQADSA-N 475.310 0.236 50 20 JCGD O=C1CC(C(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)=Cc2ccccc2N1 1779985648 ORCNNPFDRSPIJU-VWLOTQADSA-N 475.310 0.236 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3nc4ncccn4n3)CCO2)C1 1780097934 SJLKYWNRRWCNSG-JOCHJYFZSA-N 495.452 0.715 50 20 JCGD COc1cccc(OC)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1780309146 OKEBPBLYWPUVNK-PXDATVDWSA-N 482.342 0.825 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1783349918 WBLZNTKDNJOHIE-KSSFIOAISA-N 454.325 0.302 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NS(=O)(=O)CC)[C@H]2C1 1784444543 NYQJHJAGOLPYSQ-YTFOTSKYSA-N 468.414 0.467 50 20 JCGD Cc1cncc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1785288323 MNVXCGRTFVLYGL-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3Cl)C[C@@H]21)c1cccc(B(O)O)c1 1786986571 MCFFBCBMELSSLF-CEDBRAGKSA-N 472.734 0.347 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788142488 ZMVFQBCGRMYDPU-INIZCTEOSA-N 487.325 0.723 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccn4c3)C[C@@H]21 1788611332 VBZJCZGMNKYLRT-SNRMKQJTSA-N 463.498 0.240 50 20 JCGD Cc1noc(N)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726841 WXRQXLSTIBPEJS-FHWLQOOXSA-N 499.572 0.505 50 20 JCGD CC(=O)C[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1791221702 DQZZYBQWIBIYOC-MQGJPIDWSA-N 487.601 0.928 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1791254459 UPLNSYUAOJODSQ-MUGJNUQGSA-N 496.008 0.566 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21 1791254603 XTLHTEFGJRSXCK-HNKHHVNMSA-N 470.979 0.125 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2cc(Cl)ccc2n1 1796850540 AQVSEEJTGFNZOB-DBWKPXFBSA-N 483.916 0.503 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1CN(Cc2ccccc2)CCO1 1797247037 PJTBPXVIPMJKIT-UJMXGEILSA-N 451.951 0.077 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=C2c3ccccc3C(=O)N2CC1 1798451079 GWFUOSYOPWAFEG-MFKICJERSA-N 481.553 0.220 50 20 JCGD CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2c(nc1=O)SCC2 1799072004 FUJBHPLOQDXANB-MIFYACCESA-N 454.980 0.746 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)(F)F)nn1C)C2 1801011838 KCBNHMFODANYTI-DPIQGUFMSA-N 460.457 0.015 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1 1804971980 ALZGYFSWMLKBEN-QRWLVFNGSA-N 469.502 0.262 50 20 JCGD N[C@H](CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccnc1 1807258948 JRZQZUWBSKXIBX-BKULYWANSA-N 473.342 0.566 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccccc2-n2nccn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374262 YLFUZKCABMGUFK-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1n[nH]c2c1CCCC2 1808042605 KQCKINNNJLWPBH-FDDCHVKYSA-N 473.342 0.997 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1[nH]nc2ncccc12 1808106963 MJCSNLYGCTYKJQ-UTKZUKDTSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1)[C@H](F)Br 1808668123 IRVSOITYJJOUEP-JKQORVJESA-N 459.316 0.429 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810118138 XPKRNUPYLGSOLB-MRXUPLOYSA-N 472.571 0.558 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCC(=O)NC2)n[nH]1 1814523939 RVTCQRUXVAMHCL-WBMJQRKESA-N 454.491 0.240 50 20 JCGD NC[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1ccccc1 1815339607 JWKSEWJXCRXXOV-MSOLQXFVSA-N 464.356 0.791 50 20 JCGD C[C@](O)(C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(F)(F)F 1815527550 DEKMZDGMNWTBQA-KDOFPFPSSA-N 454.214 0.709 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1ccnn1)CC2 1817279761 CNRBVMQGAMVIQB-BTQGWNRHSA-N 455.504 0.481 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1819540689 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COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CCO2)C1 1832430752 AAKBYOZASFDFQC-UZLBHIALSA-N 473.885 0.987 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@@H]3F)C2)C1 1832549018 AWEYYUPOWVLQFZ-OHNQJVKOSA-N 463.934 0.933 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(S(C)(=O)=O)cn1)CCO2 1833599196 CLQWJALLNGXFKN-HXUWFJFHSA-N 485.635 0.407 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)N1CCN(C)CC1 1834423367 QUIMFCARLVWSRL-KRWDZBQOSA-N 472.472 0.979 50 20 JCGD Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1C 1835734352 CFMHYRUWIKYOGP-UHFFFAOYSA-N 482.589 0.155 50 20 JCGD COc1ncc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cc1F 1835737200 VXWLYJDOKRTPNS-UHFFFAOYSA-N 499.547 0.727 50 20 JCGD Cc1nccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835738007 QATJDXXQYCYWQA-UHFFFAOYSA-N 466.546 0.283 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1 1836971645 BPLNNUPNTYLSAO-RBUKOAKNSA-N 461.346 0.972 50 20 JCGD O=C1COc2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Br)C4)C3)cc2N1 1836992554 KUVWSPWNPKGJNJ-VQIMIIECSA-N 486.294 0.778 50 20 JCGD O=C1NC(=O)[C@H](CC(=O)N2CCC(OC3CCN(C(=O)[C@H](F)Br)CC3)CC2)N1 1837116395 BUAQPLQPVDPIFF-JSGCOSHPSA-N 463.304 0.274 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccc3)C2)C1 1837456608 LDSFDJACYZIFJZ-DEOSSOPVSA-N 467.526 0.388 50 20 JCGD CN1CCc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)ccc21 1837460049 ZTIKUQKJWXLRMP-RUZDIDTESA-N 494.552 0.061 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1837609607 VUBNXOXFGWUEGO-PNHOKKKMSA-N 488.372 0.288 50 20 JCGD O=C(c1ncccc1Br)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838073676 JLKGFBZODMIHFT-CXAGYDPISA-N 462.728 0.514 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)nc4cccnn34)CC2)CC1 1838527182 NXURRJMHYDOAKX-KRWDZBQOSA-N 477.949 0.956 50 20 JCGD COCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839053999 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COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)C2)C1 1840155293 WSFOUHZOMHYEEK-IIBYNOLFSA-N 485.921 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1 1840185292 JIEOGAJOQRRBDI-OAQYLSRUSA-N 493.952 0.054 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CCO2 1840288602 PCEVUBSTABCKJC-WZOHSFFVSA-N 479.537 0.559 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Cc1ccccn1)CCO2 1840333093 OJTLNPVFTYQJBF-ZKFLJLHASA-N 496.568 0.851 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2 1840956845 UPWQDOXAYTUXIV-FOIQADDNSA-N 475.970 0.754 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1 1841924636 KIMROGUOPVGVGJ-JKSUJKDBSA-N 489.953 0.817 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)c1ccno1)C2 1843428588 CGGBRJBXQLPPMO-SFHVURJKSA-N 498.345 0.307 50 20 JCGD CC1(CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CN(C(=O)OC(C)(C)C)C1 1847141232 XZWHJMIYFLCZJU-UHFFFAOYSA-N 471.363 0.831 50 20 JCGD CNC(=S)NCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1848099184 FGEDUIDRDALYHD-IHRRRGAJSA-N 462.016 0.804 50 20 JCGD C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)C1=O 25436429 PFEDWOMPCBYAQM-NRFANRHFSA-N 452.402 0.290 50 20 JCGD CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1Cl 728847715 MJWSTBGLOQBUBY-UHFFFAOYSA-N 482.950 0.990 50 20 JCGD O=C(Cc1cccnc1)NNC(=O)N1CCN(S(=O)(=O)c2cccc3nsnc23)CC1 728958332 FADHSKGAQHJJCV-UHFFFAOYSA-N 461.529 0.376 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cn3[nH]cc4c(=O)ncnc3-4)c2)c(C)c1 730515373 VBCDYJFPYYHCKV-UHFFFAOYSA-N 495.521 0.950 50 20 JCGD COc1cc(C=NNC(=O)CSc2nnc(O)nc2O)cc(I)c1O 730558320 INQVTCMPLMLIOS-UHFFFAOYSA-N 477.240 0.844 50 20 JCGD O=C(COCC(=O)NNC(=O)COc1ccc(Br)cc1)NCc1cccnc1 731185678 CTMMIIAIEAYYPR-UHFFFAOYSA-N 451.277 0.703 50 20 JCGD C=CCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1 761821936 YZXWIFKAIDWPCU-UHFFFAOYSA-N 452.514 0.463 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1ccccc1 771189373 QCHOJWMKZXRXDH-RDJZCZTQSA-N 481.914 0.468 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccccc1F 821719111 QBFAFXWXYADHLR-BJRSVTDJSA-N 483.543 0.980 50 20 JCGD O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)NNC(=O)[C@H]1COc2ccccc2O1 823476857 ZJOATPZNUNTFRG-LJQANCHMSA-N 486.437 0.576 50 20 JCGD CC[C@@H](C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 834791276 FQBRZEQNJYMXDL-KUHUBIRLSA-N 491.522 0.908 50 20 JCGD O=C(COC(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1)NNC(=O)[C@@H]1COc2ccccc2O1 907762012 VHPHGHBKPNYLPZ-MOPGFXCFSA-N 469.450 0.948 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCOC[C@@H]3CCCO3)nc2)CC1 916209464 LOULKXVZXSYCGR-INIZCTEOSA-N 456.569 0.230 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccc(CC#N)c1)c(=O)n2Cc1ccccc1 918016074 CRTMYXOSXLTYQT-UHFFFAOYSA-N 485.504 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C[C@H](Nc1cnccn1)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303201 QRHFDCDBCYNLLX-LUQKVYGDSA-N 489.540 0.690 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1 1810948614 PVVVKNJRUQZMSG-GMNIJNRFSA-N 464.486 0.964 50 20 JCGD O=C(CC[C@@H]1CCOC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813626764 FVVNTASYHNDPEU-MONBJTKQSA-N 451.332 0.898 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3ncnn3c1)CC2)c1cccc(B(O)O)c1 1815356365 FVONVTLWWGJPIP-HNNXBMFYSA-N 462.300 0.405 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1820108496 YPENNAOQKBVCPC-DOMZBBRYSA-N 458.349 0.354 50 20 JCGD CN(C)c1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cn1 1820832298 DLZNVYQBYGOHHF-INIZCTEOSA-N 465.344 0.824 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](CO)NC(=O)OC(C)(C)C)[nH]n1 1822414610 WWFJXNCIKYDEGU-JKSUJKDBSA-N 495.581 0.660 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCC([C@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)cc21 1824186483 NCDKCNNKLPPEET-SJLPKXTDSA-N 451.955 0.850 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1824613601 YBMKVZOQPZSPAC-RYUDHWBXSA-N 455.537 0.990 50 20 JCGD Cc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c(=O)[nH]c1C 1825449609 YOEQLLIVDKDMKC-SFHVURJKSA-N 460.579 0.993 50 20 JCGD CN[C@@H](CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1)C(=O)O 1826940106 DJHXNNRQISZFLE-FRXCEDINSA-N 474.562 0.803 50 20 JCGD O=C(c1cc2ncccn2n1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059600 SCAPYFHGTFGWMF-NRFANRHFSA-N 461.331 0.956 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1829160218 LPDJMDJBKJMPOH-KRWDZBQOSA-N 455.280 0.545 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830544302 UMFWDKJPRSJBKJ-PXNSSMCTSA-N 495.411 0.544 50 20 JCGD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830678679 BUIRAVVHDIOZLQ-APWZRJJASA-N 476.313 0.847 50 20 JCGD O=C(c1cnc(-c2ccccn2)nc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724084 CUMCCPJCKSDBQG-UTKZUKDTSA-N 461.906 0.208 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CC1 1830737339 DGSJLKYEIRKXHU-VGSWGCGISA-N 489.997 0.690 50 20 JCGD CC(C)[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1830842532 XIYFXAVCIXRSPE-JYFHCDHNSA-N 480.370 0.876 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)CC2)CC1)[C@@H](O)CCl 1833313606 MRUNVQFSCHSGAL-FQEVSTJZSA-N 488.972 0.901 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1 1833566419 CKQZJUOVZVXKSR-SCLBCKFNSA-N 475.315 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(N(C)C)cn3)CC2)CC1 1834014617 URLNFSODLGVWQY-UHFFFAOYSA-N 473.622 0.706 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cccc(Cl)n3)CC2)CC1)c1ccc(B(O)O)cc1 1834797368 GTDBAFBJMMTDIC-UHFFFAOYSA-N 484.793 0.843 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834824867 OGMPGFXQCABQNM-CXAGYDPISA-N 451.314 0.789 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835589242 OPPWXXUCIVVZGE-DOWNOZBLSA-N 491.029 0.948 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)C(C)C 1835737837 GDRZOBDUWJECHO-OAQYLSRUSA-N 488.589 0.458 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(Cl)c1 1835933871 HUKYTANNBLYFDA-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD Cc1cnn(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)c1 1836194636 ABNODZHPTMGTQS-HTAPYJJXSA-N 499.996 0.780 50 20 JCGD O=C(CCN1C(=O)C=CC1=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1836995870 NHXGYYPZYXHGRU-GOSISDBHSA-N 474.327 0.991 50 20 JCGD Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1837417051 OXKHQGRRRZZZPY-UHFFFAOYSA-N 451.332 0.996 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@]3(F)Cl)CC2)CC1 1837921068 XCXNZKMINOGUDP-GHTZIAJQSA-N 452.719 0.903 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1838417177 HTVVEQYFXAYWBY-QGZVFWFLSA-N 461.327 0.630 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN(C)C(=O)C(=O)O)CC2)CC1 1838729142 OXONSLCLQVNVNE-LBPRGKRZSA-N 462.341 0.311 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1839139059 NBDFBEZXFQGFTA-DNVCBOLYSA-N 467.922 0.519 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1839152439 ZEDUJHYUGJPRRU-QZTJIDSGSA-N 486.418 0.105 50 20 JCGD O=C(C1CCC(CO)CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199012 QDFXAQDUCPQVGH-GULCKSEBSA-N 451.333 0.932 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)nc2N1 1839199848 WTEQOORIGGUENZ-HNAYVOBHSA-N 485.310 0.727 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839741973 JBYFYIHRHCROMM-ARIZABOZSA-N 469.872 0.928 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(OC)c1 1839794071 CQGXOVARHCFFRC-GCJKJVERSA-N 470.950 0.693 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC[C@@H](C(=O)OC)C3)C2)C1 1840155780 HXDINJKTGKCEEX-DLRJPAPCSA-N 460.955 0.676 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1OC(F)F)CCO2 1840745805 QUIUUDQHBYFRQS-QFIPXVFZSA-N 484.500 0.731 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264613 PODWEZGGLWBRLT-UHFFFAOYSA-N 462.470 0.569 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2)C(C)C 1845248100 WYNXFZOQYGIOQZ-XHSDSOJGSA-N 472.970 0.161 50 20 JCGD Cc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)NCc1ccccc1 9931040 VORABVDBOYBJMN-QGZVFWFLSA-N 465.553 0.669 50 20 JCGD CCOc1cc(/C=C(\C#N)C(=O)c2c(N)n(C)c(=O)n(C)c2=O)ccc1O[C@H](C)C(=O)N(C)C 16881517 URJAXSMDXQEQPU-QQFZQELXSA-N 469.498 0.710 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)cc1 17114032 ZCKKTAXEDKBFPA-GOSISDBHSA-N 483.568 0.303 50 20 JCGD CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 17516868 GLKONDVCIVOKPF-UHFFFAOYSA-N 496.567 0.728 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cn(Cc2ccccc2)nn1 24357994 FCNQUKAMUNOUNQ-UHFFFAOYSA-N 498.565 0.741 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)/C=C/c2ccc(NS(C)(=O)=O)cc2)c1 26745628 YHSPFFFARWQQIX-FMIVXFBMSA-N 466.541 0.783 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC)cc2)c1 28196158 WSWQILGHCGPNJT-UHFFFAOYSA-N 468.557 0.700 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@@H]1CCCN(C(C)=O)C1)N(S(C)(=O)=O)CC2 726101978 GYJCJXYWDJMMCH-AEFFLSMTSA-N 496.586 0.359 50 20 JCGD O=C(COC(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O)NNC(=O)[C@@H]1COc2ccccc2O1 728335859 RUUWPTUJAMVYDR-YJBOKZPZSA-N 457.414 0.709 50 20 JCGD O=C(CCCCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)NNC(=O)[C@@H]1COc2ccccc2O1 729822754 FXAAVEIEMXHHKF-BGYRXZFFSA-N 498.492 0.522 50 20 JCGD O=C(NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21)[C@H]1CCS(=O)(=O)C1 750931791 BKUHLRAIMFVQRT-VIFPVBQESA-N 468.289 0.634 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(S(N)(=O)=O)ccc1C 819841314 RONXFAZCDQOWRE-UHFFFAOYSA-N 455.876 0.922 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1 914559184 BSRSBBXAWHAKDQ-UHFFFAOYSA-N 457.516 0.844 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1 914868814 FLBCSWFPSSGVJX-STQMWFEESA-N 459.471 0.722 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 915921849 MENKREIQBRIFLO-UHFFFAOYSA-N 473.511 0.489 50 20 JCGD CC(C)CN1CCO[C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1 915922625 WHEXJUSTBHNRLB-SFHVURJKSA-N 467.592 0.772 50 20 JCGD N#Cc1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1Cl 917718345 UGJBHUDHNZBOAB-UHFFFAOYSA-N 484.943 0.856 50 20 JCGD COc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c(OC)c1OC 918226879 CVMQSRBYCJJZAB-UHFFFAOYSA-N 494.574 0.870 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)CCc3ccc(OC)cc3)cc2S1(=O)=O 919836217 DZXGKDXPWILSJN-UHFFFAOYSA-N 461.496 0.880 50 20 JCGD COc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)Nc1ccc(C)cc1 919885913 POXSWPGTZFZKIG-MRXNPFEDSA-N 496.567 0.936 50 20 JCGD COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)N[C@@H]4CCS(=O)(=O)C4)cnc32)c(OC)c1 919886803 VDNFVMPUFXHANO-MRXNPFEDSA-N 488.526 0.628 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCCC(C)=O)c(=O)n2Cc1ccccc1 920445512 WWWCSOKTNOGNTQ-UHFFFAOYSA-N 454.487 0.335 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNC(=O)NCCCOC)CC2=O)cc1 920862581 XHZSIOOYPIORAR-OAHLLOKOSA-N 469.564 0.437 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(Cl)nc2n[nH]cc12 1777785305 UTGQKODQELLDAG-WZONZLPQSA-N 497.748 0.732 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSC(=N)N)C2 1778091594 XULGVFDNTJBEGE-DHSLWRBWSA-N 463.564 0.261 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)cn1 1778205891 UTSUYMKKAXLVGT-NTKDMRAZSA-N 496.524 0.308 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1778934178 UKLVQPIZNOGPHJ-NTKDMRAZSA-N 465.315 0.073 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1779028415 DYIIWTMCDCILDD-NTKDMRAZSA-N 496.524 0.226 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)nc2ccccn12 1779029953 CHCAQKZLWKXPCC-QHCPKHFHSA-N 463.498 0.399 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Cn1cncn1)CCO2 1780097994 WOXNHTVYDSXCQV-IVZQSRNASA-N 486.485 0.891 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(=O)N1C)CCO2 1780098672 PLZGYGVFMHMNQV-HTAPYJJXSA-N 474.470 0.584 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCO1)CCO2)NC(=O)NCc1ccccc1 1780968340 IVRKZGDEANKVFI-XXBNENTESA-N 459.547 0.342 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1 1781998146 UPLYNCQGWDDJAT-GMIGKAJZSA-N 450.330 0.348 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1782671271 YKAFOOGNHAGMHT-IFXJQAMLSA-N 453.337 0.815 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](N)CN)CCO2 1782869714 IECGEYIZSBBVSG-WMISXODJSA-N 462.348 0.472 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccccc3O)C2)C1 1783236669 INHOFQVLXPUYOJ-DZQSVEARSA-N 453.499 0.899 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)CC2=O)c1 1784083675 FMORVCWCYNXVCW-DJLVLGKWSA-N 479.961 0.628 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnccn3)[C@H]2C1 1784248553 FZJPZXYKOBQJSY-YKNBRYRPSA-N 453.503 0.133 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)C(=O)c1ccccc1 1784347055 WBXBQGCTFSDBCY-YYWHXJBOSA-N 494.552 0.051 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(F)cc4)CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980204 VJBOWQVQFYQMPR-HSQYWUDLSA-N 466.318 0.831 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1788597188 DMMKBNUGEJEXRI-WDSOQIARSA-N 473.574 0.369 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C[C@@H]21 1788609897 BRDNUPDZKPEBTL-AXHNFQJDSA-N 484.469 0.206 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790267800 HTYHGAGSBDGWEI-BUKVSMQUSA-N 496.329 0.248 50 20 JCGD O=C(CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)Nc1ccccc1 1792936399 QEOYTBMUXISREQ-NHKMSHSESA-N 479.342 0.379 50 20 JCGD CCc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c1Br 1792976272 BCWALLHKTBCFFS-IQOUGMIPSA-N 463.760 0.548 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c1 1792982376 BTTVARBHZFGMGM-AQBLEKOUSA-N 468.934 0.856 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)CNC1=O 1793763798 BMPOSBIQNFQHFQ-SDGGPSBXSA-N 473.436 0.013 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC[C@H](N)C(N)=O 1795637389 FUNZYPJZHZJYCA-WWKBNMOASA-N 461.469 0.054 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cncnc1 1795807088 VHHBPMQSQYRTLP-KEMUROEHSA-N 453.503 0.133 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CNC2=O 1797550215 QJUYSHJAMFCSDN-NSAWHWOWSA-N 478.509 0.267 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1nc[nH]n1)C2 1798523100 RQLMLOVFTGWRLE-IVWMJMPLSA-N 490.498 0.634 50 20 JCGD CCCOc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1799007933 SNTVBJAOAPWSQE-UPHUGPLXSA-N 467.526 0.991 50 20 JCGD COc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)ccc1[N+](=O)[O-] 1799248118 CDUPIZLLPTZEQO-USGNIVHTSA-N 498.496 0.048 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(Cl)c(F)cc1F 1799465252 GQFWGJVIGKZLQO-DBWKPXFBSA-N 464.661 0.815 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2c(F)cccc2n1 1799998422 FBYIFDQXIXJAFY-DFZQMDCHSA-N 481.488 0.811 50 20 JCGD C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1 1803016801 ZDLQBJCENXSBFM-XNRPHZJLSA-N 469.336 0.661 50 20 JCGD COc1cccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807360969 DGPSWIGTOSCABC-GCJKJVERSA-N 460.299 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)c2ccco2)[C@H]1c1cccnc1 1810295720 WIXREIOWAIREEW-RYGJVYDSSA-N 464.482 0.726 50 20 JCGD Cn1c(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cccc1=O 1810297259 BISKQHHJQLXVCP-IERDGZPVSA-N 475.509 0.412 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=N/O[C@H]2CCCCO2)[C@H]1c1cccnc1 1810357994 NXMCUJKSROSYPF-CVZFPUQOSA-N 474.562 0.989 50 20 JCGD CCOc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1 1811620338 CLGIOGMZXJBWPX-GCJKJVERSA-N 475.314 0.584 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812868213 USSONZRTZYFPIH-LESCRADOSA-N 457.369 0.157 50 20 JCGD O=C(CNCP(=O)(O)O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2 1814770484 VZDHCHGJOXHBKY-LDWIPMOCSA-N 459.234 0.470 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815340705 OFAYWXVDYMFRBL-HNNXBMFYSA-N 480.311 0.544 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362045 ZUQHMGYNXQMXQS-HNNXBMFYSA-N 488.375 0.964 50 20 JCGD CC(=O)c1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n[nH]1 1817473385 QNZJXUMPMQPMCK-SFHVURJKSA-N 450.264 0.635 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)[C@@H]1SC(=N)NC1=O 1817475576 UQRVWJVEHWLYOE-CXMBCZLWSA-N 484.347 0.198 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nc[nH]c1[N+](=O)[O-] 1818075758 NIOBRCLKNKDZSF-CQSZACIVSA-N 453.224 0.341 50 20 JCGD Cc1ncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cn1 1819794664 AOWNOLAYWQVDRC-LBPRGKRZSA-N 452.500 0.780 50 20 JCGD CC(=O)O[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)C(C)C 1819797844 MJMXBAUSRYUUDA-SJCJKPOMSA-N 474.543 0.955 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(=O)N(C)C)C2)C1 1829340238 GNHVTTHKJZNMRV-JPYJTQIMSA-N 494.976 0.781 50 20 JCGD CNc1nsnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1829748696 DEWLLQOALPEFIE-MEDUHNTESA-N 462.370 0.681 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1830361812 DUWZCKNMBOZRKN-OAQYLSRUSA-N 467.954 0.352 50 20 JCGD COc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cn1 1830537733 NEDJMRKNIYHJMW-FZKQIMNGSA-N 457.325 0.586 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1831309489 ZMKOVABYKCAWAP-WATLYSKOSA-N 488.585 0.628 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1831645680 CZVLXCWUIXNMJW-FOIQADDNSA-N 451.911 0.912 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1 1833173525 ZURZXGNBOCSMLO-IBGZPJMESA-N 472.007 0.875 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737038 SRWHPMJNJFGOJA-UHFFFAOYSA-N 484.605 0.152 50 20 JCGD CC(=O)O[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)C(C)C 1837222361 QMQYCKHTWNGSMN-JJRVBVJISA-N 453.305 0.721 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4ccccc34)C2)C1 1837459016 HGBDZANYIVSMLX-RUZDIDTESA-N 490.520 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CSc3nc[nH]n3)CC2)CC1 1838395344 FLAGOEYMPLBKFL-UHFFFAOYSA-N 488.574 0.208 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c[nH]1 1839054004 BDPNYTXIQAHADY-RUZDIDTESA-N 498.584 0.739 50 20 JCGD COC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054247 OJWQFRHCYVLTOX-XMMPIXPASA-N 491.589 0.214 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1 1839556406 UOCZVFWJAYRHOW-XOBRGWDASA-N 454.886 0.797 50 20 JCGD CCC(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1839830821 JYHRSEQIJPOVNV-OAQYLSRUSA-N 463.443 0.569 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1839874510 XAGWDSTXJVNVLU-ZJTDPSCFSA-N 490.985 0.100 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839937537 UXKBHJLLLYDBKJ-RUZDIDTESA-N 466.343 0.378 50 20 JCGD C[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1840028266 SABHCZFTVSPOCK-KNBMTAEXSA-N 455.349 0.830 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](CN)c3ccccc3)C2)C1 1840031926 GXTKGWVIBJGFMX-RIFZZMRRSA-N 454.365 0.969 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1840033775 PSELAXWGAKCCJR-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185362 OPEQDHMYRQIURI-QFIPXVFZSA-N 493.517 0.052 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)[C@@H]1SC(=N)NC1=O 1840187652 PDTWCQLOVIAYGM-PUTJDCORSA-N 453.348 0.049 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Cc1ccccn1)CCO2 1840333092 OJTLNPVFTYQJBF-VLYKXYPLSA-N 496.568 0.851 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1C1CC1)CCO2 1840656540 UUPYTOLGGPDIKK-VWLOTQADSA-N 464.327 0.628 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840903234 XKCVUVHTYWASKD-UVFQYZLESA-N 486.338 0.952 50 20 JCGD O=C(COc1ccc2scnc2c1)NCCC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841353352 UIDRCADKLDFMPT-INIZCTEOSA-N 480.974 0.985 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844263208 FBSMVZAARTZYOB-UHFFFAOYSA-N 492.536 0.283 50 20 JCGD C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1845130622 PKCQIGIJCZDELM-FQEVSTJZSA-N 483.374 0.880 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)cc1OC 10696633 NJTMFGMMEQRHIC-DMZKTXOQSA-N 476.486 0.509 50 20 JCGD O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)C1CCN(c2ncccn2)CC1 728981053 NHMNFNADECMEIO-MHWRWJLKSA-N 458.544 0.821 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c1 744439767 JKFBNALURSNESP-UHFFFAOYSA-N 491.545 0.622 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cc1ccccc1O)c(=O)n2Cc1ccccc1 750871532 NTQKHOCZJFPCFG-UHFFFAOYSA-N 476.493 0.524 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)n1 762477625 VQVFMRDNBYHCBK-UHFFFAOYSA-N 498.587 0.125 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1 770392593 YPQNCOAKTWYYDZ-UHFFFAOYSA-N 463.468 0.374 50 20 JCGD CC(C)C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 784471839 PKHREPBLCFFQFN-YZLZLFLDSA-N 499.520 0.883 50 20 JCGD CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 789067176 OREGTWZBGKVIPV-UHFFFAOYSA-N 454.472 0.018 50 20 JCGD O=C(CCCN1C(=O)CCC1=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 915638510 YTGYDVUMBFYVME-UHFFFAOYSA-N 472.523 0.855 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1 916562049 KUVIVTDUQRNYPL-UHFFFAOYSA-N 460.512 0.961 50 20 JCGD O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)CCN1CCN(c2ccccc2)CC1 917531578 AJXVFMTWOZZMOA-UHFFFAOYSA-N 451.593 0.552 50 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50 20 JCGD CC#C[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)c1ccc(O)cc1 1786986475 DMHYEEXDDCGEFB-VBCPDFOISA-N 490.365 0.863 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cnc2ccc(F)cn12 1790471364 KJFRCGBDCCGUAC-QSFXBCCZSA-N 466.278 0.060 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)Cc3ccccc3)[C@H]2C1 1790779420 DCYGJHZSSWMIJN-QTMHVTGLSA-N 495.418 0.565 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790961487 MDOVVJDRJBWDNO-HJWJTTGWSA-N 453.142 0.133 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@H](NC(=O)OC(C)(C)C)C3)[C@H]2C1 1792224132 VPKBLZMXOOQQQP-VMXHOPILSA-N 495.621 0.642 50 20 JCGD Cc1ccn(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1 1793878234 HRXGRAQENVGZGC-DFGXFYAUSA-N 469.970 0.913 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(Cl)cccc13)C2)c1ccc(B(O)O)cc1 1795735732 ADYRBQMXMOPZNE-ZSBFGKGUSA-N 468.706 0.413 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)c1ccccc1)C2 1796440588 SRKGYFDLACZOQN-UKBRNAERSA-N 453.499 0.444 50 20 JCGD COc1ccc2oc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)cc2c1 1797349946 GBQPRYYVXQFXKA-FAQVEIGNSA-N 464.283 0.638 50 20 JCGD Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)nc1 1797749455 AIQREMFIBJMGAQ-VPTLXERWSA-N 452.515 0.225 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2)C(Cl)Cl 1801014990 WXANHPHDYARJCE-DDFAGTSDSA-N 465.297 0.578 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)ncn2)[C@H]1c1cccnc1 1803745033 RYPNQVHVDCKTPP-AUUYWEPGSA-N 462.470 0.209 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H](O)c1ccccc1 1806802431 VKFCIDRZLMWECZ-MZYLBHOOSA-N 459.311 0.815 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374092 IFOJEFMNTBWDBB-OJWCNPDFSA-N 451.332 0.632 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@H]1c1cccnc1 1810303430 RVZJULFOZUZCNY-VGSWGCGISA-N 475.509 0.262 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1 1813069024 SCQQGRKNLRWLRH-XMSQKQJNSA-N 462.620 0.509 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(=O)nc3sccn23)[C@@H]1c1cccnc1 1813073841 OZQWJMFXSAGTRM-IIBYNOLFSA-N 497.581 0.844 50 20 JCGD Cc1cc2nnc(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)[nH]n3)c(C)n2n1 1818589032 ARMPNZMBTZSTSO-SFHVURJKSA-N 488.317 0.764 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NNC(=O)C1)CC2)NC(=O)NCc1ccccc1 1822518378 NYVMQSHLQWIEAD-AWEZNQCLSA-N 498.569 0.277 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CNC(=O)C1)CC2)NC(=O)NCc1ccccc1 1822518820 VKABJHVCTIVWRW-CVEARBPZSA-N 499.597 0.537 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3ncccn3n1)CC2 1826085759 BPBQCSSPOUDNKT-GFCCVEGCSA-N 456.532 0.785 50 20 JCGD O=C(c1cnn2cccnc12)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052015 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COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)C1 1830713580 DSTVHMSINIUAGB-HNSFDTNUSA-N 465.316 0.723 50 20 JCGD O=C(c1nc(-c2ccccc2)ns1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830722474 CCOXTQGQHUMSLW-YWZLYKJASA-N 466.947 0.875 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1 1830779136 NAZXJPOBKKSNGE-RIFZZMRRSA-N 491.969 0.653 50 20 JCGD CCNC(=S)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1831090707 XETIEMYGVDSFRA-LJQANCHMSA-N 460.409 0.084 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1 1831875182 VAVOFCUYIKWHLN-OAHLLOKOSA-N 463.501 0.658 50 20 JCGD CC1CCN(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1833406227 HTDRBUUXQWSTRE-UHFFFAOYSA-N 485.633 0.602 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)COc3ccc(O)cc3)CC2)CC1)c1cccc(B(O)O)c1 1834800486 HZDSPPBASUZUQG-UHFFFAOYSA-N 481.358 0.336 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1nnsc1C1CC1 1835211487 PEBPYXPGXSGSOF-UHFFFAOYSA-N 483.403 0.594 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccccc34)C2)C1 1835928606 SEHOBZCZZPQSQL-SANMLTNESA-N 474.322 0.903 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)ccc12 1836254447 YYEOFGHXTQPDSA-VGOFRKELSA-N 494.932 0.181 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3scnc3c1)CCO2 1837066373 NKKUWOHWTONMAN-QFIPXVFZSA-N 475.571 0.739 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1 1837372612 FNIOXSOVCROCHT-KXBFYZLASA-N 472.329 0.707 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837461397 VMPYXAPKPFMSFG-OSPHWJPCSA-N 482.541 0.029 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1837483027 HXTBWKUIWNIEQF-ZOCIIQOWSA-N 460.362 0.970 50 20 JCGD CCc1oncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837568218 NQEPLPAHSLCWFQ-UHFFFAOYSA-N 455.320 0.843 50 20 JCGD O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1837653462 CCSWGRIVDHIHRU-UHFFFAOYSA-N 482.339 0.210 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921567 ONHMVFVZGKOGIA-INIZCTEOSA-N 476.335 0.540 50 20 JCGD O=C(c1cn2cccnc2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201056 QICDFEUPUDJUGN-CXAGYDPISA-N 456.272 0.490 50 20 JCGD O=C(CSc1nc[nH]n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203462 LTLGDVMMWYGBOX-SMDDNHRTSA-N 452.306 0.044 50 20 JCGD Cc1cccn2ncc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)c12 1839612885 ZIJZTADQMOUFCE-HSZRJFAPSA-N 472.546 0.086 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CNC(=O)C1)CCO2 1839872007 RRZSMESNFSLCFA-SYJPKNQESA-N 474.464 0.464 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC[S@](=O)CC)C2)C1 1839965460 ZDZAXPGLOYFULO-WZXMGIQQSA-N 453.399 0.775 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3C)C2)C1 1840151068 VEZAOZDTYIIBOY-MIZPHKNDSA-N 465.978 0.753 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1 1840153159 GBNMYEHNIRZWJI-VFNWGFHPSA-N 463.922 0.796 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840912980 UOACKYQHDKAFEB-LYZACZEUSA-N 487.981 0.512 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cccc(OC3CCOCC3)n1)C2 1846385215 DYQVRURAIAAOSW-UHFFFAOYSA-N 459.547 0.829 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC12CN(C(=O)CO[Si](C)(C)C)C2 1847089449 DBEPYKAYUNOKEK-AWEZNQCLSA-N 456.616 0.810 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1)C1CC1 1847620425 NHQOBUHRCRLMGB-UFYCRDLUSA-N 471.363 0.875 50 20 JCGD COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)NNC(=O)C(=O)NC1CC1 9889731 XYDFXBYFJHUWFB-UHFFFAOYSA-N 458.496 0.486 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2)cc1 9931152 FVVFWEXXMQWFCH-CQSZACIVSA-N 467.525 0.692 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1 16785610 SIYWSERDWGQCCN-MRXNPFEDSA-N 463.537 0.634 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(NC(C)=O)cc1 25413406 WZFXLTUESRFVMK-UHFFFAOYSA-N 478.527 0.891 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccc(C#N)cc2)CC1 26694684 NWRXTDCBRDPRHR-UHFFFAOYSA-N 461.500 0.790 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)c2cccn2C)c1OC 726538762 XHDRZZCAIIQWSU-UHFFFAOYSA-N 452.489 0.138 50 20 JCGD COCCN(C)CCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 727033196 NIVBZHHCJXAULZ-UHFFFAOYSA-N 452.515 0.967 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNc2cccc(OC)c2)o1 728206045 RGNNAPMBHKZSGB-MRXNPFEDSA-N 494.526 0.878 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 728514616 HIBIXNDEQNQZGU-HXUWFJFHSA-N 490.524 0.277 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 728846413 YXLCOGLABGXLPA-UHFFFAOYSA-N 474.543 0.175 50 20 JCGD Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728847343 BBAKOUAIDKGICB-AQTBWJFISA-N 451.466 0.973 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1 729274823 FATFJUUWHKPKRI-OAHLLOKOSA-N 474.605 0.269 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)C[C@H](C)O1 731794487 WSTJCVLAEZWOHJ-IRXDYDNUSA-N 477.587 0.606 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)Cn2nc(-c3ccccc3)oc2=O)cc1OC 746189126 WVTVUYQILKHXNZ-UHFFFAOYSA-N 456.411 0.525 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)N[C@]3(CCCC[C@H]3C)C2=O)n1 760205687 YGWRFOSMDQXXIB-WYRIXSBYSA-N 451.505 0.185 50 20 JCGD Cc1ccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 772400544 CEOIADSHXUONEV-GOSISDBHSA-N 477.495 0.194 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccccc1-n1cnnn1 863950153 ZLFBCGGPTNAGIC-UHFFFAOYSA-N 485.526 0.077 50 20 JCGD COCCNS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1 913343293 DULQLPUPCBKXBW-UHFFFAOYSA-N 469.903 0.883 50 20 JCGD NC(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1 913416686 OXUCOQQKZZEMFH-CRAIPNDOSA-N 456.455 0.534 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)s2)c1 915906146 MINUQCMBHCJRAL-UHFFFAOYSA-N 489.601 0.570 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cnns1)N(S(C)(=O)=O)CC2 917394023 YEGITAAZXWDHNJ-LBPRGKRZSA-N 455.518 0.265 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2ccc(C)cc2O)c1 918341382 TVLFEPXEQMGWQL-UHFFFAOYSA-N 462.528 0.922 50 20 JCGD CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)s1 918399959 VQIJHEGDAILTIM-CYBMUJFWSA-N 488.613 0.884 50 20 JCGD Cc1cc(C)cc(OCC(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2N2CCOCC2)c1 920212747 BJYXAGGJDBUBTF-UHFFFAOYSA-N 462.528 0.627 50 20 JCGD NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2cccs2)cc1 920678994 DEOVAZDDVPKVKT-BJIFSAINSA-N 470.507 0.856 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)CC1 1778351516 FEASJNMMOWPALA-HNAYVOBHSA-N 459.385 0.011 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCC4)C2)C1 1778559746 LGTDHQXKODQELT-DZQSVEARSA-N 467.530 0.797 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2 1779404662 XGYDZSLDICQXIF-GPMSIDNRSA-N 477.352 0.780 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1 1779661481 WMWQONVHNTVOMR-FQEVSTJZSA-N 463.221 0.538 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(N4CCCC4)c(F)c3)C2)C1 1780143892 FBHHWXQRYZBZNC-VWLOTQADSA-N 481.333 0.863 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1780361031 WSEJRSCIWVKJTR-DAFNMPDCSA-N 482.423 0.401 50 20 JCGD CN1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)C1 1780967883 AUXYVKOXSYWCPX-SQJMNOBHSA-N 486.617 0.504 50 20 JCGD CC(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968371 FFTBTUDLDSCWGG-HSZRJFAPSA-N 461.563 0.588 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)C2)C1 1781116030 ZJNZUCNNHMFOEY-KZDUYQQSSA-N 490.395 0.828 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c4c(nn3C)CCC4)C2)C1 1782438095 VRNOLORLVVIBNF-XTVKVDEJSA-N 467.530 0.486 50 20 JCGD Cc1nccn1CCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782490472 DZSXZHMKMYBBKL-ZJSXRUAMSA-N 468.363 0.479 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCN(C(=O)OC(C)(C)C)CC3)CCO2)C1 1783884104 PRADSGRKOCQTEN-VGOFRKELSA-N 489.013 0.623 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C[C@@H]21 1783975172 ZZQKSGKVUFCWFN-YXWQFLTLSA-N 485.335 0.767 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCN3C(C)C)C2)C1 1784802581 PWNFAXTWYGMRAR-GGTDSNQQSA-N 458.563 0.823 50 20 JCGD O=C(Cc1cc(F)ccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784925780 CKUZIGIPZCIEGX-ZRCAFCQKSA-N 474.725 0.995 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CC1 1785317320 RNNGVPHKYRUUTO-IIBYNOLFSA-N 457.955 0.983 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981631 AEDQPKNJBXBXTN-VHFSOBRXSA-N 493.285 0.058 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)c2n1 1786984047 ZZECBZJEQWFPBS-NYVOZVTQSA-N 476.342 0.538 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CO)NC(=O)OC(C)(C)C)[C@H]2C1 1787395384 KTZMHIJKYXZRTP-QXKUPLGCSA-N 463.959 0.106 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1OC 1789541575 ORZLUJZJEIYIFG-JLMWRMLUSA-N 468.315 0.291 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1791249946 UMFFQYCQPHIIDZ-RBZJEDDUSA-N 463.959 0.106 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)C[C@@H]21 1791287999 MMXQSWHZKNDVHB-FNHZYXHNSA-N 479.509 0.629 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)nc1F)C2)[C@@H](O)CCl 1792975048 HIEKXEWDEYAGJX-PKCZLINISA-N 450.692 0.786 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)[C@H](O)C1 1792981311 JJLKDZRQUXUNFK-HAOOACFXSA-N 489.997 0.184 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792982875 UNLBCVCTHZCBCT-KCYAQADSSA-N 459.971 0.823 50 20 JCGD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)nc1 1794865738 YLKMIPBWGAUNGF-JHDGKUDLSA-N 480.569 0.939 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc([N+](=O)[O-])c2c1OCO2 1796188523 PVJHVPJWAVRRNI-MUJYYYPQSA-N 467.243 0.569 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3CN1)C2 1796440575 SAJFYKBEILGTDW-FKFDQLPQSA-N 478.553 0.425 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C 1799354461 RIDMOPQKGDVHHH-NIFZNCRKSA-N 478.384 0.635 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1800641068 MVJYIJBSOOLOGU-QKPAOTATSA-N 480.425 0.421 50 20 JCGD O=C(CN1C(=O)C=CC1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1801121066 WFPBBAJOFVHOHJ-DLRJPAPCSA-N 490.354 0.507 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)C(C)(C)O 1802152341 XETNGHKFTFEULD-ITGHMWBKSA-N 451.923 0.775 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360047 GQVFNVHPXPUDTN-OXQOHEQNSA-N 463.259 0.631 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C/N=C/c2ccco2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376953 YRIVERDSRAGVOR-ODMMXCMLSA-N 460.299 0.793 50 20 JCGD COCCn1nccc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809977710 CZTXNBGMDVFGKH-UHFFFAOYSA-N 454.336 0.368 50 20 JCGD Cn1cccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1=O 1810294005 HIUJZOVTVYPSGW-UZLBHIALSA-N 475.509 0.412 50 20 JCGD COC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810299423 PNBXOEAGNPDURW-YWZLYKJASA-N 454.487 0.353 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1810479852 GUSLXWLLDOBQFX-MMOPVJDHSA-N 456.551 0.388 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)Cc2cscn2)[C@H]1c1cccnc1 1813070047 FWZXOVBXZSIRDJ-MDKPJZGXSA-N 473.603 0.487 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)c1ccc(B(O)O)cc1 1815343946 YNSNHLJAKCUGHR-MFKMUULPSA-N 456.102 0.739 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nc(O)n3c2CCCC3)[nH]n1)c1cccc(B(O)O)c1 1817476600 LUCYUZDLPOONBE-QGZVFWFLSA-N 478.318 0.948 50 20 JCGD Cc1nnc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)o1 1819402910 NIAVQXNARDKQLX-OAHLLOKOSA-N 453.463 0.648 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3c(n1)OCCO3)CC2 1819796783 FZWOGAFOJFPRNM-NSHDSACASA-N 495.521 0.847 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc[n+]([O-])cc1)CC2 1819797545 DQWDYWHHEPMPSM-GFCCVEGCSA-N 453.484 0.315 50 20 JCGD C[C@@H](CN)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822518359 NKOWETYFASJSSF-GOEBONIOSA-N 473.603 0.996 50 20 JCGD CN1CCN(C2(C(=O)N[C@@H]3CCc4nc(NC(=O)CCC(=O)NN(C)C)sc4C3)CC2)CC1 1826088300 CUSOSJAVGWBUCK-OAHLLOKOSA-N 477.635 0.208 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)CC1 1828179364 WOTUHEPXFWBTGH-GOSISDBHSA-N 477.529 0.670 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1830535037 HFGGFKYONMXCAA-FZKQIMNGSA-N 458.309 0.187 50 20 JCGD O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830734921 AFWHECAYFBVKDR-XMSQKQJNSA-N 476.917 0.519 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1C(N)=O)CCO2 1833311017 BONFZBBDLAFFOW-HXUWFJFHSA-N 450.568 0.102 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)Cn3nnc4ccccc43)CC2)CC1 1833652011 PRLBJAHTLPBUAI-UHFFFAOYSA-N 484.605 0.376 50 20 JCGD O=C(COc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834472673 LRAVBVGLMAXCIL-UHFFFAOYSA-N 483.349 0.770 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CS(C)(=O)=O)CC2)CC1 1834569198 SVWIAPADRBHITJ-CYBMUJFWSA-N 452.415 0.634 50 20 JCGD CN[C@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1)C(=O)O 1834741649 BQCSDSLXTVVLFF-BEFAXECRSA-N 451.395 0.857 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1834823007 DJNZSWSAHNXATO-GOSISDBHSA-N 457.325 0.521 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CC2)CC1)[C@@H](F)Cl 1835081398 OOINDUJSPZLYQM-QGZVFWFLSA-N 457.890 0.863 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(F)cc(F)cc4[nH]3)C2)C1 1835936751 BLHZXCVUXILDNI-DEOSSOPVSA-N 499.279 0.510 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc12 1836915181 RKNZWIDIWMUOMJ-VWLOTQADSA-N 477.326 0.540 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1837116891 AHIHKBCEYJACJN-SMDDNHRTSA-N 459.341 0.367 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4=O)CCO2)C1 1837135471 JOXREEWRXAARDW-LRTDBIEQSA-N 494.342 0.922 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)N1C[C@H]2C[C@H]2C1 1837919205 QDKPTRGYMZWKQA-YSIASYRMSA-N 469.391 0.319 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)nn3)CCO2)C1 1838352814 STLFLQNBZGBWMA-UGSOOPFHSA-N 457.325 0.729 50 20 JCGD CN1CCC[C@@H](C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)C1 1838394735 QYUBHODZKUNHMZ-QGZVFWFLSA-N 472.590 0.639 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839047308 JFGAUYMHCBWYOA-MGPUTAFESA-N 480.363 0.759 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CCO2 1839084462 DCUZTWHKMZDFEU-ROYATCLZSA-N 472.380 0.627 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)C2)C1 1839147064 GEHCYMPWBFRNFI-DOWNOZBLSA-N 489.997 0.688 50 20 JCGD CNC(=S)NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839153849 TUSZSYIYEFHUGM-SJORKVTESA-N 455.408 0.163 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1 1839275212 PMKHHVUMCCBBON-IFXJQAMLSA-N 457.867 0.624 50 20 JCGD CN1CCCn2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCBr)C4)C3)cc2C1 1839621832 UOPPWUUPCKEMST-HXUWFJFHSA-N 484.395 0.574 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1840033368 BJJPSDUGWGCEPQ-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4cnccc34)C2)C1 1840184332 HDCVDKJZBJFZGD-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCN2CCOCC2)C1)NC(=O)NCc1ccccc1 1842840562 PWQKDVFKZGPDBM-UHFFFAOYSA-N 472.590 0.258 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1845002859 SUKNPTXIWVOFSV-OAHLLOKOSA-N 453.279 0.141 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846200962 CAQNRNZWWWYBCO-KRWDZBQOSA-N 472.546 0.902 50 20 JCGD CS(=O)(=O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 727943138 WVEUUXRTAADSBQ-UHFFFAOYSA-N 454.530 0.154 50 20 JCGD CCCC(=O)N1CSC[C@@H]1C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 728214195 KJBDFTJLZMEHNZ-QGZVFWFLSA-N 455.606 0.767 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N[C@@H]2CS(=O)(=O)C[C@H]2N2CCOCC2)N(C)c2ccccc21 728698321 OBFGXURHEONSIE-YLJYHZDGSA-N 487.582 0.271 50 20 JCGD Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728847344 BBAKOUAIDKGICB-QGOAFFKASA-N 451.466 0.973 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)c1 729274706 AWNNYVYJWIUIBG-AWEZNQCLSA-N 468.557 0.803 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)n1 748128549 BRMZWDHLODUJGC-UHFFFAOYSA-N 466.541 0.783 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1)C(=O)N1CCCC1 748240198 BQSNVLXMIZKMMR-UHFFFAOYSA-N 462.553 0.879 50 20 JCGD O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)c1ccc(-n2cnnn2)cc1 748464390 CFJCOIUJGFWEJR-UHFFFAOYSA-N 450.507 0.214 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCNC(=O)Cc3cccc(F)c3)nc2)CC1 749015392 WFDWIYGJSYAEHJ-UHFFFAOYSA-N 493.565 0.142 50 20 JCGD O=C(COC(=O)c1ccccc1NC(=O)Cn1cnnn1)NNC(=O)c1cccc(Cl)c1 749280014 VXUNXEZYMSZLNV-UHFFFAOYSA-N 457.834 0.583 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c1 749838613 QWIKNWPJCQYUAS-UHFFFAOYSA-N 480.977 0.391 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1 807328042 WXTMBCSMWWMEQO-UHFFFAOYSA-N 454.413 0.129 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)NC)cc2)cc1 906411116 NHEPUEPEHYVNKI-ZDUSSCGKSA-N 457.530 0.770 50 20 JCGD CNC(=O)CN1CCC(NC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)CC1 914829703 MQZHTXZPGHPXBF-LBPRGKRZSA-N 456.341 0.757 50 20 JCGD Cc1ccn2c(=O)c(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cnc2c1 915638501 XZAMWVHNBPHOPB-UHFFFAOYSA-N 455.496 0.862 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)CN3CCCS3(=O)=O)cc2)cc1 916103552 DTWWCJCMFVDNFC-UHFFFAOYSA-N 494.595 0.612 50 20 JCGD COc1cccc(C[C@@H](C(=O)NNC(=O)c2csc(N3CCOCC3)n2)n2nnnc2C)c1 916136648 VLZZHKDCHPZIQT-KRWDZBQOSA-N 472.531 0.528 50 20 JCGD C[C@]1(NNC(=O)NCc2ccccc2OCC(=O)NC[C@H]2CCCO2)CCS(=O)(=O)C1 918218509 UTWMYGWCBNNDLZ-UZLBHIALSA-N 454.549 0.242 50 20 JCGD O=C(NNC(=O)c1csc(S(=O)(=O)N2CCc3ccccc3C2)c1)N[C@@H]1CCS(=O)(=O)C1 919888136 AKFLIJLTXRFWGL-MRXNPFEDSA-N 498.608 0.626 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 920435980 RZMSRXNLOCLRAL-ZDUSSCGKSA-N 487.376 0.620 50 20 JCGD O=C(NNC(=O)/C(=C/c1cccs1)n1nnnc1-c1ccccc1)N[C@@H]1CCS(=O)(=O)C1 920745122 HHMCIZSINSWRRD-VQCBNXJZSA-N 473.540 0.917 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1 1779029151 SFKWBWGQRZYSIG-DEOSSOPVSA-N 488.508 0.294 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)Oc1ccccc1 1779036912 IPGXBBMUJMSAEJ-BXKMTCNYSA-N 467.526 0.986 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(=O)oc1)C2 1779371022 HDZBFRMWBUBJFX-VGOFRKELSA-N 455.471 0.080 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3cccnc3n1)C2 1779372612 OBKUFAYFMNSYER-WZONZLPQSA-N 478.513 0.169 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C2)C1 1780092929 ZLFINVMHXGXRLC-HSZRJFAPSA-N 496.480 0.286 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1)NC(=O)NCc1ccccc1 1783587931 KNAMVUJZMYULMA-HSGJQSDISA-N 485.585 0.730 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(C)n1 1784294848 SMEZEHFMDGCCCL-DEOSSOPVSA-N 451.332 0.455 50 20 JCGD Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc(C)c1O 1784994928 SMEJJSUVCQTYSQ-QHCPKHFHSA-N 453.499 0.765 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786979952 SQQXSXJNAUZQOJ-YYWHXJBOSA-N 465.359 0.966 50 20 JCGD COc1ccc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(F)c1 1786983629 OMSRTPGVRXLCCQ-CBMMCEQISA-N 482.317 0.821 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)n[nH]1 1787168485 VAXFLIDCZMNIPD-MZONFKNFSA-N 455.519 0.699 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCOCC3)C[C@@H]21 1787508960 VAMYDMMHXBYJOV-QXDWZXEQSA-N 459.547 0.917 50 20 JCGD CCn1nc(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610467 UJGZANUJOURIDW-FNHZYXHNSA-N 455.519 0.117 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C(F)(F)F)cn3)C[C@@H]21 1788610532 YAIIRXTYYVIFHN-PJODQICGSA-N 493.446 0.401 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21 1788638744 GFSQSJNFPLZBHT-XHWCBRGXSA-N 467.346 0.697 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789754346 KVVYURUYRWHNBP-WBAXXEDZSA-N 490.561 0.192 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1 1789870600 PXGPZVACFLAGPW-ZAHIEGGZSA-N 467.346 0.697 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCNC4=O)C[C@@H]21 1790960769 DOIZNKOAXCJKLW-QCQGSNGOSA-N 468.352 0.393 50 20 JCGD C=CCO[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793359093 MERMASAZLKGKFU-KMQSCTNJSA-N 473.574 0.513 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1793600331 XVRUYOHIJIDQMR-VTMBPIDISA-N 463.959 0.104 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(OCC(F)(F)F)n1 1794337234 QGTHUYXQMUQGCP-HBCWATKFSA-N 487.479 0.599 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(C)(C)O)NC(=O)NCc1ccccc1 1795365619 PFRRCDPYLHZZBD-RMFSNUHRSA-N 461.563 0.083 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 1795895067 NWOPCXYLMMVBKO-VTMBPIDISA-N 490.395 0.730 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(CC(C)C)nn1C)C2 1796440699 YNOAIFONQAEFAL-AOSNRDAWSA-N 483.573 0.956 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1coc([Si](C)(C)C)c1 1797727200 JYDUULGBSJSDTH-CWPLJXCYSA-N 450.612 0.401 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798442711 ADDJVCCAYKAYFA-BJWYYQGGSA-N 463.535 0.007 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3cnccn3)c1)C2 1801011949 XSPVXTFABDBIPU-BBIADKPPSA-N 466.542 0.720 50 20 JCGD CC(=O)Nc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)ccc1C 1801012497 KUPOPCJNYSQBEM-OPMZPASUSA-N 459.547 0.530 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc(O)c1 1801125040 KQPHXQKXNOUDQQ-VPTLXERWSA-N 453.499 0.227 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)=NO2)C1 1801888251 LDBJNSNHJIPAHE-HLPPOEQASA-N 470.954 0.990 50 20 JCGD COc1nccnc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804971080 LNHMTAVGSOFDGE-YLJYHZDGSA-N 461.287 0.193 50 20 JCGD COCCOCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1806757839 QUBKKQYSJATIMY-BFZLZUEVSA-N 470.530 0.884 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368316 RSCXEAPHPFVEGS-FHJLPGHOSA-N 473.342 0.609 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3nc(CO)[nH]c3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373839 CKGWZCGOUZBJEF-NTKDMRAZSA-N 499.336 0.763 50 20 JCGD O=C(Cc1ccc2ncnn2c1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807400984 OHOASUKNUWRGJD-HYBUGGRVSA-N 484.325 0.366 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808417544 LQDANMVIBQZPCX-DYSWHZDDSA-N 479.541 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1 1810302039 FCONBUWZDILZMS-CXAGYDPISA-N 450.459 0.142 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnc2snnc2c1 1811338296 BPIXHZHMVRLYOE-JXFKEZNVSA-N 488.338 0.795 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@@H]1CC(c2ccccc2)=NN1 1812306235 NOTCMRAJUVLEFL-TUSQITKMSA-N 497.364 0.847 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815228588 ISIJLRBQQYIOCC-SUMWQHHRSA-N 462.337 0.076 50 20 JCGD CC(C)n1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1C(=O)O 1815337982 YPUQUPNIJPXGPY-AWEZNQCLSA-N 497.342 0.838 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1nc2c(=O)[nH]c3ccccc3n2n1 1818583977 ICFWRLRCXFUNCN-TVQRCGJNSA-N 487.929 0.853 50 20 JCGD O=C(/C=N/N1CCCCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819393206 KDBOVCGEQPZGHQ-WWJLXRQJSA-N 452.324 0.867 50 20 JCGD C[C@@H](NC=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(C)NC(=O)NCc2ccccc2)n[nH]1 1820710243 AHTFVMOXUKEFDQ-VQIMIIECSA-N 484.561 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1 1825868047 PFBKBQHRMVVPKO-CYBMUJFWSA-N 450.565 0.441 50 20 JCGD O=C(c1nc2ncccn2n1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059426 PEEWAQNUIWXWQQ-IBGZPJMESA-N 462.319 0.351 50 20 JCGD O=C(Cn1ccnc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828547945 BTVLVEZKJOXJCD-WMZHIEFXSA-N 489.960 0.935 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(CO)on2)CC1 1828924126 JEBWHFQLBBMGDG-LJQANCHMSA-N 456.503 0.713 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(O)O)C2)C1 1829340888 SPCJWXIRZVOZHA-IERDGZPVSA-N 469.922 0.003 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830720023 QSSWBCMLNZUCDS-WIYYLYMNSA-N 453.898 0.837 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726041 NQLXSSKMIPKGAD-KKSFZXQISA-N 477.986 0.738 50 20 JCGD O=C(C1=NO[C@H](c2ccccc2)C1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731677 NSZJLHWBJUDTER-BBTUJRGHSA-N 451.907 0.560 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731756 MLXGUUZJZYNPAB-LRDDRELGSA-N 454.833 0.109 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)CCO2 1832012251 CCCLZGSTXPQEFN-IAGYGMIVSA-N 460.955 0.676 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C1(O)CCC1 1833068530 QFCWCTXCWLPHQT-INIZCTEOSA-N 472.590 0.421 50 20 JCGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)c(=O)[nH]c1C 1833385497 LYFVSAQXCZYAFJ-SFHVURJKSA-N 457.325 0.242 50 20 JCGD O=C(CC1CCOCC1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834628438 QZFNTSKVUBLPHO-UHFFFAOYSA-N 457.380 0.368 50 20 JCGD NC[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccc1 1834759086 BMJPEBAIVPOJOF-XMMPIXPASA-N 478.402 0.294 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c2ccccc21 1834821443 KKQYBWNRYIRJHP-OAQYLSRUSA-N 495.374 0.581 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc2cccn2cn1 1835424684 RCGDQOLTPFHYND-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD O=C1Cc2cc(C(=O)NC3CCN(C4CCN(C(=O)c5ccc(B(O)O)cc5)CC4)CC3)ccc2N1 1835517315 QJISXXOLLZINIJ-UHFFFAOYSA-N 490.369 0.360 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccn4cncc4c3)CC2)CC1 1835606570 PZBORHRSALNSOV-UHFFFAOYSA-N 469.590 0.893 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)o1 1835733557 KGGRMAPWTXUVKF-UHFFFAOYSA-N 482.346 0.417 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3c3ccc(F)cc3)C2)C1 1835934034 KQMPTPPYVATWJN-WRALFONMSA-N 482.317 0.379 50 20 JCGD Cc1occ(C(F)(F)F)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835937192 RPSADPGFAFWUQU-NRFANRHFSA-N 496.247 0.670 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1835937397 UBDVEWUCKJTRJL-HSZRJFAPSA-N 498.732 0.051 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C(F)(F)F)C2)C1 1835939739 ZDOUEFIQMALRLE-JOCHJYFZSA-N 492.259 0.769 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3nccnc3C(N)=O)CC2)CC1 1836050137 BKUJGJNWTKCCRU-FQEVSTJZSA-N 471.389 0.997 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1836723711 PSYOMKCWTHVPKR-YCRPNKLZSA-N 475.970 0.300 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1 1836884373 VXPWDNLPMSCQHV-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1837396970 PNNQTXGURCJLAP-AFOZGOSESA-N 475.546 0.150 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ncccc1C(F)(F)F)CCO2 1838142193 HGNAORFDYQMWMZ-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1838418454 ADTHDLGDRRTDGO-CXAGYDPISA-N 489.323 0.517 50 20 JCGD CC(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1838979374 OAGGWYDJNBUVEJ-RUZDIDTESA-N 466.343 0.874 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1839018329 MHTLUFPMLCNJLK-XMMPIXPASA-N 468.315 0.149 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1 1839137105 XAFXBQBDOZINGP-HRAATJIYSA-N 485.921 0.856 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)nc2nccn12 1839550290 ZXUGDTDATMLYJU-LIRRHRJNSA-N 466.336 0.891 50 20 JCGD C[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1839931160 MROZSPAWLWHSPF-CJAUYULYSA-N 481.553 0.949 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCOCCOCCOC)CCO2)C1 1840076341 GHLGOAGPILXERN-GHTZIAJQSA-N 464.987 0.920 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)C2)C1 1840150629 NXTDKQLFUVOLHE-XFQAVAEZSA-N 477.986 0.857 50 20 JCGD COc1cc(C)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840680717 UMBSGDWNSHWAPD-QHCPKHFHSA-N 462.547 0.447 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCc2cnccn2)C1)NC(=O)NCc1ccccc1 1846631413 OXWGQBVYZOIOCJ-UHFFFAOYSA-N 465.558 0.959 50 20 JCGD CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1 727603757 DPPLZUSVEDFLBL-UHFFFAOYSA-N 465.514 0.369 50 20 JCGD COCCS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 728214362 MUAUNDTYQTVDSJ-UHFFFAOYSA-N 496.611 0.800 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 728322544 JFURVDNQFKKTFF-SFHVURJKSA-N 495.485 0.657 50 20 JCGD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 731214693 WCCBWAMWOCFMRN-SJLPKXTDSA-N 460.535 0.668 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccoc1 747184125 SRPKOWBUCPVILC-CQSZACIVSA-N 463.921 0.476 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2cc([N+](=O)[O-])ccc2=O)c1 748697260 XRIKIIWGQCUDFY-UHFFFAOYSA-N 451.461 0.248 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(F)c(S(N)(=O)=O)c1 915462687 JZCVFOSBDQEWTK-UHFFFAOYSA-N 459.839 0.753 50 20 JCGD Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 917270824 CAIDJAPAZMFAHB-APWZRJJASA-N 484.444 0.435 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(C(=O)C(=O)N2CCCC2)CC1 918777488 LYEOBSWDTAMQHP-AWEZNQCLSA-N 496.362 0.724 50 20 JCGD O=C(NNC(=O)[C@@H]1CS[C@]2(c3ccc(F)cc3)CCC(=O)N12)N[C@@H]1CCS(=O)(=O)C1 919889702 RTIYEFFGOLVYCV-GLJUWKHASA-N 456.521 0.234 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1csc(N2CCOCC2)n1 1318229931 QWTDEVCYMYSODD-UHFFFAOYSA-N 487.585 0.143 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779291974 IERDGMQXQHRCRP-YBGOQADZSA-N 465.359 0.995 50 20 JCGD O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780005788 YFGDUEFOPIPHCX-SANMLTNESA-N 487.321 0.081 50 20 JCGD C[C@H]1Oc2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)cc2NC1=O 1780175286 JEFQDPVNIJJLAE-JBEBIEQOSA-N 494.508 0.162 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CS(=O)(=O)N1CCCC1)C2)[C@@H](F)Br 1780773539 OGZNQWDBONZBFE-FRFSOERESA-N 484.388 0.616 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2nn[nH]c2c1 1781441879 VDJSRGNWAKJISR-NFBKMPQASA-N 463.303 0.079 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)C(C)(C)C 1782210058 CFFUHRTUEGGCPN-DHJUGAMNSA-N 467.611 0.424 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(-c3ccc(O)nn3)cc1)CCO2 1783935144 PUJANWPMQZLKPD-XMMPIXPASA-N 482.541 0.666 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C1CC1)CCO2 1783935292 RPNQFICYEUUHJF-WMZHIEFXSA-N 481.594 0.493 50 20 JCGD CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C[C@@H]21 1784617327 FBLRPZIJZHWATI-DNCCFGNJSA-N 451.955 0.982 50 20 JCGD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785002838 QOBHIMFBAIIHML-ZRCAFCQKSA-N 485.277 0.250 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3COc4ccccc4O3)[C@H]2C1 1785040610 KTQSFRRGLXPDOP-LNTZLTSJSA-N 495.536 0.940 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983704 UWZNZONXMVJNJY-LQJIQPLVSA-N 489.378 0.121 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(C)n3)C[C@@H]21 1787509003 PCWNFMSDECFHHJ-RBFTXDQOSA-N 453.503 0.512 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ncsc1Br 1787548135 PCYSPVUDYJRBPK-QEJZJMRPSA-N 494.176 0.493 50 20 JCGD COc1nc(C)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789011921 AFUQIWGYUQOIMF-JVPBZIDWSA-N 468.514 0.304 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3nccn3)[C@H]2C1 1789971402 JTWZZYHPQGTNEF-FNHZYXHNSA-N 472.458 0.405 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21)C(=O)C(=O)O 1790636336 CYNGRKJJIVSSKE-MEFGBEIZSA-N 490.463 0.394 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791195266 INFCIQXZOAVEPR-QRFRQXIXSA-N 499.354 0.660 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1792452921 XVIYAWBCYKMHQQ-GAMODTGLSA-N 489.997 0.184 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)cccc1Cl 1792753813 OBFZTBLGRJLTHB-NXCRSVRDSA-N 475.908 0.924 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cncn1)NC(=O)NCc1ccccc1 1796293078 NIESEYQDZMATGZ-REPLKXPHSA-N 454.535 0.263 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2c(nc1=O)SCC2 1799074680 KEFOKPUWQBHEHC-HLPPOEQASA-N 485.404 0.655 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnco1)C2)NC(=O)NCc1ccccc1 1799095424 URKHHVMLTUCPKZ-XEMDLRDOSA-N 456.503 0.224 50 20 JCGD Cc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c(-n2nccn2)c1 1799345922 VWTAAEVHDSZTBC-ACDBMABISA-N 459.315 0.821 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1ccnn1 1800268123 UTFXUSJHKROTLI-NFWAQSGPSA-N 472.458 0.576 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1800825212 WLYAUVZSLBAHSF-KNJMQODFSA-N 463.934 0.871 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](O)[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)C1 1801014775 FQUOVJUZEBDOKZ-XLWJZTARSA-N 480.389 0.998 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1802040874 OOULRNKSLGXRHC-BVRUVYRISA-N 455.914 0.062 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807155312 LQDSIRFFYKNTBW-XTQVGHSUSA-N 473.342 0.977 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2COc3ccccc3O2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364636 SZVMOVAEXNSLOC-IGKWTDBASA-N 487.321 0.921 50 20 JCGD Cn1cc(CCC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1807427944 YHZMVIAPBALUAW-NFBKMPQASA-N 461.331 0.447 50 20 JCGD Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1 1807531554 ANENPJXCWZUMJV-UWJYYQICSA-N 465.344 0.484 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)Br)[C@@H]1c1cccnc1 1810093990 JYIIZPOANJHSDM-YYWXWVFPSA-N 457.325 0.935 50 20 JCGD Cn1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1Cl 1811168118 PYXWQRJAALITHR-LPHOPBHVSA-N 467.722 0.782 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccnc2c1OCO2 1811310634 VTEBHIJJSUKDQX-XLIONFOSSA-N 474.282 0.519 50 20 JCGD O=C(CN(CCO)CCO)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1 1812717742 WBIVGGWIODNRDL-BHYGNILZSA-N 461.332 0.065 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc(-n2cnnc2)cc1 1814703778 XXONGGBYJWAMQW-QGZVFWFLSA-N 488.338 0.943 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1 1815333498 NTBVCVZZVOMSHI-RKDXNWHRSA-N 451.896 0.354 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccnc2C(N)=O)[nH]n1 1819401760 RAQUVLODAJTCRX-MRXNPFEDSA-N 477.485 0.522 50 20 JCGD O=C(/C=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)NCc1ccco1 1820055190 PCYUYAIUXCXFOJ-ROJDOSBLSA-N 494.338 0.514 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc(-n2c(O)nnc2O)cc1 1821418320 OSMAHKPNBSCDSV-MFKMUULPSA-N 478.918 0.961 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc([N+](=O)[O-])[nH]3)sc2C1 1821742947 IHUOLLZKCRPHDW-VIFPVBQESA-N 470.471 0.918 50 20 JCGD CN1CCN(C2(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3cnccc3C(=O)NN)CC4)CC2)CC1 1822714996 FQMARYPSIDNDMM-CQSZACIVSA-N 498.613 0.147 50 20 JCGD CCOC(=O)C(C)(C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1823483192 HMSYIBFUDPIYDI-KRWDZBQOSA-N 456.308 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3c(n1)OCCO3)CC2 1826085326 MVRYOEWHTLLXCY-LBPRGKRZSA-N 474.543 0.908 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053451 PZNSZOAKUHBWRS-VWLOTQADSA-N 490.413 0.997 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C(=O)N(C)C)CCN2C(=O)OCc2ccccc2)C1 1828936798 YSVKYOFXOVFRIE-JPYJTQIMSA-N 494.976 0.781 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829051759 BAFUSHZVVKPKIF-TVTNDZMWSA-N 497.955 0.566 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc(Cl)nc1)CCO2 1829518714 IJLQNEOMGXUYBZ-ODDBZWQPSA-N 489.920 0.334 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1830534957 FVIDYOIVUDSUEB-IINYFYTJSA-N 493.248 0.829 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830727062 ZXBJXYUCMBSTFP-ZVVDCOBXSA-N 452.935 0.855 50 20 JCGD CN(C)[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccc(Cl)cc1 1830735268 FQOCVSPPOBHBGP-LVCYWYKZSA-N 474.385 0.999 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830737892 JVFHKSZFVNWWFK-AERDPVEMSA-N 487.981 0.442 50 20 JCGD O=C(Cc1ccc2ncccc2c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832031974 WOJKUGGDDNNRGE-SANMLTNESA-N 489.337 0.227 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832050904 PBIMOUIXNFPOIR-KKSFZXQISA-N 477.986 0.738 50 20 JCGD CC(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549145 DEXBZFVBDNOAHM-KKSFZXQISA-N 477.986 1.000 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSC(=N)N)C2)C1 1832549467 QDMDZQRPYZUJEA-ORAYPTAESA-N 494.014 0.202 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cncnc3)CCO2)C1 1833121807 WCUAMKHZQZNWPL-HSZRJFAPSA-N 499.480 0.623 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1 1833923920 BEHFLPSIVGMNLU-GOSISDBHSA-N 451.955 0.825 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3N(C)C)CC2)CC1 1834016775 CAJJTXCXJPTHSU-UHFFFAOYSA-N 473.622 0.706 50 20 JCGD CN(CC(=O)N1CCC(N2CCC(NC(=O)c3ncc[nH]3)CC2)CC1)NC(=O)NCc1ccccc1 1834033781 TXGNAFDKFDOFLR-UHFFFAOYSA-N 496.616 0.941 50 20 JCGD O=C(CCN1CCOCC1)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1834638517 PKZNBKWVUVJPOL-SFHVURJKSA-N 463.392 0.971 50 20 JCGD O=C(/C=C/C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)NCc1ccco1 1835805244 HVIKAGVFXIHUSN-RTLBZRNLSA-N 466.966 0.623 50 20 JCGD O=C(Cc1ccc(F)cc1Cl)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927134 IBUJXJJMURQZCM-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD O=C(CCc1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836105716 RPFGIVWHBFOAOU-SANMLTNESA-N 491.353 0.551 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)CCO2 1836800240 LIKQBIXQSNVSHR-HSZRJFAPSA-N 493.511 0.889 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921121 BRKYJPHQPPODIT-SFHVURJKSA-N 480.374 0.874 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1838471481 PWEUFRRGLIHJHQ-MGPUTAFESA-N 451.911 0.418 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(C)(C)C)C2)C1 1838528321 QWYVHKSHCVBNIY-QHCPKHFHSA-N 492.529 0.978 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1838569485 VGJJAIRNDWJMNS-OAQYLSRUSA-N 499.358 0.691 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(N(C)C)cc1)CCO2 1838964070 OMFWCCQAHPEUML-QHCPKHFHSA-N 461.563 0.196 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)OC(=O)NC(C)C)CCO2 1839074709 ZNPAZRLFEXHPBP-YWZLYKJASA-N 463.959 0.610 50 20 JCGD O=C(c1nc[nH]c1[N+](=O)[O-])N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200749 MBQFKKUPEGAPPO-YGRLFVJLSA-N 450.221 0.078 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839203717 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CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)c1cocn1)C2 1843428830 SLKPJKQQAWZDLO-SFHVURJKSA-N 498.345 0.307 50 20 JCGD CCn1nnc2c1[C@@H](C(=O)N1CC[C@H]3[C@@H]1CCN3C(=O)[C@H](O)CCl)CN(C(=O)OC(C)(C)C)C2 1847556835 QEIMJFIIKZHARV-QSPRXWTASA-N 496.996 0.934 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1 728206027 QJUZMUDXDXUVPP-UHFFFAOYSA-N 464.500 0.394 50 20 JCGD Cc1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1N1CCNC1=O 728335807 QGQSIEATPKIDRS-GOSISDBHSA-N 454.439 0.669 50 20 JCGD O=C(CN1CCN(Cc2cc(=O)n3ccsc3n2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 745981070 LFNDWHNBHIBACZ-UHFFFAOYSA-N 471.499 0.243 50 20 JCGD CN(C)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1I 746001870 XSLWURYVFDURMA-UHFFFAOYSA-N 482.300 0.228 50 20 JCGD C[C@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 856531896 KCWSSEHSOXFBHI-HOJAQTOUSA-N 455.559 0.910 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1 915776457 VYUJSMMOYNBCCA-UHFFFAOYSA-N 472.527 0.683 50 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NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)c3ccccc3)[C@H]2C1 1786341926 GBIKHPAOYBTPGK-SNRMKQJTSA-N 451.483 0.161 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C1)CC2 1786983929 WSKISPIREVEUPM-WRVHCEFRSA-N 492.381 0.773 50 20 JCGD Cc1ccccc1OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610468 ADEXWKKIPTZUTF-LRQRDZAKSA-N 467.526 0.666 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)cc3F)[C@H]2C1 1790081243 OCQINPLXUCOGSR-KHDYIWLOSA-N 457.462 0.437 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3COCCN3C(=O)OC(C)(C)C)C[C@@H]21 1791253968 GHFLTTNSLVOLDM-ATIWLJMLSA-N 489.997 0.856 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1791581333 TUECNNRSIAYMSJ-OWSLCNJRSA-N 463.604 0.915 50 20 JCGD O=C(Cc1ccc(Cl)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1792754840 XBSRAWNYOGHIKK-VPTLXERWSA-N 460.698 0.605 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@@H]1CN(Cc2ccccc2)CCO1 1797247039 PJTBPXVIPMJKIT-WPVAHCMFSA-N 451.951 0.077 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2cncc2c1 1797504329 SQGVJNWJNGJFNG-KEMUROEHSA-N 463.498 0.672 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)n1 1797749855 ZDPSWPFAQXFEKO-ZSBFGKGUSA-N 455.519 0.154 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)[S@](=O)c1ccccc1 1797754029 PLJNYHFWGUEQFU-AUXQGXHRSA-N 485.566 0.085 50 20 JCGD COc1ccc2[nH]cc(/C=C/C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)c2c1 1799387322 WZBKYLPRZOJGIY-XDKWTVRRSA-N 489.337 0.773 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1ccccn1 1800206464 MVURVMMGCZGAFO-JBXGNFEISA-N 467.364 0.963 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1 1801010552 GFDLXZAVSQAIGE-OVAYMDPCSA-N 458.559 0.761 50 20 JCGD Cc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1[N+](=O)[O-] 1801012616 RXFMBOOKAZDZLW-FAQVEIGNSA-N 461.519 0.408 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1 1807373374 AKZISDNKVOGFQV-GHTZIAJQSA-N 476.346 0.741 50 20 JCGD Cc1cnc2c(C(=O)N3CC[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)cnn2c1 1807373891 DGBYKKGNFXHNCB-SIKLNZKXSA-N 484.325 0.746 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2cncnc2)[C@H]1c1cccnc1 1807508427 LCIJJDNQPLMZNV-AUSIDOKSSA-N 453.547 0.883 50 20 JCGD Cc1nc2ncccn2c1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1809303075 VORFBSWOYQWSMN-UGKGYDQZSA-N 484.325 0.746 50 20 JCGD Cn1nc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cc1O 1810299427 PSSFCSYSYPNQBD-LIRRHRJNSA-N 464.486 0.153 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@@H](O)Cc1ccccc1 1812769097 BDPFIIKFMDUYEV-XWGVYQGASA-N 473.338 0.685 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2)[C@H]1SC(=N)NC1=O 1817257330 PBPCDISHFMUOMI-FEUHOPSXSA-N 481.604 0.231 50 20 JCGD COCCn1nccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1817586565 IPVALRKROMYTLL-HNNXBMFYSA-N 469.332 0.205 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1818123713 HHJSTQCUFOYLBI-YVEFUNNKSA-N 456.507 0.581 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCC4)sc2C1)c1ccc(B(O)O)cc1 1819127110 KCKYYFVRXIKMEU-OAHLLOKOSA-N 465.344 0.895 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H](O)Cc1ccccc1 1822078765 COCMYLOHVVBEJS-NHCUHLMSSA-N 462.315 0.999 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)NC(=O)OC(C)(C)C)[nH]n1 1822415078 AEILNSGUQLWJFZ-RDTXWAMCSA-N 481.554 0.618 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCc4nc[nH]c4C3)sc2C1 1826622721 LHSZYSWKYYSJIE-NWDGAFQWSA-N 480.554 0.896 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1 1830539864 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O=C(CN1C(=O)CNC1=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1837046351 CDOIZKOJCGGJIR-OAHLLOKOSA-N 463.304 0.227 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C\C(=O)NC3CC3)CCO2)C1 1837247022 KYOOMHJJJGONFS-ZWXCXDBRSA-N 458.353 0.309 50 20 JCGD Cc1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1837362313 KATYSZYOXOHDHG-UHFFFAOYSA-N 467.530 0.710 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4occc4c3O)C2)C1 1837459580 KWLOGXPOOCFLAP-XMMPIXPASA-N 495.492 0.521 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1837479720 QCNUDCGVLFLBJA-KSSFIOAISA-N 456.341 0.518 50 20 JCGD CO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528172 JMVACSPBJRDWLJ-SPLOXXLWSA-N 465.459 0.625 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C#N)cc(OC)c3)CCO2)C1 1838583506 HGPIULJIJXYLHH-NQIIRXRSSA-N 451.907 0.891 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)C#N)C2)C1)NC(=O)NCc1ccccc1 1839054448 ZWPWMIHAVBGCBY-DEOSSOPVSA-N 486.573 0.339 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839155240 PELBCLINUKLIHL-SQNIBIBYSA-N 455.335 0.295 50 20 JCGD Cc1cc(F)c(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839457882 HXGGNBIRJGIGNG-QHCPKHFHSA-N 489.479 0.656 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)nc2ccc(Cl)cn12 1839603550 PYJGSIPUIAUZRV-QRWLVFNGSA-N 471.341 0.966 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840009257 WLKOCTLKNLZDGX-AHWCRGGASA-N 487.981 0.300 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1840031113 GBOCPECNRPXRGM-KQHSUYLTSA-N 499.362 0.233 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)C1 1840031668 YXZZONMXSBNGNR-KKSFZXQISA-N 497.390 0.772 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1840034297 HOCPTMOIWSOVGK-XPTSAGLGSA-N 470.246 0.677 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)n(-c2cccc(=O)n2C)n1 1840188235 YMMDAPZUPVASHN-NRFANRHFSA-N 498.367 0.753 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846198072 FJEUVYRUBSZIGT-LJQANCHMSA-N 471.363 0.973 50 20 JCGD CC(C)(C)OC(=O)N1CCC(F)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)CC1 1847286056 DBUQZBPXUUNGDF-OALUTQOASA-N 489.353 0.921 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCN2C(=O)COc3ccccc32)cc1OC 17989190 RULTZHQXCVUNSA-UHFFFAOYSA-N 457.439 0.824 50 20 JCGD CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1 20910772 KKNPQZQGNFYPBM-UHFFFAOYSA-N 469.545 0.545 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc(F)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1 725960865 VZARKHRQEIKZOY-SJORKVTESA-N 474.401 0.314 50 20 JCGD COc1ccc(CC(=O)NNc2nc(-c3cccnc3)no2)cc1S(=O)(=O)N1CCOCC1 728078734 SCKXVCYZMPERIO-UHFFFAOYSA-N 474.499 0.847 50 20 JCGD O=C(NCCCN1CCN(c2ncccn2)CC1)NNC(=O)C1CCN(c2ncccn2)CC1 728943711 CCBMQHTYYVOAEU-UHFFFAOYSA-N 468.566 0.026 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Cn1cnc2scc(-c3cccs3)c2c1=O 729274886 GQCHDYBQNVABJF-SECBINFHSA-N 455.543 0.272 50 20 JCGD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1 729531255 IEHOFRCMFPJJGR-SFHVURJKSA-N 456.532 0.859 50 20 JCGD CC[C@@H]1Nc2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2NC1=O 729717667 IFOPTNMFPBCPQH-UGSOOPFHSA-N 454.439 0.973 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2cn(-c3ccccc3)nc2-c2ccncc2)c(=O)n(C)c1=O 730568930 GRERTOFSAQCPOE-UHFFFAOYSA-N 476.522 0.969 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@H](C)C2)c1 744446653 HIXLLUBUVNGHBR-TXEJJXNPSA-N 460.940 0.424 50 20 JCGD CN(C)C(=O)COc1ccccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 746198489 ARURQKUYBZBESN-SFHVURJKSA-N 457.439 0.298 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)C(=O)N3CCCC3)c2c1 748241253 QTVMWIAAIGWSLT-UHFFFAOYSA-N 463.516 0.354 50 20 JCGD C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 750541870 BFBHVFUWWCSIHC-WBAXXEDZSA-N 476.555 0.796 50 20 JCGD CSCC[C@H](C(=O)NNC(=O)CNC(=O)c1cccs1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 751208621 GYLRYPDBRQEPLR-MELADBBJSA-N 466.585 0.922 50 20 JCGD COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 751293792 CMNCTDXEFIEFML-UHFFFAOYSA-N 451.443 0.211 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)cc1OC 769572446 CSJVBTALORSBCZ-GFCCVEGCSA-N 455.464 0.736 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1 769684982 BYPPBDJINFBOTN-UHFFFAOYSA-N 476.511 0.424 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1 770424311 LDCVHCXUUOJFBX-OAHLLOKOSA-N 464.500 0.925 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccccc2Cl)CC1)c1ccc(-n2cnnn2)cc1 807135549 KOGFYPXIOHVDRI-UHFFFAOYSA-N 490.933 0.677 50 20 JCGD COc1c(F)cc(CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1S(N)(=O)=O 915637403 ZDOUFTQGCXVILJ-UHFFFAOYSA-N 463.447 0.377 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 915775479 CJLAWKZIJYLRRV-UHFFFAOYSA-N 487.538 0.886 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(Br)c(C(=O)O)c1)c1ccc(-n2cnnn2)cc1 916105786 IFRBLFWEBHQWDS-UHFFFAOYSA-N 467.261 0.746 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@@H]1CCN2CCCC[C@@H]12 916638400 FXAIXBNEQFIYCR-MSOLQXFVSA-N 451.549 0.278 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)Cc1c(C)noc1C)N(S(C)(=O)=O)CC2 916829374 IIWHQPVGXMRGGT-QGZVFWFLSA-N 480.543 0.948 50 20 JCGD Cc1cc(C)c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(C)c1NS(C)(=O)=O 917727274 BGSARKMSTIEXBN-UHFFFAOYSA-N 479.544 0.582 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NC1CCN(CC2CC2)CC1 918084029 SMQRPAZSNRITST-UHFFFAOYSA-N 493.630 0.845 50 20 JCGD CCCS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 919810520 IUCGJKCRKPUIEG-UHFFFAOYSA-N 453.542 0.751 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1 920425182 KDFISTHLEJGYPU-UHFFFAOYSA-N 452.445 0.742 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1778089927 JUXWYZJCYKNMBB-FRFSOERESA-N 484.388 0.616 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1779321119 YQAFJEYZVADADR-DWVIIIMKSA-N 476.480 0.853 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1780326831 FJIKODALFVRTAE-NRFANRHFSA-N 459.695 0.181 50 20 JCGD CC[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559017 TVSZECBCXCSZPB-DCLXLUIPSA-N 475.590 0.617 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCO1)CCO2)NC(=O)NCc1ccccc1 1780968336 IVRKZGDEANKVFI-CVDCTZTESA-N 459.547 0.342 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCCCO1)CCO2)NC(=O)NCc1ccccc1 1780968938 KQMRMXXHLZSAAC-HYBUGGRVSA-N 473.574 0.732 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1781022834 KZFFEQMIJJRXFC-QFIPXVFZSA-N 476.534 0.042 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1781229680 HPJHJRAEMMTGQS-WBAXXEDZSA-N 453.319 0.547 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1781230577 VULGKAFERHAQHJ-RTBURBONSA-N 458.346 0.696 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1782563648 CFYVYEBWDKNEGZ-KUHUBIRLSA-N 454.369 0.946 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1784341640 KWQSGQHLSWYFLK-QAETUUGQSA-N 457.955 0.743 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Oc3cccnc3)C2)C1 1784547751 SPMKCFAFUSOJGG-LVPNSNHYSA-N 468.514 0.813 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCS(C)(=O)=O)C2)C1 1784741267 HTXDJPWLPRYORW-IFXJQAMLSA-N 481.999 0.383 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCNC(=O)C3)C[C@@H]21 1785079476 NOCPJXDYUFNRPN-XAJHFOFHSA-N 486.997 0.624 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncn3-c3ccncc3)[C@H]2C1 1785754642 XWMDWJPRXOIEJU-QRFRQXIXSA-N 469.546 0.234 50 20 JCGD CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)c1F 1785793167 IMLMYKKSWFKETI-XEDDXIFXSA-N 473.509 0.839 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)c3cccc(Cl)c3)[C@H]2C1 1786885198 LVLHZDMNQWQRBY-DSYPUSFNSA-N 486.960 0.632 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4[C@H]3O)C[C@@H]21)c1cccc(B(O)O)c1 1786982848 IVBZWRGIDOPDMS-KGZUAYNTSA-N 478.354 0.256 50 20 JCGD CN(C)[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)c1ccccc1Cl 1786984956 CQGHUCKXCTUFHR-NWZJSZKRSA-N 499.804 0.916 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4nc[nH]c34)[C@H]2C1 1787298528 WGBJMYJKAYEBPB-IXDGSTSKSA-N 463.498 0.469 50 20 JCGD O=C(CN1C(=O)CSC1=S)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788150439 YQEDRYGEBZWMFZ-UHFFFAOYSA-N 483.380 0.974 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)n(C)n3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724844 PLBTYFAVUFYUGS-BJLQDIEVSA-N 499.572 0.065 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C[C@@H]1CCOC1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792978305 POLSCGMWXGGHMZ-MNWMBMHPSA-N 489.997 0.496 50 20 JCGD CN1N=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)CCC1=O 1793784653 AIGXAACUFDICTR-YXPYIKCWSA-N 485.969 0.316 50 20 JCGD O=C(C[C@@H]1NC(=O)NC1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1793945650 RSNLQBILGIGNIW-RIUYPTKQSA-N 493.358 0.180 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccccc1)NC(=O)NCc1ccccc1 1795058303 YIJWTASMWXKUSF-IUTQVRIDSA-N 493.564 0.805 50 20 JCGD COC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1795130933 NUCZRPSDHYVXNH-LOUJCGABSA-N 461.943 0.661 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(F)(F)F)c[nH]1 1796547165 RINOMMNQKAPPEE-CULMDFNYSA-N 466.420 0.549 50 20 JCGD COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1OC 1797748571 JAGXQPOUMNSEQH-GPVSGQMNSA-N 497.552 0.538 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)cc2NC1=O 1798439774 DFJCMZLRAPCFTI-HNKHHVNMSA-N 478.509 0.970 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOCCOCCOCCOC 1799382667 DWHJNZAIEWHDPI-DMUMMCEESA-N 464.987 0.680 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cccc([N+](=O)[O-])c1=O 1800282313 SWBGRPVYNMJLLB-ZSBFGKGUSA-N 452.540 0.198 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCO1)C2 1800978642 XZLRYPNBVYZRHS-RZFLPCETSA-N 489.997 0.856 50 20 JCGD NC(=O)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1802164640 YOWRRWBKVMVMHQ-JYYAWHABSA-N 453.337 0.251 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1=O 1807375028 KSTDUPMLNHPITD-HTAPYJJXSA-N 498.304 0.530 50 20 JCGD Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1 1807531552 ANENPJXCWZUMJV-UTKZUKDTSA-N 465.344 0.484 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808439162 IFHTXJWOFZSZBM-SIKLNZKXSA-N 465.315 0.590 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)C1 1809968478 YOLYKSCJAFAGAV-RTBURBONSA-N 456.348 0.801 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)N1C[C@@H]2C[C@H]2C1 1810303310 SZMISWMQPJBHJV-ZQWWELHWSA-N 477.569 0.740 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2c3c(nn2C)CCC3)[C@@H]1c1cccnc1 1812226737 CHMSDYFMRKHIPK-VGSWGCGISA-N 467.574 0.996 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1 1812388929 UWKDSENOYYEUTC-IVMMDQJWSA-N 469.336 0.661 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)nc3sccn13)CC2)c1ccc(B(O)O)cc1 1815343849 SCUDUCAXYSDEDA-ZDUSSCGKSA-N 495.351 0.432 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CC(N)=O)CC2 1817275777 CRIWSJWVYBWUTO-UPBICYQTSA-N 459.532 0.701 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cn[nH]c3cn2)[nH]n1)c1cccc(B(O)O)c1 1817476548 WLPNYEKJOSQCPL-LJQANCHMSA-N 459.275 0.981 50 20 JCGD 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O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cc3F)C2)C1 1835926601 UMALSHJKRSBMFR-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1 1835939429 QHOBUOSUBPYDMB-RUZDIDTESA-N 482.342 0.376 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn3cncc3c1)CCO2 1837078864 XYAYSLOIIXWGIH-VNSNFZHPSA-N 493.524 0.538 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)CCO2)C1 1838484062 XMODVNWZKCIQSP-HXOBKFHXSA-N 489.960 0.894 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)C1 1839109245 YRXZHHIFHRWRMJ-OHNQJVKOSA-N 479.933 0.205 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1839146450 OTKOBUXYCOEPBY-IERDGZPVSA-N 479.921 0.766 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839685106 GHCHBNSWMBVFSN-WQGACYEGSA-N 455.277 0.695 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 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O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)c2)CCN1 726867786 UMXFUHCLMOPHMH-UHFFFAOYSA-N 493.567 0.005 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C(=O)Cn3cnnn3)CC2)N(C)c2ccccc21 727390896 AGJJPHQNFVJAGZ-UHFFFAOYSA-N 463.502 0.015 50 20 JCGD CCOc1ccc(OCC)c(NC(=S)NNC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)c1 727496411 NEADBYOZGYLTJJ-UHFFFAOYSA-N 489.558 0.639 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CC(=O)N(CC(F)(F)F)C3)cc2)CC1 728215211 WXLPATYHCZWGPX-CYBMUJFWSA-N 463.482 0.477 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])ccc1=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 748855288 KQXKNKQCUWRVGY-UHFFFAOYSA-N 474.433 0.976 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(I)cc1)c1ccc(-n2cnnn2)cc1 906441410 IDYRXBPSTOJCAL-UHFFFAOYSA-N 470.252 0.890 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CN3CCCS3(=O)=O)c2)c(C)c1 916097496 HLGRQPBFMKZQPH-UHFFFAOYSA-N 480.568 0.901 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1 916830606 KCHCAARMYDEYAP-UHFFFAOYSA-N 462.484 0.236 50 20 JCGD 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CC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726879 YYBKVSWTEBLVQV-ACRUOGEOSA-N 473.574 0.682 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1 1789873258 SHXZPLGBJGDZGZ-NTLWEQJWSA-N 499.432 0.899 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1 1792792154 SBTRWJSHNVPUDY-UIVXKWKOSA-N 453.499 0.679 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792981568 NEJGNAZNXILSNB-SGQRUEDASA-N 463.934 0.525 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl 1793116697 QWHAYBHXCKEISG-YIDVYQOGSA-N 496.026 0.552 50 20 JCGD COC(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793882703 SILYJJCTIQFFCQ-XFMPKHEZSA-N 462.931 0.064 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]cc1I)C2)[C@H](F)Cl 1796366701 ZRQJUZRFUDZPFE-NJANEAIBSA-N 456.643 0.752 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-n3ccnc3)ccn1)C2 1796441737 WXHOZRJRACUIGY-KFYWAZSKSA-N 490.524 0.605 50 20 JCGD C#CCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C 1796908335 OVHKANHOEXLQIA-LRSLUSHPSA-N 497.401 0.854 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](O)[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)C1 1797120434 JBTJONRDPKIOIC-ZQNQSHIBSA-N 480.389 0.998 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798440456 SQZNYWSXEYXVGW-BASYENTBSA-N 490.561 0.477 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cn1C)C2)NC(=O)NCc1ccccc1 1799097138 FBFFOAXNOANQEU-OPMZPASUSA-N 486.548 0.714 50 20 JCGD O=C(/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)NCc1ccco1 1799350420 ZRDJJPZGUJUUSK-UYILKHRDSA-N 458.284 0.732 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C 1799366019 DKOSCVHRVMMTFI-XYFZXANASA-N 478.384 0.635 50 20 JCGD CC(=O)N[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)c1ccc(F)cc1 1799822467 NLYYZHWXUZLBPP-CIAFKFPVSA-N 467.306 0.635 50 20 JCGD Cc1nccn1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1800276519 HOROBZUBZIRLKR-JHDGKUDLSA-N 483.573 0.127 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc([N+](=O)[O-])c1)C2 1801010666 PGJCHQCIANJWIL-FAQVEIGNSA-N 461.519 0.490 50 20 JCGD C[C@@H]1[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)CCN1C(=O)OC(C)(C)C 1801014471 VDMUSDLOKHCXIF-YXZMJPADSA-N 495.621 0.595 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@]1(F)Cl)NC(=O)NCc1ccccc1 1801092258 UYDKWAXBDZIEAV-UGPLMPIKSA-N 481.956 0.847 50 20 JCGD COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1F 1804960341 NDVOGALGPUYIBU-LAUBAEHRSA-N 478.289 0.938 50 20 JCGD O=C(NCC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)c1cccnc1 1806872139 OKGBVSPCZARPKX-UHFFFAOYSA-N 464.331 0.036 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807359957 FXOUPIZLDVKPLM-BPXKWBHBSA-N 474.330 0.372 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCc2cnccn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368007 PKWKYJLAMOSBLP-AUSIDOKSSA-N 459.315 0.504 50 20 JCGD CC(=O)c1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n[nH]1 1807369359 HSJBQDANEUINDU-LAUBAEHRSA-N 461.287 0.321 50 20 JCGD Cc1nnc(CCC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1 1807369736 UBQWABQTLSBUHZ-PGRDOPGGSA-N 479.371 0.874 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807371386 TUTNMKBIKWHANC-LNRPMLKFSA-N 451.288 0.200 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375009 MAQIKBCMFZNGMW-JBACZVJFSA-N 451.332 0.654 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1[nH]nc2ccncc12 1808099839 OLYLCGYHSTTZQG-VGSWGCGISA-N 470.298 0.666 50 20 JCGD Cn1cc(F)cc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808866833 WDJKQIAJUSOUKX-DYESRHJHSA-N 450.279 0.872 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1 1808920052 XILHCUPIONJNQH-NZQKXSOJSA-N 487.325 0.748 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2nc(CO)[nH]c2c1 1809112235 LXWQRVUAANERFO-DVECYGJZSA-N 499.336 0.763 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1 1810303428 RVZJULFOZUZCNY-VGOFRKELSA-N 475.509 0.262 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nc3ccc(F)cn3n2)[C@@H]1c1cccnc1 1812291366 AAWUYDVEGQJKCG-IERDGZPVSA-N 482.520 0.956 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812715952 AXXZCEQQBMFFTB-ZVZYQTTQSA-N 457.369 0.157 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1CCc2nc[nH]c2C1 1813324247 QCDGOYNXTYWWJS-BVZALQNUSA-N 473.342 0.609 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CC2(O)CCC2)[C@@H]1c1cccnc1 1813636133 XSSGRWKTJLEFHW-JXFKEZNVSA-N 452.515 0.705 50 20 JCGD COc1cccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815336804 FJGJJKTVQNOGNO-MRXNPFEDSA-N 466.328 0.695 50 20 JCGD Cn1ncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1Cl 1815361045 SKXMYHRVTKBWEC-LBPRGKRZSA-N 459.724 0.749 50 20 JCGD C[C@H](Cn1cccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1816015388 VJZMXSANNSLWTN-BEFAXECRSA-N 450.308 0.928 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CS(=O)(=O)N3CCCC3)sc2C1 1817277169 ZWWYNPXYLZIIGW-NEPJUHHUSA-N 464.997 0.735 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)C1 1817474186 PDYRQVGWYHMIAU-GPMSIDNRSA-N 468.319 0.985 50 20 JCGD Cc1cc(C(=O)NCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)no1 1819466549 QWFHUOCCTSBHBY-SFHVURJKSA-N 480.290 0.122 50 20 JCGD Cc1ncncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797801 KOAGDAUQSALJOS-LLVKDONJSA-N 452.500 0.780 50 20 JCGD COC(=O)C12CC(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3ccc(B(O)O)cc3)CC4)(C1)C2 1825554082 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CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2C(=O)C=CC2=O)CC1 1831871451 SJNJTTIVHIXLQK-SFHVURJKSA-N 461.563 0.294 50 20 JCGD O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2 1832500222 RMFQHYRBIGCKMJ-GJYPPUQNSA-N 473.295 0.973 50 20 JCGD CCc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1Cl 1833595849 HDRMZZWCFFJKLK-NRFANRHFSA-N 484.985 0.079 50 20 JCGD Cn1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)cn1 1834168621 TWAOOMFCAHXXLT-HRAATJIYSA-N 485.969 0.622 50 20 JCGD CO[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccc1 1834460753 PNAQLQFRQVEJSK-XMMPIXPASA-N 479.386 0.939 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1=CCCC1)CCO2)NC(=O)NCc1ccccc1 1834683157 NBIRKSVARJWMNN-RUZDIDTESA-N 485.585 0.899 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)nn1 1834824174 UUDAUXGEFQRSNS-GOSISDBHSA-N 458.357 0.888 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)N1C[C@@H]2C[C@H]2C1 1835678158 POVPBAQLKWFZKL-QYZOEREBSA-N 462.639 0.271 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4cccc(Cl)c34)C2)C1 1835938132 MZYOZYFPFDBETM-XMMPIXPASA-N 497.744 0.885 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c12 1835939200 HFTAFDVIKDZDRM-RUZDIDTESA-N 493.325 0.240 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1 1836412635 ORLLZMDHNFAVRT-KGLIPLIRSA-N 450.353 0.695 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836837293 NKLWFYYHYHOKAJ-VWLOTQADSA-N 490.325 0.002 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1csc3c1CCCC3)CCO2 1836898652 UMTRUTOFZHJKPD-DEOSSOPVSA-N 484.383 0.691 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1 1837372607 FNIOXSOVCROCHT-DNVCBOLYSA-N 472.329 0.707 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(s3)CCC4)C2)C1 1837456447 IBWYLNCKKYEWNQ-QHCPKHFHSA-N 485.566 0.619 50 20 JCGD CCC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1cccc1 1837457625 LFTCKDLATAYNHI-RDPSFJRHSA-N 484.557 0.598 50 20 JCGD Cc1nc(N)sc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837893123 VORNSKKUJHUCBQ-UHFFFAOYSA-N 487.586 0.958 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(C(F)(F)F)n1)CCO2 1837932690 PDQQHGHRFZXIQI-FQEVSTJZSA-N 487.479 0.543 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837949372 OWZYHDSSRWMWNS-RDTXWAMCSA-N 471.308 0.418 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)CCO2 1839042645 GTIFWYYKXGDAAS-QHCPKHFHSA-N 494.539 0.826 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(C)CCCN1)CCO2 1839120464 GUDPAWHGSUAUMA-USCONSEESA-N 489.013 0.717 50 20 JCGD O=C(Cn1nccn1)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1839238122 VLDOBZTZHNNXNP-WIYYLYMNSA-N 492.374 0.741 50 20 JCGD O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2 1839960740 LEHTUFOLLVDYGE-JTDSTZFVSA-N 459.312 0.737 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1839987811 IOUBTYQRRUKTMG-FQEVSTJZSA-N 459.616 0.819 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(Cc3ccccc3)C(=O)OC)CCO2)C1 1840083946 JQCNAUZASHTYQE-WMZHIEFXSA-N 497.976 0.965 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccc(Cl)c3)C2)C1 1840183288 XIJJCFNVDKZQLO-JOCHJYFZSA-N 482.965 0.548 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1840187063 UEFFNXXUEJBLMR-XOBRGWDASA-N 496.388 0.882 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1840895744 JPWVBBLWAWJQPJ-MRXNPFEDSA-N 480.406 0.088 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012021 VVNSASNGQGKYRD-HNNXBMFYSA-N 453.279 0.141 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847562890 DFFKXYVVSHJZEM-UJDJNWPZSA-N 457.955 0.547 50 20 JCGD O=C1NC(=O)[C@@H](CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](Br)Cc2ccccc2)N1 1848131458 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CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncsc1Br)C2 1801011504 QTJJHHMBYLRDSZ-GNXNZQSNSA-N 474.381 0.482 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373235 PSKGBYKXQKOZAJ-AVRDEDQJSA-N 459.315 0.538 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376050 RPBAROYHMLJTPU-UTKZUKDTSA-N 470.298 0.666 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1 1808722867 WFJKWKNUFQXXMT-XLIONFOSSA-N 456.551 0.947 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1 1813070609 KBJGFORAXFPGDU-KKSFZXQISA-N 456.503 0.173 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1813073048 FLMRSMOSIMXMKX-FOIQADDNSA-N 492.627 0.321 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1 1815329416 AJJQVRCECOQYBL-JTQLQIEISA-N 461.580 0.951 50 20 JCGD Cc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c(O)n1 1815343633 FXTGSSWPDDKUJX-CQSZACIVSA-N 452.301 0.772 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2C(=O)C=CC2=O)n[nH]1 1815476337 KDABTZZPJLXKBZ-OAHLLOKOSA-N 459.507 0.090 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2)N1CCN(C)CC1 1822692969 SEGABMZBQINMQL-KGLIPLIRSA-N 486.602 0.003 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)C[C@](C)(O)CC(=O)O)sc2C1 1826077631 LSZQKGJBRRZOLA-WYRIXSBYSA-N 455.537 0.044 50 20 JCGD N[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1 1826909194 UBQKDPUEJFGVSJ-VXKWHMMOSA-N 450.348 0.695 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CNC(=O)O1)CCO2 1831576352 JEFKESSNIOXDHI-JZHCSEKISA-N 476.436 0.437 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1831639819 DVNJRRNAMFXOPZ-KHJUTWJGSA-N 482.965 0.857 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCC1(F)F)CCO2 1831715221 HXMLGWLCPMXAAZ-GHTZIAJQSA-N 466.290 0.262 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1833350455 UHCMJUZJWMQBLM-ZWKOTPCHSA-N 491.029 0.433 50 20 JCGD Cc1ncc(Br)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833394335 SFTIOSMWGWVIMG-CRAIPNDOSA-N 476.755 0.822 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cocn3)CC2)CC1 1834308302 DSWBWLVDBPZKRZ-CVKSISIWSA-N 455.519 0.994 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cocn3)CCO2)C1 1834509303 RBDYTNPFILRSHH-NRFANRHFSA-N 474.426 0.892 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C[C@H]3CCCCO3)CC2)CC1)c1ccc(B(O)O)cc1 1834797506 QSFAXATUVGMCTI-JOCHJYFZSA-N 457.380 0.511 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cccc(Cl)n3)CC2)CC1)c1cccc(B(O)O)c1 1834799993 MLBAAQADYQGYSF-UHFFFAOYSA-N 484.793 0.843 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CSc1ccccc1)CCO2 1835094561 RYONRDUZPCATNF-QFIPXVFZSA-N 464.588 0.608 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835118178 DDGJWVBOAYCRBO-GAULPXCLSA-N 486.573 0.811 50 20 JCGD CN(C)C(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1835436344 WVUSVBORNRHATB-UTKZUKDTSA-N 482.375 0.537 50 20 JCGD C[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)O1 1835464975 VTEHWVFECOSUSV-FOIQADDNSA-N 458.563 0.438 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)n[nH]3)CCO2)C1 1835851921 VSDQTNVDFIXDAS-XOBRGWDASA-N 487.941 0.317 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1Cl 1835934241 PZKMSHOZJJXXIK-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1836515994 YTTPHGKZVKLPRK-VQIMIIECSA-N 466.000 0.276 50 20 JCGD Cc1onc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1C 1836988014 NEVRRRKGIMDVMO-UHFFFAOYSA-N 455.320 0.897 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3c1NC(=O)C3=O)CCO2 1837137524 FEAWEKDWVYUDPG-JOCHJYFZSA-N 475.574 0.743 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)Cc3ncccn3)CC2)CC1 1837210392 CAAOQXXINJVDPN-UHFFFAOYSA-N 467.530 0.330 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1 1837459487 RUJZXMXFAVBQLF-NRFANRHFSA-N 474.905 0.117 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)ccn1)CCO2 1837862226 XMMIYBAQRVNGPE-WGLQLPMYSA-N 488.932 0.939 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839465841 QDRWQVWQBTUMGX-QFBILLFUSA-N 457.867 0.279 50 20 JCGD O=C1Cc2cccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Br)C4)C3)c2N1 1839574061 OUEQNIKXPSLIEY-APWZRJJASA-N 470.295 0.942 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccc(F)c34)CCO2)C1 1839620434 LSJJNORUVPHVAP-FOIQADDNSA-N 454.886 0.797 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1840033228 YETXSMBITZMPMT-KZULUSFZSA-N 468.308 0.288 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cc1 1840035704 AWWVVMWLWXXUPS-KKSFZXQISA-N 482.375 0.965 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1840083888 GDBJHOFDIFILJY-MHVFZBBKSA-N 456.898 0.904 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nccc4[nH]ccc34)C2)C1 1840184127 UQHOPZLZKMXRJD-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1 1840437370 JITWRNWTZRIGHC-BFUOFWGJSA-N 457.369 0.819 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840452984 KDWGQFZRCNIOHM-JCKWVBRZSA-N 460.300 0.996 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1 1840498527 PHPGADJSPXKPJP-LPHOPBHVSA-N 456.337 0.960 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2nccn(Cc3ccc(F)cc3)c2=O)C1 1842242857 VLGSGODEAYEGNY-UHFFFAOYSA-N 484.532 0.621 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2 1844265020 LLNZSSVVDGKOSM-UHFFFAOYSA-N 464.442 0.600 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265057 QQHDWCBNXPDEGK-UHFFFAOYSA-N 454.443 0.738 50 20 JCGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C)C1 1846330934 SQDLCNLVQBGHIA-LSDHHAIUSA-N 496.026 0.772 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1CCS(=O)(=O)CC1 1848073625 MFJYPOWXAPIYOM-ROUUACIJSA-N 494.526 0.066 50 20 JCGD C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1=O 25433326 OAWRRJMRXJJSCW-RUZDIDTESA-N 496.543 0.952 50 20 JCGD CN(C)C(=O)c1ccc(SSCCCC(=O)ON2C(=O)C[C@H](S(=O)(=O)O)C2=O)nc1 514280158 KMRAQLKAJPMTOK-NSHDSACASA-N 477.542 0.777 50 20 JCGD CCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)COC3)c2ccccc2c1=O 726379913 VOQUZXCLFKCTSP-UHFFFAOYSA-N 471.495 0.186 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)NC(=O)c1n[nH]c2ccccc12 726381982 KWPHQWHCKWXYEL-GFCCVEGCSA-N 457.516 0.744 50 20 JCGD COCc1cccc(S(=O)(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 727352525 HBVDPCPEFMTDMJ-UHFFFAOYSA-N 497.595 0.796 50 20 JCGD C[C@@H](NC(=O)c1cccs1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 728213650 FBHLMAVILIFMQM-CQSZACIVSA-N 451.574 0.946 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)c1 728528971 QHIPZHYFOYNXRM-UHFFFAOYSA-N 479.291 0.056 50 20 JCGD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c1 751281041 XXVLTNLNEGUCJE-UHFFFAOYSA-N 455.470 0.061 50 20 JCGD O=C(COC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1)NNC(=O)[C@H]1COc2ccccc2O1 914821025 XIOUASABCAEJAD-KPZWWZAWSA-N 475.404 0.848 50 20 JCGD Cn1nc(C(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)c2ccccc2c1=O 917387302 MLGRBUQZIVGOMJ-XMMPIXPASA-N 474.477 0.694 50 20 JCGD CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C(=O)c1ccc(Br)o1 917388334 VOUCKTTUWVDRGN-UHFFFAOYSA-N 487.332 0.826 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccnc(C)n1)N(S(C)(=O)=O)CC2 917393527 OIZOQQKZOFEPQO-INIZCTEOSA-N 463.516 0.512 50 20 JCGD O=C(NNC(=O)[C@H]1CCN(c2ccccc2Br)C1=O)N[C@H]1CCS(=O)(=O)C1 919884371 FBIDZJMKDXURQT-WDEREUQCSA-N 459.322 0.320 50 20 JCGD CNC(=S)NCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091344 XIARTGAWGARRHC-WPXOGLPSSA-N 491.618 0.118 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1 1779030496 AZMKSSMMKCGETQ-JOCHJYFZSA-N 459.453 0.650 50 20 JCGD CN1CCC(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)CC1 1779371525 XLAMQBRFNJEPSA-HYBUGGRVSA-N 472.590 0.545 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1Cc3ccccc3CN1)C2 1779373510 XBOVXSSLTAOOAS-XLGIIRLISA-N 492.580 0.527 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1[N+](=O)[O-] 1781303932 OQNJLVXWFRIFBE-HSZRJFAPSA-N 467.287 0.269 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cc21 1781329878 MMVKFMPVZQMXMV-CXAGYDPISA-N 458.288 0.151 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1782050220 XMGVMKRWAVASIR-HSZRJFAPSA-N 482.302 0.098 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1782568118 PMEUYISNJALYIA-RVWJGDDESA-N 482.476 0.446 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1783343709 PDWAAJONHYNAPR-DNVCBOLYSA-N 453.337 0.815 50 20 JCGD CSCC[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783969224 IOWRYXHHTWTLLG-XXBNENTESA-N 493.630 0.277 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(Cc4ccccn4)CC3)C[C@@H]21)[C@H](O)CCl 1784085169 CSYBNXLSDWIPLK-WJMWBRGCSA-N 464.994 0.873 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ncccc4c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980030 AEJXCFPSOGFLOM-SSPYTLHUSA-N 473.338 0.751 50 20 JCGD C[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)NC(=O)OC(C)(C)C 1787466665 NHHORUCKWLLJJI-OWSLCNJRSA-N 483.610 0.642 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)[C@H]3SC(=N)NC3=O)[C@H]2C1 1787492699 KBRVGKZHBPEOQG-NKTODWNOSA-N 475.409 0.800 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787507620 KDORQNHQKVRULN-WVIPKZCGSA-N 460.535 0.901 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1 1788611296 RRAFOCHOTGUHKE-TZYHBYERSA-N 494.596 0.977 50 20 JCGD CC(=O)N1CCN(CC(=O)Nc2ccc(C3(NC(=O)CCC(=O)NN(C)C)CCC3)cc2)CC1 1789216106 AIXDQHQBOIVZDP-UHFFFAOYSA-N 472.590 0.658 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(O)[nH]3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726631 HCVWVYPERABJJH-LNLFQRSKSA-N 485.545 0.055 50 20 JCGD CC[C@@H](C)[C@@H](N)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726698 NMJYOLFXSFJURS-NSMXDQILSA-N 488.633 0.686 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3COCCN3C(=O)OC(C)(C)C)C[C@@H]21 1791249245 GHFLTTNSLVOLDM-TXTZMMAHSA-N 489.997 0.856 50 20 JCGD COc1cc(C#N)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1 1791291083 YBSSHMSPXRDUQP-VDGAXYAQSA-N 457.531 0.533 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21 1791539875 BEFDBKVEIOCEPU-DFJGONKVSA-N 484.395 0.468 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCO)NC(=O)OC(C)(C)C 1793087827 PYWBZXUNRLFKSN-NIFZNCRKSA-N 478.384 0.635 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)cc1Cl 1793743341 ICQJWCMOUGADCM-USGNIVHTSA-N 454.930 0.984 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccccc1[N+](=O)[O-])C2)c1ccc(B(O)O)cc1 1795736758 FNPIQIFBJPXMET-PCLDGEOKSA-N 465.271 0.191 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cn1 1796080924 OMVKHBUVWSZACZ-AYRXBEOTSA-N 478.340 0.520 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796189652 LYIDUCQHWCVLHG-WKCHPHFGSA-N 489.337 0.233 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1797179273 KMKPQNAXXCIHBO-QKQGURCUSA-N 459.971 0.823 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(c2ccccn2)CC1 1799088821 JEICDALFFMVTJR-BBIADKPPSA-N 472.590 0.261 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C#N)CC1)C2)NC(=O)NCc1ccccc1 1799095102 UAXRQFCLVHIVDN-OPVJXMOQSA-N 454.531 0.226 50 20 JCGD Cc1ncncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097483 MBEPOQXIFGXBMB-HATOLVCRSA-N 481.557 0.334 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl 1799276121 GVANQVPVDVNJQS-WAPIYPGOSA-N 454.351 0.655 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccc(F)cn12 1800062285 LAXKHJLABLQFJF-DFZQMDCHSA-N 481.488 0.811 50 20 JCGD COc1ccc(Cl)c(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1F 1801012454 ZVDQBYSZESAYKE-HSAQVAQVSA-N 484.956 0.993 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)N(C)C(=O)OC(C)(C)C 1801012635 SQNAPYMUGRKBEP-OAFZBRQQSA-N 469.583 0.204 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1801964829 SLDRLUVQMYIANY-YYAJDYIMSA-N 469.583 0.252 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1804348869 GPXVJNXXDWVMIX-OWLYRPNTSA-N 464.526 0.755 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807367413 ZHIOBCKJUXTUAD-SIKLNZKXSA-N 468.388 0.130 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnnc(Cl)c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369381 IFJDRGCASQTUPC-UZLBHIALSA-N 465.706 0.838 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375824 VOCNVSVSLYLJSJ-QPPBQGQZSA-N 499.373 0.151 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376000 ROCLNVBPRYMKHZ-NVQJOJJJSA-N 463.347 0.553 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(c2)CNC3=O)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376003 RAODPDARMXYZOC-WMZHIEFXSA-N 484.321 0.638 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2c(n1)OCCO2 1808189113 VOCPVVCLGFHMRM-GCJKJVERSA-N 488.309 0.561 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1 1808416546 BEPDDBIPHGQLCW-ODZZAOHFSA-N 492.544 0.555 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc2ncccn2n1 1809763530 MPYKTHQLYWGMQS-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809977670 BUQWMKOFPIZDRX-NRFANRHFSA-N 450.348 0.176 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810309095 OZOGJCAGXVNJLL-OXJNMPFZSA-N 475.509 0.621 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC(=O)N(C3CCCC3)C1)CC2)c1ccc(B(O)O)cc1 1815336813 FRGCGNFQIAQAMO-DOTOQJQBSA-N 496.398 0.840 50 20 JCGD NC[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1ccccc1 1815339610 JWKSEWJXCRXXOV-ZWKOTPCHSA-N 464.356 0.791 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1 1815364546 WJXVFIAUKUUWQI-SFHVURJKSA-N 492.366 0.787 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CNC(=O)C2)n[nH]1 1821961560 JBFQRCOFRXHZJD-VNURZQNYSA-N 454.491 0.672 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060211 SJSHTHHRUORUFY-FGZHOGPDSA-N 457.380 0.905 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CS(C)(=O)=O)C2)C1 1830535872 VQNXWOHVRJFCHZ-KEYYUXOJSA-N 469.398 0.155 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1830543959 JOLJUJOKZARDPA-IFXJQAMLSA-N 471.352 0.602 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)C1 1830736941 CAIKERLLFGUVNC-GSHUGGBRSA-N 489.997 0.690 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn(C(C)(C)C)n1)CCO2 1833590230 HTDKRZSEAAKTHU-JOCHJYFZSA-N 464.567 0.081 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccno1)CCO2)NC(=O)NCc1ccccc1 1834153424 QQDGJKWWXWNBRQ-HSZRJFAPSA-N 486.529 0.091 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnn4ccccc34)CC2)CC1)c1ccc(B(O)O)cc1 1834798594 OGGCACIMUBLPHK-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cccnn3)CC2)CC1 1835117820 NFFWPGFIRIMDJI-JVWAILMASA-N 466.546 0.796 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835734350 CAADZFHMKINALU-OAQYLSRUSA-N 471.606 0.355 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C(F)(F)F)o1 1835929262 HWTVOSXTRRVTAY-NRFANRHFSA-N 496.247 0.670 50 20 JCGD CCOc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cnc2c1cnn2C 1836376688 GJEQGUPNRLVSLI-JXFKEZNVSA-N 469.901 0.971 50 20 JCGD CN1CCN(CCC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)CC1 1836412479 IERONMRIKHOMJS-IBGZPJMESA-N 476.435 0.886 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2 1836626346 JRWWQOGNYHIDTF-SFTDATJTSA-N 499.490 0.673 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836775714 ARNNHKINBWZBOO-VLIAUNLRSA-N 498.378 0.118 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn3ccnc3c1)CCO2 1836983822 DMORUICCKCTDFV-FXZATJRASA-N 493.524 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4sccn4c3)C2)C1 1837457500 FWNQHBHZSAAFDG-JOCHJYFZSA-N 484.538 0.383 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc(O)cn3)CC2)CC1 1837586489 YJRLZVLXWMCHEO-UHFFFAOYSA-N 453.304 0.393 50 20 JCGD COc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)ccn1 1837921325 ZSLNJFXMVRSUOG-UHFFFAOYSA-N 467.331 0.696 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838394774 VVARGQSAVQQHNO-UHFFFAOYSA-N 482.541 0.310 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1 1838498353 KQPDELSXGHKDFX-KKSFZXQISA-N 463.922 0.796 50 20 JCGD O=C(c1nc2ccc(F)cn2n1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839624484 JUUDCKRTJJKYIJ-GUYCJALGSA-N 474.262 0.629 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1839967512 OOOZTADRWOBYNG-WBMJQRKESA-N 462.370 0.527 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1 1840030715 UQOLLGKBHNEDTN-KUHUBIRLSA-N 466.336 0.671 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1840033334 ARMUCXPHSKUCNC-YCRPNKLZSA-N 495.374 0.580 50 20 JCGD CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840087724 OQQJDQDRKHEJAJ-HYFFOGBASA-N 492.013 0.982 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1 1840153205 HMZGUNVGHXPCGR-HRAATJIYSA-N 463.922 0.796 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(=O)Nc3ccc(F)cc3)C2)C1 1840154366 VOOJGZGFUHHONQ-LAUBAEHRSA-N 471.913 0.865 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1 1840266627 YNMBMBUWKHOGES-QTPRHWQCSA-N 497.552 0.915 50 20 JCGD Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1Cl 1840691312 FKPGFSDYFQBVFI-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)CC1 1840817898 AGFLISPWFNPMAS-DYESRHJHSA-N 475.970 0.565 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840881732 LJCFXPOMQVRCEQ-PFKNGNAYSA-N 475.970 0.346 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)N1C(=O)OC(C)(C)C 1841011233 JFZFVSQCZHXBAV-LPHOPBHVSA-N 471.363 0.971 50 20 JCGD CC(C)N(CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)C(=O)OC(C)(C)C 1841119421 PLESJXQFUGOULJ-UHFFFAOYSA-N 459.352 0.829 50 20 JCGD O=C(Cn1ccc2sccc2c1=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1848181525 QYZAIFVNXHXPBJ-ROUUACIJSA-N 451.313 0.258 50 20 JCGD O=C(NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)[C@@H]1CCS(=O)(=O)C1 18946193 WSVGWMZIWWEMJZ-LLVKDONJSA-N 497.020 0.113 50 20 JCGD Cc1cccc(OCC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1 725909057 AIQUABBGKHFTAG-GOSISDBHSA-N 483.568 0.303 50 20 JCGD C[C@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N1C(=O)NC2(CCCC2)C1=O 726523255 HGRHVSFOEPLZTG-CQSZACIVSA-N 477.543 0.485 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)c1 727723253 UPAXKVBSLCWXDL-UHFFFAOYSA-N 473.515 0.951 50 20 JCGD COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1 729274895 GVMJSPRMVHKFDL-LBPRGKRZSA-N 470.529 0.195 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1OC 770416930 FYFDWKYWODSTBQ-UHFFFAOYSA-N 465.484 0.605 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)cc2)cc1 913500074 LNEUXCFDPKQFOC-UHFFFAOYSA-N 486.547 0.271 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)c1 915107459 CVFCFHQKZADVKL-INIZCTEOSA-N 451.549 0.626 50 20 JCGD CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1 916639489 KGLZOIGGGRMORH-UHFFFAOYSA-N 497.574 0.551 50 20 JCGD Cc1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n2nc(C)cc2n1 916741276 SYOWPXSIRDXFTA-UHFFFAOYSA-N 486.554 0.761 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1 916830505 CPQHYTZJSCQVRI-UHFFFAOYSA-N 461.500 0.408 50 20 JCGD COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)cc1 919886867 XAYGTZSRMPSGCW-HNNXBMFYSA-N 482.540 0.627 50 20 JCGD O=C(Cn1nc2n(c1=O)CCCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 1317799450 IWRLHMJILBMBLO-UHFFFAOYSA-N 462.532 0.017 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1778165959 HRETZMZNWIAHJA-VBKZILBWSA-N 465.348 0.953 50 20 JCGD Cc1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779030600 DCPZZHJKTXFPDC-HSZRJFAPSA-N 453.499 0.516 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(Br)CC1)CCO2 1779037190 SZSYDKOYDKNXJK-KRWDZBQOSA-N 452.309 0.056 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3=C4c5ccccc5C(=O)N4CC3)C2)C1 1780008205 IYHXNPDVZKTPIY-VWLOTQADSA-N 481.553 0.460 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC23CCCN2CCC3)C1 1780666900 UKHLXLHDRYOBBJ-HYBUGGRVSA-N 484.601 0.831 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1780905413 UWKXHLQYGDQRCW-OWJWWREXSA-N 498.515 0.086 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1F 1781413946 JPFDWRXJWFKDSF-DUXKGJEZSA-N 455.914 0.607 50 20 JCGD O=C(/C=C/c1cccc(O)c1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781846825 YVWLPTWNRGHHRZ-CGSIKTIKSA-N 464.327 0.913 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@H]1NC(=O)NC1=O)C2 1781901529 PDVDGEFNAVSIQP-SJBDTSRBSA-N 459.341 0.272 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCS(C)(=O)=O)C1 1782713708 MNELFHWTQLWKFJ-JJRVBVJISA-N 453.399 0.966 50 20 JCGD CC(C)(C)OC(=O)N1CCc2nc[nH]c2[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1782849525 HOVOTTDEHPAXMQ-ZDPZECHZSA-N 497.980 0.674 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)CC[C@H](N)C(N)=O)CCO2)C1 1782864511 NFLBLTVNVWGAGU-RTBCXJIMSA-N 461.469 0.294 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CC[C@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)[C@H]2C1 1783475713 XQFDAPBFKMFMPV-XRGQIBNMSA-N 487.981 0.298 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(C#N)nc1C(F)(F)F)CCO2 1783933941 OKSRTKFRACVEBP-FQEVSTJZSA-N 482.463 0.789 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1784373494 OEAQMYFXMZPNBV-MNEFBYGVSA-N 460.362 0.523 50 20 JCGD O=C(COc1ccc(Cl)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784421504 HSZBJWRJBHIVLA-XERREHJYSA-N 490.724 0.831 50 20 JCGD Cc1ccc(C)c(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1785008214 PTNNWVSQKJHFPN-RRPUWOKSSA-N 466.343 0.656 50 20 JCGD O=C(Cc1ccc(Cl)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1786540424 NEPFIZWKLYYUCZ-YYWHXJBOSA-N 456.735 0.856 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C[C@@H]21)c1cccc(B(O)O)c1 1786983732 XVDWXBCXCSPCSO-MHADKKCISA-N 477.326 0.153 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)nc3)C[C@@H]21 1787508693 OVBVZMMWPORMRR-RNGGJZMBSA-N 454.487 0.515 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610558 GGFWFHJUXUXRNM-KKXDTOCCSA-N 472.933 0.949 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(-c4cccnc4)c3)C[C@@H]21 1788611694 RLWKEMWWUHZWQI-JHVJFLLYSA-N 490.524 0.173 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(=O)NCc3ccco3)[C@H]2C1 1788720798 MWBLVMMVWGCRDZ-ZCTXCFBYSA-N 453.923 0.686 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c([N+](=O)[O-])c1 1789963801 ZCHDVHHVMDCVRJ-IKICRFKJSA-N 455.895 0.725 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc4cnccc34)C[C@@H]21 1791290968 UHPFCKOTRBKMEK-YSSFQJQWSA-N 454.531 0.596 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(Cc3ccccn3)CC1)C2)[C@H](O)CCl 1792975406 QOFJYKPBBYFVKE-PIKOESSRSA-N 450.967 0.483 50 20 JCGD CCOc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cnc2c1cnn2C 1792976923 ODPJOLRYPSMRAK-VZAMPYOESA-N 451.911 0.170 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncn1-c1ccncc1 1794795269 NQCZCJVIBDYVCS-ACHSLPGTSA-N 460.498 0.831 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCc1ccccc1F)C2)c1ccc(B(O)O)cc1 1795733052 YIBYEUFSHQLWNZ-BBIADKPPSA-N 454.307 0.732 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(-c2ccccc2)n1 1796540129 BCIQLIDLFVBSLF-XSLZEOFGSA-N 490.524 0.605 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1797587706 IXGJAXSROSSDPA-CNMWIUBYSA-N 498.374 0.647 50 20 JCGD O=C(Cc1n[nH]c2cc(Cl)ccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799079015 MAFROTNVRHHGHG-YEZVWNJWSA-N 482.733 0.342 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl 1799278838 YYIVKFAJORACSG-VRQAJEBUSA-N 460.362 0.283 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)[C@@H](F)Br 1799344639 PHTMAHJTLDAAFC-ULAWRXDQSA-N 453.158 0.622 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)[S@@](=O)c1ccccc1 1800214232 IOADNRIATOEVAL-ZCRWQLMLSA-N 485.566 0.085 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnc2[nH]ccc2c1 1800846666 RNJINTYHVRHCBP-OPMZPASUSA-N 456.547 0.458 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CN(C(=O)c3ccccc3OC)C1)C2 1800971317 VVJDPPGVZZZZGF-WQDJSCAQSA-N 479.961 0.611 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)C2 1800981454 NHDNEVSZDUJEPD-IZKTWJBDSA-N 475.970 0.200 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C1(O)CCC1 1802465465 JPJLVQFYAXETGB-WRWLIDTKSA-N 466.542 0.951 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1802894161 QUKHBZDYTKZWDC-TWUVWWFLSA-N 488.972 0.867 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2 1804302883 RNXNBGBVWRWKMS-RCJHGTSTSA-N 497.593 0.454 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)C(C)(C)O 1804434666 KCPGGVCDLMVEMN-FCGDIQPGSA-N 489.378 0.282 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCC2(CCCN(C(=O)[C@@H](O)CCl)C2)CC1 1805527120 SHNMGJHDWPRZKX-IBGZPJMESA-N 479.014 0.904 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)CC1 1807087482 ZLMICMFIHBKODV-KRWDZBQOSA-N 494.357 0.218 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc1 1807365891 PSSFLYGABMXSPL-HUVFLSCGSA-N 489.337 0.823 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377277 ZZBFCAABCTWNNT-PXNSSMCTSA-N 486.297 0.143 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809968827 GIZVZJNRRMESOD-UHFFFAOYSA-N 455.280 0.016 50 20 JCGD COc1nccnc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813071277 RPUKKPAPGJIPPW-OXJNMPFZSA-N 455.519 0.573 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C2CN(C)C2)[C@@H]1c1cccnc1 1813608086 ONNLNRLSKDZNFP-PWCMAEROSA-N 451.531 0.783 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822782715 XHFZZXCYBXMIOK-KXBFYZLASA-N 450.308 0.928 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1 1826804257 IPWGTYCJTTXLFQ-LSPPGFKNSA-N 496.505 0.465 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnncc2C(=O)O)CC1 1829254554 HCAASNWBSSZGJC-SFHVURJKSA-N 460.535 0.781 50 20 JCGD CC(C)(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1829569973 RAFOQEBBGLNRIM-RUZDIDTESA-N 496.568 0.761 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CN1CCSCC1)CCO2 1829709718 DBZPELFXYWSMDN-KRWDZBQOSA-N 450.399 0.277 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnn3)C2)C1 1832549563 UXPXZCCVOTUSLY-HRAATJIYSA-N 483.953 0.679 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CN3CC(=O)NC3=O)CC2)CC1 1833265504 ZDZHACYJKWFFEE-ZDUSSCGKSA-N 472.384 0.141 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)cnn1C 1834421609 MWBZVZYSJZZGOQ-HTAPYJJXSA-N 499.996 0.931 50 20 JCGD Cc1cccc(/C=C/C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834798101 SJESHMLELAIOTB-MDZDMXLPSA-N 476.386 0.968 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1cccc1C=O 1834806987 YKKPNVNPQOZRJD-KRWDZBQOSA-N 495.584 0.746 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCBr)CCO4)C3)c(C)n2n1 1834821405 IHCWICRPYYVAMQ-LJQANCHMSA-N 481.351 0.596 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1 1835117105 LIXDXMQWIHDQCW-QGZVFWFLSA-N 452.980 0.518 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C#N)CC1)CCO2 1835340956 KHJDEEBXDCSTJO-BTYIYWSLSA-N 470.954 0.879 50 20 JCGD O=C(c1ccc2occc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930173 AKJYYYHFDYMPOA-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD O=C(c1ccc(C(F)(F)F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931135 GEELXSPRWMQNET-JOCHJYFZSA-N 492.259 0.769 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1Cl 1835933641 FCEKVITZHBKDQX-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc3c(c1)CCCO3)CCO2 1836683182 MIUJOTIDTTXKQX-VWLOTQADSA-N 488.585 0.384 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CO4)CCO2)C1 1836994597 RBIFCJWCYKFQDV-RNODOKPDSA-N 482.331 0.871 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cnc(OCF)cn3)CC2)CC1 1837306821 XNQGQDICQVRLPZ-UHFFFAOYSA-N 486.309 0.388 50 20 JCGD CC[S@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921244 PGYGLOKKMRGBRC-YTTGMZPUSA-N 464.393 0.137 50 20 JCGD CCOc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838886216 KGYKDSKEYSYTKN-HSZRJFAPSA-N 462.547 0.528 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1839148107 MVXSELRAKPVKGL-XMSQKQJNSA-N 450.967 0.857 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1839153165 CLGOFMKWAABGBV-RBUKOAKNSA-N 459.330 0.713 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840142960 FIDIWVNZWPIJGJ-NRTGNBEESA-N 477.327 0.889 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)N3CSCSC3)C2)C1 1840153339 KXSAVWSHXGWDHI-RVKKMQEKSA-N 468.041 0.740 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])C2)C1 1840154425 WXQCTIPKHILHBU-JLTOFOAXSA-N 487.893 0.633 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(=C/c3ccco3)NC(C)=O)C2)C1 1840155212 SUKXSFIURYDBPE-FIMNXLPWSA-N 469.922 0.467 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3occc3Br)C2)C1 1840183966 KWHKFFKCHFKFMW-IBGZPJMESA-N 487.351 0.485 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cc(F)c(F)c(F)c3)C2)C1 1840185358 PIFQMXOJAFZDBO-OJZQOFKYSA-N 498.502 0.947 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2 1840949905 ZNYKSQUSEBHSNH-VXKWHMMOSA-N 479.484 0.501 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)/C=C/C1CC1)C2 1843428932 YOWXASVNRORLMA-ZRFOIIEFSA-N 497.401 0.972 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)[C@@H]2C1 1844265263 LSTXDLRMQPBMQZ-BCDXTJNWSA-N 484.557 0.615 50 20 JCGD C=CCOC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847563663 OKNHADBRIVQKIQ-FXUDXRNXSA-N 488.969 0.593 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cnn(C)c1)N(S(C)(=O)=O)CC2 726102101 IFZGELVDIVXKHW-HNNXBMFYSA-N 451.505 0.147 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1 726254932 ZMVYEUSMZIIXEW-UHFFFAOYSA-N 478.962 0.811 50 20 JCGD Cc1ccc(S(=O)(=O)NCCCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 728330976 WJMLJGHIALGZPF-LJQANCHMSA-N 491.522 0.584 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728856618 YLBRJOOYKBHFTI-UHFFFAOYSA-N 496.615 0.733 50 20 JCGD O=C(NNC(=O)N1CCN(CC(=O)N2CCc3ccccc32)CC1)C1CCN(c2ncccn2)CC1 728958652 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NC(=O)[C@@H]1CCCN(CCCNC(=O)NNC(=O)COc2ccc(Br)cc2)C1 729507834 WVVVRXJWEASFCQ-CYBMUJFWSA-N 456.341 0.746 50 20 JCGD O=C(CNc1ccccc1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O 729513339 KTTQUKAVMYXDRD-INIZCTEOSA-N 458.496 0.883 50 20 JCGD Cn1c(CCC(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)nc2ccccc2c1=O 729988624 JUDCRWVICPHKOF-UHFFFAOYSA-N 453.411 0.779 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)Nc1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 730897084 FIJMKJXIFAUXNL-UHFFFAOYSA-N 468.463 0.784 50 20 JCGD Cc1ccccc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1 731358123 FETIMNVLHYRJAK-UHFFFAOYSA-N 473.511 0.687 50 20 JCGD COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 748697796 VUJRVAPIGGNTNC-UHFFFAOYSA-N 469.564 0.079 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)c2)C[C@@H](C)O1 912920843 FBDFIDFIGVORFY-USTZCAOPSA-N 482.603 0.745 50 20 JCGD O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1nnc(O)c2ccccc12 913580808 QYWMAZFFHWXNSX-UHFFFAOYSA-N 480.300 0.837 50 20 JCGD Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 916124772 LNDNLATXCKLUIH-KRWDZBQOSA-N 450.434 0.613 50 20 JCGD O=C(COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)NNC(=O)c1ccccc1 920634521 DKDPKLYJGFHIAQ-INIZCTEOSA-N 490.494 1.000 50 20 JCGD COCCCNC(=O)NNC(=O)CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21 920862863 XOIYCGJTXLBUOH-UHFFFAOYSA-N 469.520 0.136 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4cncc34)C2)C1 1778683112 GPERESNTMKPACF-LRULAXNGSA-N 463.498 0.912 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371126 GPMMVIYTGCZEDJ-SMTRDTIPSA-N 495.584 0.818 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CS(=O)(=O)N1CCCC1)C2 1780702642 NTCUJNQBGOQDMW-FRQCXROJSA-N 450.001 0.943 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968213 GPESJTJQPWCGMF-YADARESESA-N 488.589 0.963 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2)C1 1781342978 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CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(C)(C)NCCC#N)[C@H]1c1cccnc1 1807151626 WGGBCQQJAVXPQR-WIYYLYMNSA-N 457.579 0.742 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn(-c3cccnc3)c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369307 FUNSXGORPJCXNM-HYBUGGRVSA-N 496.336 0.976 50 20 JCGD O=C1Cc2cc(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)ccc2N1 1809683850 JDPYEDHHXFVYPG-DVECYGJZSA-N 484.321 0.889 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)Cc2cscn2)[C@H]1c1cccnc1 1810301918 DVUPFWHJGYZBBY-XPGWFJOJSA-N 494.581 0.426 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810478274 RUFSYMPMJFYZLA-SYNHAJSKSA-N 477.529 0.328 50 20 JCGD CCOc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1 1811625849 PDIUCUVTTAOAEB-IERDGZPVSA-N 490.524 0.902 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1 1813072297 FCAIHPROBWACPV-VGSWGCGISA-N 453.547 0.917 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)[C@@H]1c1cccnc1 1813073040 LCALXNZMGFVDIH-PWIZWCRZSA-N 492.577 0.304 50 20 JCGD C=CCNC(=O)/C=C\C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1814437193 MMUUMEZIXJMSDV-HJCTWCACSA-N 451.292 0.254 50 20 JCGD CC(=O)c1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n[nH]1 1815337050 JKTCGBMUIMJGST-ZDUSSCGKSA-N 453.289 0.288 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nccc3nc[nH]c23)[nH]n1)c1ccc(B(O)O)cc1 1817471518 QQCOGTGBBPRZDQ-QGZVFWFLSA-N 459.275 0.981 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1822575022 UFWDOEZXOVSVBH-OAHLLOKOSA-N 488.375 0.962 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1 1824182404 AMYDUXRODWXKQT-IAGOWNOFSA-N 450.001 0.631 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C3CC3)C2)C1 1829000328 GOSPNNXWYHCXEM-SANMLTNESA-N 491.353 0.842 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@H]3C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)CC1 1830248763 GWYULGWCIYPQOB-NRFANRHFSA-N 476.666 0.759 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830720044 ROZBVXAPFKOTLW-BIZBXSGISA-N 460.955 0.412 50 20 JCGD Cc1ccc(COCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1C 1830727902 JUJSXYDTBHKXGF-DENIHFKCSA-N 454.951 0.876 50 20 JCGD O=C(c1cc(-c2cc[nH]n2)n2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732421 XWHLUMWMHRWBFK-NFBKMPQASA-N 487.944 0.999 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1831201659 GJVHSUSRKRJQTN-RDJZCZTQSA-N 452.321 0.440 50 20 JCGD Cn1cncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549241 IVNLZYANSODIHW-YCRPNKLZSA-N 485.969 0.622 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc(C)c(C)c1)CCO2 1833297695 RWCAGIGUKVLONA-BYEYKRMRSA-N 482.541 0.902 50 20 JCGD NC[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccc1 1834759630 QSORXMWWDKREPR-DEOSSOPVSA-N 478.402 0.294 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834818704 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C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)[C@@H]1SC(=N)NC1=O 1839152295 VDSKSDZVBCMFCU-UQLKUDODSA-N 481.402 0.482 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCC(=O)N3)C2)C1 1839743352 KTXRDJUDVVFIFB-LHMGHXNASA-N 474.464 0.607 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1839967051 YEMPNXTZAKUDFC-VBQJREDUSA-N 467.382 0.194 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(N4CCOCC4)n3)C2)C1 1840033067 RTSCMWQGEYRRGJ-HRAATJIYSA-N 497.390 0.772 50 20 JCGD COc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1F 1840186781 FKTPMMJXDSUSRY-QFIPXVFZSA-N 466.510 0.277 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840803674 PORPFBXHLLPQTD-AVYPCKFXSA-N 463.959 0.346 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)O[C@H]2C1 1841353886 WHBBUSUZAQDMNG-FPCVCCKLSA-N 457.955 0.814 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)C2=NN(C)C(=O)CC2)C1)NC(=O)NCc1ccccc1 1841864434 NNMCOCCSZOKHPX-UHFFFAOYSA-N 469.546 0.144 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1842810720 AZUOWDMUUALEAT-UHFFFAOYSA-N 471.539 0.148 50 20 JCGD O=C1CNC(=O)N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](Br)Cc1ccccc1 1848033927 HTJFXDNBVRPQTE-JYJNAYRXSA-N 463.332 0.746 50 20 JCGD COc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)ccc1OC(=O)c1ccncc1 730569136 PJUBRJJHVBOLIS-UHFFFAOYSA-N 484.494 0.344 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)c1cccs1 750226821 ZVUCCONGTLLLLH-UHFFFAOYSA-N 482.359 0.855 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc4ccccc4n3)c2)CCN1 906309854 WRRDQIVYNWFZJN-UHFFFAOYSA-N 453.480 0.430 50 20 JCGD O=C(CCOC[C@@H]1CCCO1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 915636558 VFWANRCISYMLLO-SFHVURJKSA-N 469.560 0.373 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCc1c[nH]nc1C)N(S(C)(=O)=O)CC2 916578842 YEGNPIOLMFUQJU-INIZCTEOSA-N 480.547 0.515 50 20 JCGD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 917289146 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnnn1C)CCO2 1780095639 RUGNMECENMOGCN-FQEVSTJZSA-N 458.431 0.406 50 20 JCGD CSc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1O 1780151216 IIHFDLPJNLKLKJ-QFIPXVFZSA-N 471.539 0.870 50 20 JCGD CC[C@@H](NC)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970032 QKWKNNGOBDILKT-AUSIDOKSSA-N 460.579 0.161 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(O)ccc1O 1781143713 RCKIUOHBJOHFFA-NFBKMPQASA-N 454.288 0.219 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2cccnc2nc1O 1781250041 MYHAARKIEFOTJJ-CJFMBICVSA-N 490.325 0.457 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781325667 PNHDSHPSPMSNHU-LLKNDRQVSA-N 486.338 0.686 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)nc1 1781327048 WLCQXQPREXPXMU-BBRMVZONSA-N 464.313 0.619 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](COC(C)=O)OC(C)=O)C2 1782175350 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Cn1c(=O)c2c(ncn2CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@](C)(Cl)CCl)C3)n(C)c1=O 1794252757 LZGZWCZNYJZFOX-TXTZDMIGSA-N 485.372 0.308 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(Cl)c(F)c1)C2)c1cccc(B(O)O)c1 1795737843 ZKOVILYLDROUAI-USGNIVHTSA-N 476.697 0.441 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1-c1ccccc1)C2)c1cccc(B(O)O)c1 1795738987 OXLBEOAUULSOHR-JHDGKUDLSA-N 471.322 0.945 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ccc1F)C2 1796443695 BPMABGFESGYPKB-NXTZLTDHSA-N 457.462 0.869 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccc(C(F)(F)F)cn12 1797432587 CSNXGHXOHWOHIQ-VTEUUUEMSA-N 496.490 0.929 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)cn2[nH]cnc(=O)c12 1798466982 VUEYBMYHLTXFSK-NRWUCQMLSA-N 452.309 0.318 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1C(=O)OCCO 1798567578 HLJZDSARPODTQS-VWPFQQQWSA-N 469.332 0.822 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097584 PTIHFLWSCZICRB-KMQSCTNJSA-N 488.589 0.723 50 20 JCGD CN(C)C(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800436590 YTKQUEBKYYNKAN-YVSFHVDLSA-N 452.349 0.670 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1804075634 YLIAFJIPDFWNFO-RDGPPVDQSA-N 459.352 0.922 50 20 JCGD COc1cnc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1 1806051961 VWONMZQNXOHEIZ-IIBYNOLFSA-N 455.519 0.573 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362800 NOWKHFOSDZWAEQ-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD CN1CCC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1 1807373912 VGCDWRBIFJXQAE-RZUBCFFCSA-N 450.348 0.423 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375177 PSEBVOOOKBSKET-CVDCTZTESA-N 464.331 0.094 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)COCCO)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1808633649 SSQJCLLBZRHSHF-XUZZJYLKSA-N 498.584 0.443 50 20 JCGD C=CCO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810295716 WICUBNQVJLCXTF-SYNHAJSKSA-N 452.515 0.991 50 20 JCGD NC(=O)c1nccnc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1 1811191858 RABLNPYGIVUBLZ-TUKIKUTGSA-N 465.283 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C2CCC(O)CC2)[C@@H]1c1cccnc1 1813196145 XBJCPFTZVJUEBI-WVWVSWFPSA-N 466.542 0.951 50 20 JCGD COCCOCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1814307155 KPIHUAFTLKSUQV-XIXVAHAYSA-N 462.532 0.852 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3ccncc13)CC2)c1ccc(B(O)O)cc1 1815340096 GBXATLDKYCQASR-CQSZACIVSA-N 462.300 0.405 50 20 JCGD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)n1ccccc1=O 1815344313 SUHPUTWFLGSMRC-CJNGLKHVSA-N 466.328 0.472 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3ncccn3n1)CC2)c1cccc(B(O)O)c1 1815356495 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CC(C)N(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)C(=O)OC(C)(C)C 1829977957 HEOQSJUPFWWEKN-HRAATJIYSA-N 477.986 0.688 50 20 JCGD O=C(COc1cccc(Cl)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830278579 GNXXVTKWUUPALG-HSZRJFAPSA-N 488.733 0.169 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1=O 1830726700 UAVUDDUTPYYHEG-KHCICDEESA-N 493.988 0.712 50 20 JCGD O=C1C[C@@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CN1Cc1ccccc1 1830726849 UORYBZPKHUUYLJ-PWHSHALESA-N 479.961 0.091 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC#N)C2)C1 1832549593 VFYCFJJXLHFDJD-MGPUTAFESA-N 458.943 0.879 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833399871 IPNKOZCVBJUFQD-APWZRJJASA-N 459.952 0.573 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C(=O)c3ccco3)CC2)CC1 1833755930 DGHRCDZQVPJIIV-UHFFFAOYSA-N 468.514 0.346 50 20 JCGD CC(=O)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)n[nH]1 1833821396 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc[nH]3)C2)C1 1838526822 DWSKYUCDLJEOMM-NRFANRHFSA-N 473.442 0.627 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1OC 1839398204 COUQQJZVYRFQCG-IERDGZPVSA-N 456.923 0.682 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1 1839667879 NBXDNJUEGWDFIH-QEEYODRMSA-N 483.363 0.440 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1F)CCO2 1839768655 UIMDCKIBCLXLBV-VPCSNGCSSA-N 463.934 0.933 50 20 JCGD Cc1cnc2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)cnn2c1 1840033721 NPHNJIMQPJNYJP-KUHUBIRLSA-N 466.336 0.891 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSCc3[nH]cnc3C)C2)C1 1840153291 JQEKDWSZUYGMSO-HNAYVOBHSA-N 460.984 0.662 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1 1840182396 ILISCJVHZVLYCP-IRLDBZIGSA-N 450.511 0.527 50 20 JCGD Cc1ccc2cc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)ccc2n1 1840184377 JAAZEPVHFFUMPC-RUZDIDTESA-N 483.569 0.986 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cn3cccnc3n2)C1)NC(=O)NCc1ccccc1 1844041078 QNRKSWLTZCKKTR-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCS1(=O)=O)C2 1844693268 NTKJWPBMRQWZIY-KRWDZBQOSA-N 465.484 0.914 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCS2(=O)=O)C1 1845913932 KCHYIHIIYFOJEP-KRWDZBQOSA-N 465.484 0.914 50 20 JCGD CN(CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)S(=O)(=O)c1ccc(Cl)cc1 8630643 XPFGPJMUILPKTL-QGZVFWFLSA-N 497.913 0.491 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cc1 726710573 GWCXMZJGCOPTJE-QGZVFWFLSA-N 485.545 0.712 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc2c(c1)C(=O)N(C[C@H]1CCCO1)C2=O 728846387 YSIRDDNFAIHPNO-QGZVFWFLSA-N 478.509 0.929 50 20 JCGD C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)COc3ccccc3O)n(C)c2)C1 730780489 MZOBXJDVHIWSNL-AWEZNQCLSA-N 450.517 0.991 50 20 JCGD C[C@H](COCC(F)(F)F)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 743341553 NMWZKVVLBYVCBL-GFCCVEGCSA-N 454.475 0.611 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2C)n1 748128963 IWZSVZAGUPLXFV-UHFFFAOYSA-N 496.567 0.328 50 20 JCGD Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1NS(C)(=O)=O 906450713 ZNNGLTZHBAYGQU-UHFFFAOYSA-N 496.567 0.462 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2c(Cl)cccc2Cl)C[C@H](C)O1 912919059 HWMXYSDZMMAPJA-RYUDHWBXSA-N 467.375 0.918 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)cc1OC 913253759 GRZWLWMYUSZCJU-MRXNPFEDSA-N 469.454 0.128 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c1 913465179 JWVLFRWKKHFECJ-UHFFFAOYSA-N 490.563 0.830 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2cc(Br)ccc2=O)c1 914864637 PLSMZYGVHHHYAJ-UHFFFAOYSA-N 457.306 0.322 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCCc1cccnc1)N(S(C)(=O)=O)CC2 916262639 LZLYEXOZKQRONY-SFHVURJKSA-N 491.570 0.921 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)NCC1CC1 920859660 YQOIJRXXFIEYKF-YHVDPYDOSA-N 458.562 0.120 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCCN1C)CCO2)NC(=O)NCc1ccccc1 1780968516 MMEMCTVPNGDLEQ-OFVILXPXSA-N 486.617 0.647 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)Cc3cccnc3)CCO2)C1)NC(=O)NCc1ccccc1 1780968849 FVUPDVOCLNXVHI-VWLOTQADSA-N 480.569 0.800 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1781222397 TUMCPMCSATWAHG-YLJYHZDGSA-N 450.960 0.530 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1 1781862279 XZGIJJCTZXNQOP-NVGCLXPQSA-N 450.330 0.443 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1782093310 DFAWHCWDTIANOH-DEOSSOPVSA-N 452.316 0.749 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)n1 1782208965 DJKWDIORCNOVPJ-WZONZLPQSA-N 474.562 0.541 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2 1783933192 DIGXTTBFRYFGNA-XXBNENTESA-N 457.531 0.383 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936973 MQKZVZHPDRBADX-KOSHJBKYSA-N 489.573 0.504 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783945982 VHGDNZSKCFZECR-WTOJCKNJSA-N 466.362 0.990 50 20 JCGD CC(=O)N(C)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785075261 AIWGWOKVKLVKKZ-XSLAGTTESA-N 489.013 0.967 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3OCCc4ccccc43)C[C@@H]21)c1ccc(B(O)O)cc1 1786978596 BPUQSQZAJRIGHJ-HCUBDLJJSA-N 478.354 0.664 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3Cc4ccccc4C3=O)C[C@@H]21)c1ccc(B(O)O)cc1 1786979876 UWIZMPURNXASPY-VJBMBRPKSA-N 491.353 0.006 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21 1787507310 OILAGMMTGBJMTO-JHUKZBBPSA-N 472.458 0.915 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21 1788611110 MYQKGTRNPSKKKS-PJODQICGSA-N 459.894 0.036 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(N)=O)C[C@@H]21 1789221957 VAUPIXWVNYABMI-OWQGQXMQSA-N 462.459 0.379 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCNC(=O)OC(C)(C)C)[C@H]2C1 1789928924 ARGMXRPURLQYEO-SIRPWMCASA-N 477.986 0.496 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1790174794 AIPAJWXEYKWBRS-GCQYFTOKSA-N 468.320 0.500 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21 1791143153 YJOUFULPOADHLU-NTLWEQJWSA-N 499.432 0.899 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791489877 BPRDWOYHWBZYEF-QQOZLPODSA-N 451.332 0.234 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1 1792529669 YCRVWHUUYWMLKS-AENRVVEGSA-N 475.945 0.994 50 20 JCGD Cc1cccnc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1793993086 OZOFXFUFYGZMLM-VPTLXERWSA-N 452.515 0.225 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3cccc(F)c3)CC1)C2)c1ccc(B(O)O)cc1 1795732824 LTUHAHCBJQNCCJ-UPHUGPLXSA-N 452.291 0.441 50 20 JCGD COc1ccc2c(c1)CC[C@H](CC(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)c1ccc(B(O)O)cc1)C2 1795734157 GNSCOSSMHNIVHG-CJQNEGCDSA-N 492.381 0.773 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1796189396 HOMIDGPHMJSRGF-MUJYYYPQSA-N 463.259 0.717 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)[C@H]2C1 1796370236 IYGGSHUGIHQXJW-QOVIGXIDSA-N 475.945 0.992 50 20 JCGD CCc1noc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1798176047 VOTHUZUIWPSIEK-UYNJTKMTSA-N 456.503 0.883 50 20 JCGD CC(C)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1800692379 SNGYNUFRLWMWHB-RUMRUAAYSA-N 450.344 0.936 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCc3sccc3C1)C2 1801010844 ZECRWWVZYQRYKF-FAQVEIGNSA-N 463.604 0.069 50 20 JCGD CCOC(=O)N1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)CC1 1802344378 YUKMISSDPVCNJO-BCDXTJNWSA-N 451.568 0.866 50 20 JCGD C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1802480290 BVEBOZMIEUOVHH-CWZDDEHYSA-N 477.525 0.258 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807155003 GSQSUPRZGSUQIG-XTQVGHSUSA-N 473.342 0.977 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360348 AKMSDCIBKMQKCH-IERDGZPVSA-N 462.271 0.201 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1 1807361084 OSDMINPRUQTFAE-NQIIRXRSSA-N 476.346 0.741 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362021 KGVGZXSKDHIQKV-RXVVDRJESA-N 470.298 0.438 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809980205 LZCPSNLXTJMWQR-UHFFFAOYSA-N 452.364 0.804 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1810350529 CKJAOMQZNIJUPN-HNAWSFBYSA-N 459.374 0.974 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCC1=O)CC2 1817280331 ROKPHDTXDCQZBL-SUZBBLJPSA-N 471.543 0.812 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nc[nH]c1[N+](=O)[O-] 1818075800 QADQZENCKRETRF-CQSZACIVSA-N 453.224 0.341 50 20 JCGD Cc1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn2[nH]cnc(=O)c12 1820117575 KNFVQFSIVWGQBN-GOSISDBHSA-N 489.301 0.354 50 20 JCGD CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C#CC(=O)O)[nH]n1)NC(=O)NCc1ccccc1 1820711458 OXFMZTUWUFSNLE-SFHVURJKSA-N 481.513 0.836 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822117725 BVKKUKWDCOHWGK-KRWDZBQOSA-N 471.323 0.920 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1 1822528376 KXJZLKPSEXLEAY-WJNWYLSZSA-N 480.485 0.461 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2cc(C)c(O)nc2=O)n[nH]1 1823370041 FYPPZRSOXHPYNN-GXTWGEPZSA-N 452.899 0.927 50 20 JCGD Cn1nncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548027 CKZGKJRCYYRYDT-PGRDOPGGSA-N 490.948 0.481 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2c[nH]c(=O)cn2)CC1 1828924531 WVYKCUBBERMBNP-GOSISDBHSA-N 453.503 0.316 50 20 JCGD O=C(CN1CCSCC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1829714703 CCMGUBQBLIRROS-HOCLYGCPSA-N 454.362 0.182 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1 1831204947 BZZBXEHHBIYZCV-KXBFYZLASA-N 462.385 0.923 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CSCC(=O)OC)CCO2)C1 1831449844 TXAYZQYKTAMZSP-SUMWQHHRSA-N 467.382 0.523 50 20 JCGD CCc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1833516183 HNIIIMVDEIMXIC-QHCPKHFHSA-N 468.514 0.026 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833599094 CRDBRJKVXSFFRZ-DNVCBOLYSA-N 459.952 0.573 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)CC1)c1ccc(B(O)O)cc1 1834798484 BJLNIQDNHAAVKU-DEOSSOPVSA-N 477.370 0.555 50 20 JCGD O=C(CCS(=O)(=O)c1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1835146738 ZZADHGLHQHFCBF-PKOBYXMFSA-N 462.927 0.841 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cc(F)cn3C)CC2)CC1 1835249587 XADVJLJBKAIGMI-UHFFFAOYSA-N 450.559 0.722 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CC3(F)F)CC2)CC1 1835737860 IXSRGQUKEPXXKJ-QGZVFWFLSA-N 450.490 0.526 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1 1835835792 HXONAAJUKMNWAO-ZSZQSSIHSA-N 455.353 0.711 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837319790 HTDMBMNPNQXRSL-QMTHXVAHSA-N 461.231 0.332 50 20 JCGD CC(=O)c1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n[nH]1 1837365131 GKYRYQQBTDCYJP-UHFFFAOYSA-N 468.319 0.218 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ncccn3)C2)C1 1837711921 WIPGRFYRWVCJFE-LJQANCHMSA-N 454.625 0.877 50 20 JCGD Cc1nc(C)c(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)o1 1837921144 FMQNLAXXDYKQRW-UHFFFAOYSA-N 455.320 0.897 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n(C)n1 1837921267 RVJHWAMNABOECK-UHFFFAOYSA-N 468.363 0.588 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C)COC3)C2)C1 1838526769 CGGUGOUWZJLMSH-QFIPXVFZSA-N 477.470 0.627 50 20 JCGD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200544 JWDXHWCDLGCNAT-XLIONFOSSA-N 497.321 0.926 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)CCO2 1839203910 ADNXKKXFPYPDPD-GCKMJXCFSA-N 477.986 0.736 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(O)c(C)c1)CCO2 1839309087 VCQASKLZIWCUBZ-MSIOFZDNSA-N 483.525 0.905 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(C(=O)OC)(C3)C4)C2)C1 1839966663 MADDJRWLJSVNLZ-PHSYYZNHSA-N 473.364 0.960 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1839994803 GBFJYLVWSQISBL-VIDGFWFCSA-N 480.326 0.158 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1840032877 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CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846962232 ZFDUTXVHNIUIQW-INIZCTEOSA-N 460.535 0.805 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)[C@H]2C1 1847562908 DPGIKDMMSXDWAP-KOWPAETKSA-N 457.955 0.670 50 20 JCGD N#Cc1ccc(C(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 726980405 XBPFDSABZFFDRN-UHFFFAOYSA-N 455.496 0.534 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=S)NCC3CCC3)c2)CC1 727866479 KGIBCKMGSSORNX-UHFFFAOYSA-N 453.590 0.448 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2nnc(O)c3ccccc23)C1 728202470 HWVQBHKGUGCAEE-CYBMUJFWSA-N 473.515 0.537 50 20 JCGD Cn1c(=O)nc(O)c2c(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc(C3CC3)nc21 728324261 ZSLOBVDNTWKPLK-INIZCTEOSA-N 495.448 0.056 50 20 JCGD CC1CCC(NC(=O)CN2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)CC1 728961684 LEVMBCDTJCNXJT-UHFFFAOYSA-N 486.621 0.746 50 20 JCGD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)C1 731219043 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HANHPIUZASVOLR-UHFFFAOYSA-N 477.518 0.984 50 20 JCGD COC(=O)c1sc(S(=O)(=O)NNC(=O)c2cccc(OC)c2O)c(C(=O)OC)c1C 919958462 NDYMZPRVRNOSDL-UHFFFAOYSA-N 458.470 0.967 50 20 JCGD Cc1nnsc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1778238626 IORNWGPNYQZTQS-FOIQADDNSA-N 459.532 0.286 50 20 JCGD CC(=O)N1CCN(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)CC1 1778912246 XIDVMGYBGFZTEF-HHXXYDBFSA-N 477.375 0.355 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/N3CCCCC3)C2)C1)NC(=O)NCc1ccccc1 1779019609 SASHGLWYGACABE-JOWQQVNMSA-N 499.616 0.634 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034194 OTSGXFLNZZPWJL-MWTRTKDXSA-N 452.515 0.402 50 20 JCGD COc1ccnc(C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c1 1779537678 YTCSKAICWINJEJ-RUZDIDTESA-N 496.568 0.880 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccnc2C(N)=O)C1 1779940611 UHBLMDHMCWEBOQ-VLXJIEOASA-N 468.352 0.877 50 20 JCGD CC(C)N(C)CC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968633 FUALYNSPNZMYDL-XMMPIXPASA-N 474.606 0.503 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969906 QDQDFDZBKZCESI-HAAQQRBASA-N 498.584 0.021 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781324945 GAKOCMPVKSFVDY-FHSNZYRGSA-N 482.347 0.783 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc([N+](=O)[O-])c1OC 1782119376 ZIDFRBZEQRINOT-IFXJQAMLSA-N 457.867 0.655 50 20 JCGD C/C(=C\c1cccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782524090 ZSMWGQFZSKEIQC-ZEKRBLEXSA-N 463.343 0.992 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCCCN1C(=O)OC(C)(C)C)CCO2 1783936559 JFKTZRVVQPBHMY-HOYKHHGWSA-N 495.621 0.979 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc([N+](=O)[O-])c1OC 1784092581 QFGMJVUTMZIDNR-ONQXIZJVSA-N 471.894 0.805 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C=CCN3)[C@H]2C1 1787400748 WXSLEVJHSXLGLJ-WOYTXXSLSA-N 456.971 0.626 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)Cc3cccnc3)[C@H]2C1 1787472466 MDRRCEYRMHYXCV-QNNUHGRASA-N 481.557 0.065 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cccc(OC2CCOCC2)n1 1789106372 DMFFOQSUTIDWND-WQCNXYOZSA-N 467.950 0.832 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[S@@](=O)c1ccccc1 1790595425 KDCZLGGXZIWIQH-JOIMRNKESA-N 484.383 0.156 50 20 JCGD O=C(CCc1ccc(F)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1792743074 ZJRHLWAHGOMDTM-FAQVEIGNSA-N 458.270 0.481 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1 1793668988 UMHZCMADBCMSEA-YVSFHVDLSA-N 489.997 0.592 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795112968 SXVBKJIUPWCPFG-XFMPKHEZSA-N 464.357 0.247 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(-c2ccco2)no1 1796125243 YSCCWQFFCKYIRP-YVWYUNDQSA-N 451.244 0.131 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c([N+](=O)[O-])c1 1796189492 UXXUZTSJDNJLTP-REPLKXPHSA-N 467.287 0.778 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796190003 QJLWYRZYQCECCK-ACDBMABISA-N 489.378 0.550 50 20 JCGD Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)ccc1C(F)(F)F 1796710069 FFEKGZRIYCSMSM-ZSBFGKGUSA-N 465.237 0.241 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O 1796874784 KJENRRGJZRWTCQ-BRFYPRMVSA-N 473.559 0.561 50 20 JCGD C=CCO[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095353 OWGLSJFNNMSJHK-KMQSCTNJSA-N 473.574 0.513 50 20 JCGD COCCOCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl 1799278682 VAFBHPQLBQHLDU-WQDJSCAQSA-N 485.405 0.509 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)[C@H]1SC(=N)NC1=O 1799347008 HMILNIKNQQTBTG-ALMWHKAHSA-N 451.318 0.069 50 20 JCGD O=C1NC(=O)[C@@H](CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)Cc2ccccc2)N1 1800435744 MJGXINQVLNAQGJ-ORDFZIBCSA-N 493.358 0.180 50 20 JCGD Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c(C(F)(F)F)o1 1801011661 XRTVDNDNXCUGIO-JJLQDPRZSA-N 461.441 0.578 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl)NC(=O)NCc1ccccc1 1801017433 ZJXFMVVVBQQPCF-SCAQPMJSSA-N 472.373 0.726 50 20 JCGD CN1CCC(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1802569059 MASCAMSYJBZVAQ-RBBKRZOGSA-N 450.348 0.423 50 20 JCGD C[C@](O)(C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(F)(F)F 1803991297 YDTGTVPDRHQRQN-MDYRTPRTSA-N 465.237 0.394 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)nc1 1805050544 DNIDLCXKLFTQKX-JCGIZDLHSA-N 466.947 0.799 50 20 JCGD CCOC(=O)/C=C/C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1806294383 RZGBUSQDZYBPDC-KYNLDRKZSA-N 466.498 0.519 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1807029398 RWKKWHDAYWLGDN-YCPHGPKFSA-N 477.296 0.986 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807376156 WQOVGLCEHFJWTB-UGKGYDQZSA-N 496.373 0.996 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)Cn2ccnn2)[C@H]1c1cccnc1 1808416523 AZHSBXJUABAUAR-ZXRGJLGVSA-N 463.502 0.513 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1 1810293282 BGNZQTCLOBQQAB-PGRDOPGGSA-N 476.298 0.946 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810302566 LEFGGCIUKJZONW-HRAATJIYSA-N 475.509 0.412 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1812774227 NCQLASJDZRCKHY-RZLSGREXSA-N 466.336 0.859 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C2CCC(O)CC2)[C@H]1c1cccnc1 1813196140 XBJCPFTZVJUEBI-IFXFZGMBSA-N 466.542 0.951 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813413237 WZWVDZTZYWPSNZ-ZNLUXHQJSA-N 461.331 0.614 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813619418 CTLHIDDYTOBFFZ-PUHATCMVSA-N 464.375 0.954 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348439 OBOSJMNTUNXSPF-BXUZGUMPSA-N 461.305 0.610 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)C1 1817474188 PDYRQVGWYHMIAU-MDZRGWNJSA-N 468.319 0.985 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1cnc2[nH]ncc2c1 1818947940 DZUIGLYCMILEQP-HNNXBMFYSA-N 462.300 0.634 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCO4)sc2C1)c1cccc(B(O)O)c1 1819115476 ISWWHRFZILJKFW-AWEZNQCLSA-N 467.316 0.342 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1csc(N)n1)CC2 1819795841 UTCYUNXEGNRTKL-QMMMGPOBSA-N 458.529 0.720 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(CO)o1)CC2 1819797821 LQFDXAUYYLJHHP-JTQLQIEISA-N 456.484 0.767 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCc2ccc(O)nn2)n[nH]1 1821638907 BWQGWYNNIWLRIE-MRXNPFEDSA-N 458.523 0.903 50 20 JCGD O=C(c1cc(O)nc(O)n1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059825 WXLBEUDZPYHDDU-GOSISDBHSA-N 454.292 0.115 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)[C@@H]1SC(=N)NC1=O 1827667528 HMNFOOWFNIHDSX-KYNGSXCRSA-N 486.403 0.402 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1830535408 NSYHMNWNOOMEOF-QRWLVFNGSA-N 485.379 0.622 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1830544508 ZUEKOEHSLYMKPZ-LIRRHRJNSA-N 471.352 0.767 50 20 JCGD COc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccc1[N+](=O)[O-] 1830733284 HUSVUKZTWSFQEF-JXFKEZNVSA-N 471.894 0.202 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830898008 YUXYRKUGLIUERU-DEOSSOPVSA-N 469.347 0.014 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830996678 NTNNWJXWFGGTGX-DVSDUFGPSA-N 489.997 0.736 50 20 JCGD COCCOCCOCCOCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)CCl)CC1 1831731397 JWBWSYFLQQBHAJ-WOJBJXKFSA-N 479.014 0.902 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3C(=O)c4ccccc4C3=O)CCO2)C1 1832534975 OSNHQTDXRFTBPQ-MBSDFSHPSA-N 493.944 0.383 50 20 JCGD O=C(NCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1cccs1 1833033126 OJSVRXRUWLCYQE-KRWDZBQOSA-N 450.344 0.738 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1833263158 DHBWFWSFXQVGFR-CZUORRHYSA-N 460.417 0.182 50 20 JCGD CC(C)(C)[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833286598 PHYIRKRVYPXPDI-IBGZPJMESA-N 460.579 0.277 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4ncncc4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798544 JGIAGHLQCHPIHQ-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1834800065 OVONALMATANEGP-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1834826734 UUMHIUOIDMLFMJ-KUHUBIRLSA-N 455.353 0.756 50 20 JCGD O=C1CCc2ccc(C(=O)NC3CCN(C4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)nc2N1 1834971214 UHBDJMUDQADESP-SFHVURJKSA-N 463.966 0.751 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C3=NN(C)C(=O)CC3)CC2)CC1 1835116510 WDHYEGAWJNWSKV-JVWAILMASA-N 498.588 0.300 50 20 JCGD Cc1cc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3cccc(B(O)O)c3)CCO4)ccc2[nH]1 1835939260 JGJGZZYCEMOXPZ-RUZDIDTESA-N 477.326 0.540 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(C(F)(F)F)n1)CCO2 1837929701 MIIOXKSJKVRYMH-NRFANRHFSA-N 493.247 0.164 50 20 JCGD Cc1cnoc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838394571 LPHGTKDGYUJWTE-UHFFFAOYSA-N 456.503 0.908 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838527288 MDJFAPUNGFTVFR-UZLBHIALSA-N 485.877 0.190 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049410 WIZJSNYVCCGSHV-PMACEKPBSA-N 470.357 0.965 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)c(O)c3)CCO2)C1 1839473485 BIWDESYOZJQMAO-IIBYNOLFSA-N 469.922 0.674 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ccoc3cn1)CCO2 1839487246 XPJRPGYGQMOYTG-QFIPXVFZSA-N 459.503 0.271 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3COc4ccccc4O3)C2)C1 1840150135 GIZFVXWXFCLZLW-HOIFWPIMSA-N 468.934 0.927 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C(=O)N(C)C)c3)C2)C1 1840155642 BXZPQAROWPXEJW-AVRDEDQJSA-N 467.950 0.712 50 20 JCGD Cc1cccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)n1 1840183279 WXRZTDUVFJHPPQ-WCYCAPIHSA-N 459.547 0.233 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1 1840904139 BKEXPEVZTLESOA-NRFANRHFSA-N 482.375 0.966 50 20 JCGD CCOc1c(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cnc2c1cnn2C 1843011060 KMDNQEYGJASDHD-UHFFFAOYSA-N 463.303 0.178 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846157678 HFPRWJGYBSRMAR-CYFREDJKSA-N 483.374 0.831 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C)C1 1846330933 SQDLCNLVQBGHIA-HUUCEWRRSA-N 496.026 0.772 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)N1CCCC13CN(C(=O)c1cccc(B(O)O)c1)C3)C2 1847094413 UHPLKUKFXZSSIV-UFYCRDLUSA-N 483.374 0.971 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)CCC(=O)NN(C)C)CC2=O)c1 1847218731 AFTHGNNKKCWUFP-VDGAXYAQSA-N 471.558 0.623 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cnn(C)c1)c(=O)n2Cc1ccccc1 10161585 ZNHCWGLEZMOMBD-UHFFFAOYSA-N 478.513 0.259 50 20 JCGD Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Nc2nc3ccccc3s2)cn1C 725881404 SFBWRXASPXGMQK-JTQLQIEISA-N 451.534 0.265 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cc1 726710771 RJOJSNUCOYLNRC-UHFFFAOYSA-N 455.519 0.487 50 20 JCGD CCCS(=O)(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 728345891 TZHCBOJRAPDZBV-SFHVURJKSA-N 477.495 0.983 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCc1nccn1C)N(S(C)(=O)=O)CC2 728752286 DUPQTLRAKSTCLW-HNNXBMFYSA-N 480.547 0.217 50 20 JCGD C#Cc1ccc(C(=O)NNC(=O)C[C@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)cn1 728960043 OBYWDVUJSMNLBY-SFHVURJKSA-N 472.523 0.790 50 20 JCGD O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1csc(N2CCOCC2)n1 729220817 AOEVDIUAQPCUKC-UHFFFAOYSA-N 489.606 0.316 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CCCC(=O)NC(C)C)N(S(C)(=O)=O)CC2 729516526 YTEAGYWLYYTNKW-QGZVFWFLSA-N 498.602 0.795 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)cc1 751282891 RCWPZLSFBSZIPR-UHFFFAOYSA-N 458.518 0.050 50 20 JCGD O=C(COC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)NNC(=O)c1cccc(Cl)c1 769225209 PUVYOCYFICPZPW-UHFFFAOYSA-N 460.786 0.849 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NN=Cc3cn(C)c(=O)n(C)c3=O)c2)cc1 839383724 OMTKIZVQONVFIF-UHFFFAOYSA-N 471.495 0.657 50 20 JCGD COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c1C 897557296 JOPVUQAAAQCIRL-DMMSUNFISA-N 492.598 0.533 50 20 JCGD Cc1ccc(C)c(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)c1 906287588 ADYIJVCUPUBJJZ-UHFFFAOYSA-N 460.512 0.264 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CC[C@H]3NC(=O)NC3=O)c2)c(C)c1 913168355 UNKITSGFKNRPPY-QGZVFWFLSA-N 473.511 0.853 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1 916533622 QDLWHHDWERAKTE-UHFFFAOYSA-N 496.929 0.325 50 20 JCGD CC(C)S(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 917694892 QQROOYPIYZMQGW-UHFFFAOYSA-N 453.542 0.749 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1C 918137823 HDIACCJQFYEBAG-UHFFFAOYSA-N 476.534 0.652 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2C[C@@H](O)CN2C(=O)Cc2ccccc2F)cc1 919185722 YFFHWYXVDHPEOD-IEBWSBKVSA-N 457.458 0.643 50 20 JCGD CC(C)NC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Br 1318038096 UZOCFOVNXYORSG-ZDUSSCGKSA-N 463.354 0.721 50 20 JCGD CN1CCN(Cc2cccc(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2)CC1 1326078084 QOICMBTVVYGZMB-UHFFFAOYSA-N 473.603 0.871 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cnccc4n3)C2)C1 1777733758 QQDBWZSEXOCWAK-QHCPKHFHSA-N 461.482 0.386 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1 1777781299 LAZGNODCUWVCQK-XTVKVDEJSA-N 493.528 0.319 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(C)c1C)C2 1778091481 RWAGNDFPCBOFKQ-JZUGSGHOSA-N 469.546 0.990 50 20 JCGD Cc1cc(C)n2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)c2n1 1778555632 CXXJBMBKMITWLQ-PXDATVDWSA-N 491.357 0.467 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2 1779029896 ZROAGIDTZJJYBC-RDPSFJRHSA-N 478.509 0.322 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779030618 DLLYXMOQLRTYPR-HSZRJFAPSA-N 453.499 0.380 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(OC)c1 1779034868 VOBRCUAJNAXZIF-VWLOTQADSA-N 497.552 0.779 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1779176939 OKXHJDBUSVTACK-BIENJYKASA-N 468.352 0.456 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)COc3cc(Cl)ccn3)C2)C1 1779230031 OSDMYCSWFIWJNN-OAQYLSRUSA-N 474.905 0.256 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779299901 HBLHXBGCYVFXPU-HRAATJIYSA-N 473.643 0.944 50 20 JCGD CC(C)N1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)CC1 1779371339 PXWNHLXXMLOWAF-PXDATVDWSA-N 486.617 0.933 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1780202814 WESCIIYTBVKSSI-CWTRNNRKSA-N 480.319 0.905 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1780795165 YSQWFYZZBZLLLU-YBGOQADZSA-N 466.343 0.961 50 20 JCGD O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1780948275 XTIVQQFWWWSVCU-QHCPKHFHSA-N 482.733 0.582 50 20 JCGD N#Cc1ccc2[nH]nc(C(=O)N3CC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c2c1 1782195501 WNJCLNOCWXFUHD-QHCPKHFHSA-N 474.481 0.190 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1782302335 FSSLNQHYGJEYBV-HSZRJFAPSA-N 466.278 0.219 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1782952998 JVPNNMSAVLPNJX-BXTJHSDWSA-N 494.010 0.526 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1783343724 PDWAAJONHYNAPR-KXBFYZLASA-N 453.337 0.815 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@]3(O)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1784011180 ONIWDNPCWIACLS-IWMITWMQSA-N 475.970 0.442 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCN(C)CC3)[C@H]2C1 1786725367 NQZZJJJGAQTZML-OWSLCNJRSA-N 459.429 0.635 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ncsc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786979888 WRPPEPKDTMISMC-QSFXBCCZSA-N 465.340 0.883 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609759 HCJUPIIUHINAQD-ROOHIHILSA-N 498.496 0.514 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn(C(F)F)c3=O)C[C@@H]21 1791291469 VWOMSZQRCNFQOS-BPUTZDHNSA-N 469.489 0.210 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21)C(Cl)Cl 1791295746 YBICIOCYBCVLNS-AUTRQRHGSA-N 451.332 0.235 50 20 JCGD CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1792785617 LEJLAWUNGZHKPO-SVZOTFJBSA-N 487.022 0.021 50 20 JCGD COc1ccc2c(/C=C/C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)c[nH]c2c1 1795734120 DQTKHLAQTGGMFJ-XDKWTVRRSA-N 489.337 0.773 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncsc1Br 1796494334 DQAULVQNXRXISN-GNXNZQSNSA-N 474.381 0.482 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncc1F)C2)NC(=O)NCc1ccccc1 1799097936 XPGGITDELSAHHE-OPMZPASUSA-N 484.532 0.770 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2 1799269940 GEWSYSJVWCWSNE-VPEYGQHGSA-N 459.971 0.965 50 20 JCGD C=C(CC(=O)OCC)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1799304853 BPTQDYGAZHTRQN-ZPHZMXASSA-N 459.503 0.219 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1ccccn1)C2 1800643056 KTPVJXXTGYAZIP-JBXGNFEISA-N 467.364 0.963 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2 1800979414 FWXGNPDAKOJOGF-DDFXLWFNSA-N 451.867 0.928 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](c1ccc(Cl)cc1)N(C)C)C2 1801012735 HZMBLBUUOATSKO-WOSNLTMFSA-N 480.009 0.905 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CNC(=O)C1)NC(=O)NCc1ccccc1 1801674071 AVBJTFHRTCHTKQ-OKYOBFRVSA-N 456.547 0.107 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2C)[C@H]1c1cccnc1 1805317422 YFAURSOPWPKFFS-HTAPYJJXSA-N 454.531 0.473 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CC[C@@H](N)C(N)=O)[C@@H]1c1cccnc1 1807192761 YGOQQOQLYNMBLR-MMTVNHQJSA-N 454.369 0.711 50 20 JCGD 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782551031 IBYJCGIWWSOCGM-ATVHPVEESA-N 467.482 0.743 50 20 JCGD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)CNc3cccc(OC)c3)C2=O)cc1 825781876 JQWWDCNOCNTNEY-QFIPXVFZSA-N 455.471 0.730 50 20 JCGD CCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2cc(C)ccc2C)c2ccccc2c1=O 913573085 SHJXWUCHSCVIEP-UHFFFAOYSA-N 457.512 0.773 50 20 JCGD C[C@H]1CN(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C[C@@H](C)O1 916249605 BUVBNOVPOCHZHF-CALCHBBNSA-N 483.591 0.151 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCCNC(=O)c2ccc(OC)cc2)c2ccccc2c1=O 918221866 PJEDITLLKPRHIR-UHFFFAOYSA-N 452.471 0.799 50 20 JCGD O=C(CSCC(=O)N1CCOCC1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 920284992 PKHVUAWSXHIVPX-UHFFFAOYSA-N 495.565 0.741 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)c1ccncc1 1321404793 VTVCVSZIRRUWSY-OAHLLOKOSA-N 483.344 0.838 50 20 JCGD C[C@H]1CCc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C4)n[nH]c21 1778603799 BNJBZOCTEHZCQH-XSSDXNQZSA-N 460.579 0.960 50 20 JCGD O=C(C[C@H]1CNc2ccccc2O1)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1778934236 VTHCHOREWSNSMN-CYFREDJKSA-N 465.315 0.073 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2 1779028345 CWBGLEUFJVWBKY-HSZRJFAPSA-N 465.510 0.566 50 20 JCGD CSc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1O 1779032798 VXPRDXZJSJCXKF-JOCHJYFZSA-N 471.539 0.870 50 20 JCGD Cc1nc[nH]c1C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967939 DXUYLPCHUFKSSL-QHCPKHFHSA-N 469.546 0.508 50 20 JCGD CC(C)[C@@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969613 MUVYMBIHOBESKA-OFNKIYASSA-N 461.563 0.179 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1781339573 CVKLDRORQRETCO-LXIYXOSZSA-N 482.347 0.783 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](N)CCC(N)=O)CCO2 1782864833 WCRRBJCSTFCLIT-XYAYVLSKSA-N 461.469 0.294 50 20 JCGD COc1ccc(C(=O)CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1786428341 GJYZVOFXABLEGT-APTRMMRNSA-N 494.353 0.631 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21 1787506628 JYBGRUCMZFLYRY-LIKXFGNHSA-N 473.921 0.857 50 20 JCGD CC1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CC1 1788607722 BDMFRXQNOSVOIQ-VDGAXYAQSA-N 458.563 0.010 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4c(O)nnc34)C[C@@H]21)[C@H](F)Br 1789923170 WARIJLHPDWPGEE-BQUFFADESA-N 456.272 0.719 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1793088442 ZXJAANJRVLEQIB-XCCSTKFXSA-N 464.346 0.958 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795112525 KXKCCEZOPVRQRH-HLPPOEQASA-N 478.384 0.901 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2nccc-2c1Cl 1796224684 SRZYXDFKIQLHCZ-DBWKPXFBSA-N 462.938 0.744 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1 1796365684 XNYOFKWMCRYDND-KARBZBNUSA-N 463.934 0.728 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c2cc(O)ccc2n1 1797353937 NYCFWOAMUCRYTK-GPVSGQMNSA-N 475.310 0.446 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1O 1797686177 IQFZBFWBUORWDE-PJVZLEMVSA-N 495.621 0.616 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)[C@H](O)N1CCOCC1 1797808428 NWGFKTBFYMJBAR-PQTWGXLHSA-N 496.402 0.233 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)[C@@H](O)C1 1799198101 RMZQQNHVKUUSRT-IWTMDLJTSA-N 494.358 0.494 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C2)NC(=O)NCc1ccccc1 1799865653 GPNHSMYMSHUGAW-REPLKXPHSA-N 498.544 0.776 50 20 JCGD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)N(C)C(=O)OC(C)(C)C 1799916892 PLGAGVAKMBYCMP-DQEVTTJGSA-N 459.352 0.874 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cccc([N+](=O)[O-])c1=O 1801356763 ZLANRBDDQCRQAR-BDHJUDLHSA-N 483.485 0.529 50 20 JCGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1804343366 DBSQDEJKWPIPHZ-DVOMOZLQSA-N 452.309 0.471 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807367614 TYEPNAYIASMJPE-SIKLNZKXSA-N 465.315 0.590 50 20 JCGD CN(C)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807369371 HYBFMXZRTPGJHX-CVDCTZTESA-N 473.342 0.856 50 20 JCGD Cc1nnsc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807376019 RAUCXUMVOFYLQB-SJLPKXTDSA-N 451.317 0.555 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1 1808413525 BQVHKCLIQBJZQR-ZZXHSXFOSA-N 479.541 0.844 50 20 JCGD C[C@@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)O1 1809557014 GESHKBKXGOIZHJ-BGRCLHOASA-N 452.515 0.967 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1C 1810295147 RBOZZXKGRJUZQH-VGOFRKELSA-N 476.541 0.684 50 20 JCGD Cc1nc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c(=O)[nH]c1C 1810300311 XIWUQEGAYSTFJK-OXJNMPFZSA-N 490.524 0.414 50 20 JCGD C[C@@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)N1CCN(C)CC1 1810306120 UPNHGMDDNQUBSC-LQBOVUBWSA-N 494.600 0.036 50 20 JCGD Cn1cc(CCC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815339354 AEIYIYNTHLRLOO-MRXNPFEDSA-N 453.333 0.415 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc([N+](=O)[O-])o1)CC2)c1cccc(B(O)O)c1 1815347782 OOIBJVBJTUXGBG-GFCCVEGCSA-N 456.245 0.864 50 20 JCGD Cc1cc2nnc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)c(C)n2n1 1815356839 UEXVWVUIGLNBPM-OAHLLOKOSA-N 491.342 0.417 50 20 JCGD O=C(O)c1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)ncn1 1816154581 NGFCDGXCKUCHQU-KRWDZBQOSA-N 464.247 0.197 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C1=NN(C)C(=O)CC1)CC2 1817277098 IXHIDDBLERJOMU-ZVYABZQBSA-N 484.542 0.797 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CC[C@H]3CCC(=O)N3C2)[nH]n1)c1cccc(B(O)O)c1 1817476890 GHWJZLNDOHMBHR-QRFRQXIXSA-N 479.346 0.796 50 20 JCGD COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)nn1C 1819798044 RVFIIBTUERIRGS-SNVBAGLBSA-N 470.515 0.423 50 20 JCGD CN(C)CC(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822518591 QXGKNFQJXCGRQG-MRXNPFEDSA-N 473.603 0.963 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1cnc2c(c1)CCNCC2 1824640182 PSCORWWHDSYCRV-SFHVURJKSA-N 491.382 0.446 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060219 SWZANYFRICISLW-LJQANCHMSA-N 450.366 0.034 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924195 MBEJTTUTHBMBKZ-UPTIQUDWSA-N 456.547 0.958 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1829119391 WNNFRBXGXDXEBK-MOPGFXCFSA-N 453.584 0.130 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830737049 CRFPTDLCKCVPGY-JLHGSKIFSA-N 489.997 0.832 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830738420 PIPMVBSCGUBXKR-VFNWGFHPSA-N 477.986 0.593 50 20 JCGD CCOc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1OC 1830738842 VPJYCEYTTDDXJU-VGOFRKELSA-N 470.950 0.693 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1830881874 LTQBJVKRUFXSOC-OPAMFIHVSA-N 492.013 0.984 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1831994090 QVQUTAXOXRCQJP-PBHICJAKSA-N 453.305 0.865 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832050901 PBIMOUIXNFPOIR-IIBYNOLFSA-N 477.986 0.738 50 20 JCGD C[C@H](CN)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549144 GKTKIKXZVAORDS-SIFCLUCFSA-N 462.975 0.170 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C#N)CC3)C2)C1 1832549288 LMUGCHATZWBAKX-YCRPNKLZSA-N 470.954 0.879 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSC(=N)N)C2)C1 1832549466 QDMDZQRPYZUJEA-DJJJIMSYSA-N 494.014 0.202 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccn4c(O)nnc34)CC2)CC1)[C@H](O)CCl 1833310561 NDFMKPXBFIZRSL-MRXNPFEDSA-N 450.927 0.220 50 20 JCGD CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1834751458 XMOSRISUSZHUHU-UQBPGWFLSA-N 481.553 0.949 50 20 JCGD COc1ncc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1F 1834800033 QNHFFAGOCXEGIZ-UHFFFAOYSA-N 484.337 0.408 50 20 JCGD CS(=O)(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1835258816 WVWCCCKQLTULOO-CJRTWVEFSA-N 483.493 0.373 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1 1835737882 LIZFAEAIQGULND-UHFFFAOYSA-N 484.517 0.420 50 20 JCGD CCC[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)n1cccc1 1835928576 RKKKGUGEWRHTDH-XUZZJYLKSA-N 469.347 0.279 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1 1835928735 WXJKIVWGYFVGTF-QFIPXVFZSA-N 470.312 0.558 50 20 JCGD CCc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc(C)n1 1835937352 RXXIJZFCNHVQLQ-DEOSSOPVSA-N 467.331 0.016 50 20 JCGD CNC(=S)NCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1837467207 ZLWMCSPATLXVOF-IAGOWNOFSA-N 455.408 0.163 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(-c3cnco3)c1)CCO2 1839365529 QIRMROWXNADKIC-RUZDIDTESA-N 491.309 0.405 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1 1839390025 FZLKNUWOIPNVKR-YVCVADBVSA-N 484.347 0.996 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1 1840034195 CYIUIWFQMAUGCB-ACJLOTCBSA-N 458.357 0.887 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1 1840152679 PNTZSWLEDZHTGB-SCLBCKFNSA-N 450.870 0.682 50 20 JCGD Cc1cc(C)cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840305968 AZWMBXJTRHTBPZ-AREMUKBSSA-N 480.370 0.686 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1840892211 NATBRUQTXGQHAI-XDHUDOTRSA-N 467.526 0.559 50 20 JCGD O=C(c1cn2ccc(Br)cc2n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011424 BVOORFRRNRZLDR-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(CCN3CCCC3)nc2)C1 1843457632 NLFILCXAFPFEKG-UHFFFAOYSA-N 477.569 0.849 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)CC1=O 1848090555 JGPHSBSDJJIZAJ-HJNYFJLDSA-N 475.354 0.852 50 20 JCGD CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(OCC(=O)N2CCCC2)cc1 730570317 HKLCGNSCRZNUIO-UHFFFAOYSA-N 474.543 0.113 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)NNC(=O)N1CCOCC1 745992927 NNMRPNZPFLVHTQ-UHFFFAOYSA-N 487.966 0.026 50 20 JCGD CCN(CC)Cc1ccc(C(=O)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)o1 746391925 ILRNTYOLVVSVEQ-UHFFFAOYSA-N 453.499 0.954 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCO[C@@H](C(N)=O)C2)cc1 747775601 FNEGLWQUEHUYSX-SPQRHKFCSA-N 452.471 0.054 50 20 JCGD Cc1nc(C)c(CCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(O)n1 765862566 FZETXRHIZFEPAL-UHFFFAOYSA-N 491.570 0.533 50 20 JCGD Cn1cc(C=NNC(=O)c2cc(S(=O)(=O)NCc3ccccc3)ccc2O)c(=O)n(C)c1=O 839407975 ZZEZKCKYNHBPMU-UHFFFAOYSA-N 471.495 0.032 50 20 JCGD CN(CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@H]1CCS(=O)(=O)C1 914531950 PHTWIHKWFZKYJB-ZDUSSCGKSA-N 486.597 0.429 50 20 JCGD Cn1c(CC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)nc2ccccc21 914830689 QUUPAHQHNVBABA-UHFFFAOYSA-N 456.528 0.759 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc(O)n1 1778035506 OAOQBEQPAVXQNB-AUSIDOKSSA-N 453.304 0.217 50 20 JCGD CC(C)(C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccn1 1779034955 YJCPVHFSTAQWKP-QHCPKHFHSA-N 452.515 0.501 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(F)F)CCO2)NC(=O)NCc1ccccc1 1780968555 BLJCZMONAGEOHO-NRFANRHFSA-N 453.490 0.818 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3cccc(F)c23)C1 1781426860 KAWOTQDXKXMCBO-WZONZLPQSA-N 474.537 0.974 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1 1781553172 PEPPWDLJLCYYQS-NRFANRHFSA-N 472.433 0.490 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCNC3=O)C2 1781996419 IPBVILRBMVSYKZ-KPAZRMRSSA-N 468.352 0.537 50 20 JCGD O=C(Cn1cnnn1)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783021738 AFHZGDRWSJLHAV-VQIMIIECSA-N 463.336 0.509 50 20 JCGD CN(C)C(=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783022573 KEUFHXBFOLLBJS-OXJNMPFZSA-N 452.349 0.911 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2)C1 1783348337 YWWJIAOBQPSMNJ-BIENJYKASA-N 478.384 0.875 50 20 JCGD Cc1ccc(C(=O)C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1783745316 PWKMZWXDBXJJLV-QHCPKHFHSA-N 451.483 0.320 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c([N+](=O)[O-])cc1O 1783934555 CYXPRYOCZPVVSG-NRFANRHFSA-N 479.490 0.126 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784083962 ILUIPWXWMWIFKI-DEYWJSPQSA-N 479.961 0.347 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1CCc2ccccc2[C@@H]1O 1784149076 OJUWISQPUXDFJV-GXWFBMCDSA-N 478.354 0.256 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C2)C1 1785613013 UNBMPIYDEVKGPT-PZPWOCDFSA-N 477.986 0.734 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)ccc1F 1786981829 AJCAZVQNPGHYGY-MDKPJZGXSA-N 456.279 0.421 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)no3)C[C@@H]21)c1cccc(B(O)O)c1 1786984259 VYUXVLGQGGTJAC-LEDOBFOHSA-N 475.310 0.929 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS[C@@H]3CCCCO3)C[C@@H]21 1791291084 LBYJWBTYRRSSOU-NWZZKEMCSA-N 456.609 0.599 50 20 JCGD Cc1cnn([C@@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1791600526 UYCQRTQAQBGDJQ-LNMJFAINSA-N 455.519 0.045 50 20 JCGD O=C(Cc1c(F)cccc1Cl)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1792754141 SKSUDIDRGYEYMP-USGNIVHTSA-N 460.698 0.605 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2 1792874290 MGUSBWNODDKJJY-RBGFHDKUSA-N 492.411 0.883 50 20 JCGD COc1ccc([C@H]2C[C@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1793299009 HVEMVQJGAMNLMP-NQDIBGKZSA-N 464.327 0.382 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)C2)c1ccc(B(O)O)cc1 1795733039 WSZLAWMCIZFVTP-OQZLWFJBSA-N 452.291 0.512 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796193113 LTINZGHSAUGNTJ-BCDXTJNWSA-N 466.303 0.906 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(=O)Nc1cc(C)on1)C2 1796440447 MBOLKPYDDMKDSA-JXZJUKCJSA-N 485.501 0.035 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1798538919 QYBORNJYHZNFQS-VTEUUUEMSA-N 497.512 0.176 50 20 JCGD CC(C)[C@H](S)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799094815 ABABBHULJCSBQZ-YHELAOLJSA-N 477.631 0.877 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CNC1=O)C2 1800332505 RTOWGXCAOSXLPG-SDGGPSBXSA-N 473.436 0.013 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCOCCOCCOC 1800849293 SAVSCIYRJMZDDH-ZMMAXQRCSA-N 495.411 0.446 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2 1800982436 FUCDQXOFAIJUID-MQJTVSLUSA-N 461.902 0.573 50 20 JCGD CCOC(=O)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)Cc1ccco1 1801234046 NCDIJWJLIWWPOB-KPEUIFRASA-N 457.911 0.427 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1 1804967889 GJIJSJNWBXXHHA-IFXJQAMLSA-N 490.480 0.202 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc1 1805094978 URNJCKMZEIVBTR-XXBNENTESA-N 473.342 0.856 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807367411 ZHIOBCKJUXTUAD-DENIHFKCSA-N 468.388 0.130 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374043 WPQSHNPWVSBUIO-LNGMVNIQSA-N 490.369 0.482 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1=O 1807375034 KSTDUPMLNHPITD-VGOFRKELSA-N 498.304 0.530 50 20 JCGD CN1CC(C(=O)N2CC[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2c2cccnc2)C1 1807451861 GSVHZHRIPIRXCG-XUZZJYLKSA-N 493.612 0.995 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1808463747 HXZUFLHOZHPQHU-GCJKJVERSA-N 459.547 0.970 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302572 LEFGGCIUKJZONW-KKSFZXQISA-N 475.509 0.412 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810309571 SCANXAMOCNZOBE-QFBILLFUSA-N 482.541 0.989 50 20 JCGD CC(C)(NCCC#N)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1814976354 JCNXVBDFXAZXOX-HNNXBMFYSA-N 455.349 0.331 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347690 KXXMLZPJUBLQRI-BBRMVZONSA-N 466.328 0.911 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348090 DEDXBXFGNCIQPY-IXDOHACOSA-N 483.355 0.804 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CC(c3ccccc3)=NN1)CC2)c1cccc(B(O)O)c1 1815360214 QEPWOTHBKJPYQN-FXAWDEMLSA-N 489.366 0.815 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360660 WNAGPWABLPVHPX-HNNXBMFYSA-N 453.333 0.631 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cncn2)[nH]n1 1818111784 HDHRGVGYVBYCSN-WJNWYLSZSA-N 452.479 0.828 50 20 JCGD NC(=O)c1ccccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1821159443 KFPJPOGIEMTPFD-LJQANCHMSA-N 461.287 0.808 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1824634615 GVJDRBHFOHNDOD-OAQYLSRUSA-N 457.380 0.762 50 20 JCGD COc1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1 1826176283 VTYSIHVDKNSRLT-FQEVSTJZSA-N 452.320 0.712 50 20 JCGD CN(C)C(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828550830 CWGANJSWQPRNRJ-VGOFRKELSA-N 480.949 0.126 50 20 JCGD C[C@H](NC=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551025 GEYAJAWIKIRQCG-ZJBJCVSYSA-N 480.949 0.173 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)ccc1F)CCO2 1830188309 GMLYAVCBNLTFRH-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1 1830538520 IECFDJGMBVQNHZ-DJJJIMSYSA-N 487.351 0.799 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830735642 KHJOFYUJVNLKAG-GHTZIAJQSA-N 488.990 0.079 50 20 JCGD C=CC[C@@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830738919 VKVIYEACSZWXSK-JKSBSHDWSA-N 489.997 0.902 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832899945 PKPDUYWEHVSVDI-MRXNPFEDSA-N 483.660 0.839 50 20 JCGD O=C(Cc1cnc2ccccn12)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833295073 SJMOCPDZOUMNEC-UHFFFAOYSA-N 489.385 0.442 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833308635 ZAYKHAVROBFJRN-LJQANCHMSA-N 487.022 0.411 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(C(F)F)c1)CCO2 1833318993 JALQTXHBWURGCG-QFIPXVFZSA-N 475.257 0.083 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)n1 1834821464 LOYVJGYXXRPSNN-SFHVURJKSA-N 487.307 0.853 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3)CCO2)C1 1834995423 ZAHOTBDDLCVCBK-PSQINSSGSA-N 467.526 0.820 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CC3(O)CCC3)CC2)CC1 1835117964 BSTABSTUZMOLIY-WPWMEQJKSA-N 472.590 0.997 50 20 JCGD COCc1oncc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835236301 BRNNAONYXFREDH-UHFFFAOYSA-N 464.567 0.379 50 20 JCGD Cc1cc(/C=C/C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)no1 1835777049 GBSNHRYBUGKBRK-NSCUHMNNSA-N 481.557 0.880 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4cccs4)on3)C2)C1 1835931223 IRSMJMKIWAWWTI-QHCPKHFHSA-N 497.338 0.467 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457793 RNEXEKSCQOQSOJ-XMMPIXPASA-N 497.508 0.053 50 20 JCGD C[C@H](Cc1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837461619 ZZHMDUGJLDTFCG-WAIKUNEKSA-N 471.514 0.227 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1837715173 ARWKQHMPBOVVPI-NRFANRHFSA-N 466.611 0.847 50 20 JCGD O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838458077 NVJCWNVCIJATDX-FDDCHVKYSA-N 475.929 0.313 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)cc4nn[nH]c34)CCO2)C1 1838620145 SGVHBQLWBHBMMA-AUUYWEPGSA-N 472.329 0.935 50 20 JCGD CCOc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1838884347 URQPHNZIRIZEAS-XMMPIXPASA-N 468.315 0.149 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839147184 ILPMDKIYHXWHHK-AUSIDOKSSA-N 496.008 0.806 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839152845 MDGZNGXGJCXARB-RTBURBONSA-N 463.362 0.836 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)C(=O)c1ccccc1 1839198561 ITMSRSBSIKKSDQ-PXNSSMCTSA-N 486.338 0.906 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839652271 WHNRCYIZRAHRJR-OALUTQOASA-N 461.346 0.808 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840036679 PWMLWNMCBMLWGL-LPHOPBHVSA-N 481.384 0.296 50 20 JCGD Cc1ccncc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840182237 ABHBQCKZXNRBFC-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1 1840955412 OBPXMJZHZRYFLB-AUUYWEPGSA-N 461.943 0.100 50 20 JCGD CCOC(=O)N(CC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)Cc1ccco1 1844265214 GOMJFLSYBBBTMT-UHFFFAOYSA-N 484.513 0.754 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCCNC(N)=O)NC(=O)OC(C)(C)C)C1 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CCC[C@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1802039813 SCUZRAQIQVRFTC-MTKWVWKQSA-N 460.535 0.015 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)Cn2ccnn2)[C@@H]1c1cccnc1 1808416521 AZHSBXJUABAUAR-YQNFXTCNSA-N 463.502 0.513 50 20 JCGD CC(=O)NCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808416837 SCJAEZTVTANYPX-FFRZPXIQSA-N 453.503 0.358 50 20 JCGD C[C@@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)N1CCN(C)CC1 1810306119 UPNHGMDDNQUBSC-KPLVRAHFSA-N 494.600 0.036 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@H]1c1cccnc1 1813071195 PUZPZILQGITOKY-UZLBHIALSA-N 480.529 0.523 50 20 JCGD Nc1c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)sc2nccnc12 1815253153 URQNZUCSJLFHFF-GFCCVEGCSA-N 494.367 0.949 50 20 JCGD Cc1nnc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)s1 1815339808 QDXZTSFNVYNEGD-ZDUSSCGKSA-N 457.346 0.451 50 20 JCGD CNc1nsnc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815347612 GQOZKZFYUOAZIK-LLVKDONJSA-N 458.334 0.256 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnnn1C)CC2 1817277578 YJQSYJGNKPSXLY-DLDHGHKKSA-N 455.504 0.631 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=N/O[C@@H]2CCCCO2)[nH]n1)c1cccc(B(O)O)c1 1817476566 WVTRHIKZJYUJER-PAIJHWHYSA-N 469.307 0.924 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc2nonc2c1 1818171524 NVSHRHUOKJAHLE-CQSZACIVSA-N 463.284 0.899 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819801733 RMKJGUPWRHYTSB-STQMWFEESA-N 468.543 0.900 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@H]3c3cc(NC(=O)CCC(=O)NN(C)C)n[nH]3)CC2)CC1 1822415499 JWCCJLXNQQBYID-SFHVURJKSA-N 474.610 0.555 50 20 JCGD COCCOCCOCCOCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2 1823067981 HRZPAKBRIIMKIL-GOEBONIOSA-N 494.010 0.741 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(N)=O)CC1)NC(=O)NCc1ccccc1 1830165347 CNOHEQIHMUQSGA-HXUWFJFHSA-N 487.605 0.621 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830358486 WLROJKRBULZPIP-SGSZHJQISA-N 467.954 0.842 50 20 JCGD CC(C)[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1 1832549959 YZPWOKICZZGQJR-GCKMJXCFSA-N 477.986 0.592 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cccs3)CCO2)C1 1833157006 BEWBRANLNUTIPS-QFIPXVFZSA-N 473.555 0.449 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cn1 1833437148 ZLFVBFZRYNSNOF-FZKQIMNGSA-N 457.325 0.729 50 20 JCGD CCOc1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1833951213 AMVGRJIZWVKCGR-UHFFFAOYSA-N 496.572 0.373 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3c(F)cncc3F)CC2)CC1)c1ccc(B(O)O)cc1 1834798305 GDRUNTNMMYVQJN-UHFFFAOYSA-N 472.301 0.539 50 20 JCGD Cc1ccn2c(C(=O)N3CCC(N4CCC(NC(=O)c5ccc(B(O)O)cc5)CC4)CC3)cnc2c1 1834799069 NBICBLMEYKFIPA-UHFFFAOYSA-N 489.385 0.822 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)n1ccccc1=O 1834823458 WAXXKGWSGHTNIS-KXBFYZLASA-N 456.337 0.651 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)nn1 1834824175 UUDAUXGEFQRSNS-SFHVURJKSA-N 458.357 0.888 50 20 JCGD C[C@@H]1CCc2c(C(=O)NC3CCN(C4CCN(C(=O)c5cccc(B(O)O)c5)CC4)CC3)n[nH]c21 1835359471 BWTSDSRJCKFQMY-MRXNPFEDSA-N 479.390 0.638 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cscn3)CCO2)C1 1836041311 VIZNIKKXWQYJDS-SGSZHJQISA-N 474.543 0.276 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1 1836399647 HTRWCUANWOQUFK-KXBFYZLASA-N 467.394 0.859 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837171193 DDLBWJLSWCFCDB-DNVCBOLYSA-N 466.336 0.973 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1 1837562772 PFWICNJCKDBFTJ-ZRGTWWFSSA-N 484.513 0.289 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c2ccccc21 1837713064 FINIGOOYBVNJGK-HSZRJFAPSA-N 490.633 0.648 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cncc(C(F)(F)F)c1)CCO2 1838183797 HKSXZOUZKNXQBA-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cccnn3n1)CCO2 1838422859 QROGUFGDAGQECS-GOSISDBHSA-N 452.309 0.584 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200464 IFVNDHYXAKWTBJ-MPGHIAIKSA-N 459.316 0.098 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)c(F)c3)CCO2)C1 1839271293 AAQDIWWNVQITPF-JOCHJYFZSA-N 491.907 0.861 50 20 JCGD CC(C)(C)Oc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839342645 KMEGRYMLOXIJTK-AREMUKBSSA-N 496.369 0.928 50 20 JCGD N#Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(Cl)c1 1839423485 DMWZXABUUUQRIC-QHCPKHFHSA-N 483.717 0.275 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc3ncccc13)CCO2 1839543254 MHXFZEJGRBFILP-QHCPKHFHSA-N 470.530 0.073 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1839964677 YTSYNBJQVRBQCV-ACJLOTCBSA-N 467.324 0.368 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1840034323 HXBLBWTZPMCSRB-BTYIYWSLSA-N 499.358 0.689 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)NC(=O)c3ccc(F)cc3)C2)C1 1840154315 RYULPGAOAMDPFA-QRFQSNJMSA-N 485.940 0.654 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3-n3nccn3)C2)C1 1840155266 VJBMOEIFNYLJBM-UWJYYQICSA-N 463.922 0.591 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1cccs1 1840374509 ZCBOHJRXBVXHDU-KSFYIVLOSA-N 458.345 0.302 50 20 JCGD CCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1840524317 WVWQBQBESQXUPR-XMMPIXPASA-N 491.589 0.216 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2 1843415516 VFJDIXUPSNKDMT-AEIQVQRHSA-N 490.561 0.600 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN 1847643989 RSCCRWVOGWHCCM-BZSNNMDCSA-N 486.529 0.079 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=S)NC(C)(C)C)c1OC 28716756 ROFLWNXBJZFNRY-UHFFFAOYSA-N 460.578 0.632 50 20 JCGD CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 108497782 GCPFEAUGAPEGCG-SFHVURJKSA-N 461.544 0.961 50 20 JCGD C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)C2=O 728213194 UTGADKASAZYVCH-AOMKIAJQSA-N 492.602 0.567 50 20 JCGD O=C(NNC(=O)c1csc(-c2cnccn2)n1)c1cccc(S(=O)(=O)N2CCOCC2)c1 728230093 QRBGIUPIYJCYEI-UHFFFAOYSA-N 474.524 0.696 50 20 JCGD C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cnc2c(c1)c(O)nc(=O)n2C 728502659 QCYCWGLXEFHUDI-GFCCVEGCSA-N 469.479 0.964 50 20 JCGD Cc1c(C)c(C)c(S(=O)(=O)NCCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(C)c1C 732307540 JMPYCNAWMZDLTE-INIZCTEOSA-N 459.590 0.479 50 20 JCGD CN(CC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1)[C@H]1CCS(=O)(=O)C1 747900637 TVMQCSWXGMCQCS-FCHUYYIVSA-N 470.595 0.880 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)NCc1cccs1)N[C@H]1CCS(=O)(=O)C1 751363325 SSEWLWGYDSHOKL-JTQLQIEISA-N 478.599 0.419 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccc2c(c1)OCCO2 770392602 CLDRVSORMMZFMX-UHFFFAOYSA-N 470.301 0.960 50 20 JCGD C[C@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OCC(=O)NNC(=O)c1cccs1 811679320 ARVFRCJVMIBTOK-LBPRGKRZSA-N 482.540 0.121 50 20 JCGD CCOc1ccc(-n2ncc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2C)nn1 818374351 JXZJEELDBOWHDO-KRWDZBQOSA-N 482.453 0.514 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1 914460612 HRUDNZAZFRGMBV-UHFFFAOYSA-N 484.538 0.180 50 20 JCGD COc1cccc(C[C@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n2nnnc2C)c1 915857571 IMPCKQZVXQPLTD-GOSISDBHSA-N 458.500 0.639 50 20 JCGD COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 916111130 ZAEXMHJJYRLGRW-UHFFFAOYSA-N 484.556 0.592 50 20 JCGD O=C(CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)NNC(=O)CC(F)(F)F 918364790 SMSXAAMUBGGIOX-UHFFFAOYSA-N 464.422 0.869 50 20 JCGD O=C(NNC(=O)[C@@H]1CCN(c2ccccc2Br)C1=O)N[C@@H]1CCS(=O)(=O)C1 919884369 FBIDZJMKDXURQT-MNOVXSKESA-N 459.322 0.320 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccccc1OC(F)F)N[C@H]1CCS(=O)(=O)C1 919886585 SNMJJUQAXUSMQO-AAEUAGOBSA-N 460.459 0.410 50 20 JCGD CCOc1ccccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032313 IYZYXAYBGXIQQH-HSZRJFAPSA-N 453.499 0.841 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(F)c1 1779034661 ROGLPJVNMKFQDJ-JURIHQFCSA-N 483.500 0.990 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374679 BZICLNKBILZFHW-KPAZRMRSSA-N 468.352 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1 1779599732 XUEMBNBFEMGRDP-XMMPIXPASA-N 468.558 0.748 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097815 MIYICDXSLQRCBP-GCJKJVERSA-N 492.485 0.115 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)c([N+](=O)[O-])c2)C1 1780873732 YFASNVIVIZOBJX-AUSIDOKSSA-N 498.496 0.740 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1782162633 FRXAIIZSSNLWFR-XMMPIXPASA-N 475.314 0.013 50 20 JCGD C[C@H](Nc1nccs1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 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O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)s3)C2)C1 1835929484 QWKGYJVCWBXPGD-FQEVSTJZSA-N 464.736 0.465 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1835931709 YKFOJQKWCPHXJE-VWLOTQADSA-N 490.325 0.140 50 20 JCGD Cc1ccc2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)ccc2c1 1835937081 NSYFLMXMSQLNII-AREMUKBSSA-N 489.337 0.607 50 20 JCGD CCc1nc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)co1 1835984341 ODZSUEDBYFWNEA-UHFFFAOYSA-N 454.336 0.416 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3nccnc3C(N)=O)CC2)CC1 1836050138 BKUJGJNWTKCCRU-HXUWFJFHSA-N 471.389 0.997 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(=O)Cn3nccn3)CC2)CC1 1836107526 WUZCUSPJMFSETC-UHFFFAOYSA-N 499.528 0.997 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1836215621 GLYSMJFTXAWJDU-KZDUYQQSSA-N 479.933 0.348 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2 1836473380 FVFGTAASFDBQHZ-CKFHNAJUSA-N 494.383 0.112 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1837459236 NAKGJFRWSZPFMU-XMMPIXPASA-N 496.499 0.689 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(F)CCCCC3(F)F)C2)C1 1837459434 OXJOGFCTFPZTHP-SFTDATJTSA-N 499.490 0.673 50 20 JCGD CCOc1cnc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)cn1 1837710088 HMWBWYVRQNMWLU-HXUWFJFHSA-N 452.584 0.797 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1837717972 UDMIPZRZCRJPHB-IERDGZPVSA-N 450.612 0.823 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1 1839197408 UKRHAMVYGPUCBS-BXWFABGCSA-N 475.311 0.876 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1839931158 MROZSPAWLWHSPF-BVZFJXPGSA-N 481.553 0.949 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nsnc3NC)C2)C1 1839961947 OAPASYYRSGOKRW-BDJLRTHQSA-N 462.370 0.823 50 20 JCGD COC(=O)[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)NC(=O)OC(C)(C)C 1840111968 SQRPJASYSUPPHO-RCDCFZSISA-N 495.932 0.434 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(OC)c1 1840185598 POTIHKLSPZCTOY-QHCPKHFHSA-N 478.546 0.147 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc3nnc(Br)n3c2)C1 1843126663 LYBRDNYGAGPWLP-UHFFFAOYSA-N 499.329 0.621 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@]2(F)CCN(C(=O)OC(C)(C)C)C2)C1 1843954888 GBSZDSWUKKBWTF-JOCHJYFZSA-N 469.558 0.912 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cc2)C(=O)C1 1844960750 OQQIOSACAHIRAO-UHFFFAOYSA-N 475.509 0.929 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCCS1(=O)=O 1848098622 MHSLYGYAJGUUBB-AJNGGQMLSA-N 463.984 0.898 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)c2c(C)nc3ccccn23)CC1 9747069 FRZWYZLVDXUXEC-UHFFFAOYSA-N 461.504 0.608 50 20 JCGD O=C(NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)[C@@H]1COc2ccccc2O1 16185035 KGXRPNCYTISTIH-SFHVURJKSA-N 478.552 0.865 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 17407207 SPDFVDDUROZSTL-INIZCTEOSA-N 482.584 0.438 50 20 JCGD N#Cc1ccc(C(=O)NCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 726983049 GQUQSCZULIVBTC-UHFFFAOYSA-N 499.549 0.089 50 20 JCGD COC(=O)c1ccc(F)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 727351101 DXCLMIZZSFNXNJ-UHFFFAOYSA-N 465.868 0.536 50 20 JCGD CC(C)(C)NC(=O)CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 728135105 XAEOZWSHNXSNDQ-UHFFFAOYSA-N 483.591 0.275 50 20 JCGD CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O 729277293 YKWXFYSYCXKJRA-ZANVPECISA-N 485.415 0.930 50 20 JCGD CCNC(=O)CCCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 729509501 RJWVPMNWGREGOZ-UHFFFAOYSA-N 454.549 0.094 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)Cn2ccc3ccccc32)cc1[C@]1(C)NC(=O)NC1=O 729667889 ZVNCTKFJTJXRJJ-NRFANRHFSA-N 471.495 0.714 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=S)NCC(F)(F)F 746397973 LIVAFRRHUFZJFP-UHFFFAOYSA-N 454.496 0.698 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)CCOc2ccccc2)cc1[C@@]1(C)NC(=O)NC1=O 747076356 CCDUBZTZUJVSJK-HXUWFJFHSA-N 462.484 0.528 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=O)C(=O)N2CCCC2)c1 748247553 ROTXGNCOLHWBHA-UHFFFAOYSA-N 451.549 0.311 50 20 JCGD Cn1c(=O)nc(O)c2nc(CCC(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)[nH]c21 749173691 LDIDOKYRMVDMSC-UHFFFAOYSA-N 453.381 0.844 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc([N+](=O)[O-])cc1I 751064808 YNDXTRCWJCSTPI-SSDOTTSWSA-N 453.214 0.395 50 20 JCGD O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)c1csc(N2CCOCC2)n1 915357433 ILZGBXKDFRBTTL-UHFFFAOYSA-N 456.484 0.012 50 20 JCGD N#Cc1cccc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 916092889 NFFXXPPACWUESM-UHFFFAOYSA-N 472.523 0.738 50 20 JCGD CCS(=O)(=O)NCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1 916517239 YUYYBGSJLKWYGE-UHFFFAOYSA-N 497.599 0.988 50 20 JCGD O=C(NNC(=O)C1CCN(C(=O)c2ccc(Br)cc2)CC1)N[C@@H]1CCS(=O)(=O)C1 1317993417 FSVPEOCRJDIXMI-OAHLLOKOSA-N 487.376 0.819 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C2)C1 1778126744 RHFAYZIQUSICIW-JOCHJYFZSA-N 467.567 0.056 50 20 JCGD CC(C)(C)OC(=O)N1CCn2cnc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2C1 1778368330 UTWHEECCUJZNNU-AOMKIAJQSA-N 497.980 0.677 50 20 JCGD COc1cc(C#N)cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779032163 DBFJLAJLXGILLK-QHCPKHFHSA-N 464.482 0.323 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1779072825 MVLLTWADRYTYGR-JCGIZDLHSA-N 453.319 0.547 50 20 JCGD Cn1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c(C(F)F)n1 1779373431 RBHIBOFJOHOIHN-OPAMFIHVSA-N 491.499 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1 1779613375 NEODFZYDUYOUHS-QHCPKHFHSA-N 476.497 0.228 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)CCO2 1780099093 RXZDQACDSACNOL-TYYYZTEESA-N 459.455 0.856 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3[nH]nc4c(Cl)cccc34)C2)C1 1780941654 SRZNELZUDPQICC-HSZRJFAPSA-N 497.943 0.901 50 20 JCGD COc1ccc(F)c(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1OC 1781820088 ONKSRHJITUOAAT-HSZRJFAPSA-N 472.278 0.280 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/N1CCCCC1)C2 1782215065 QNVXSZJVCCXTLW-LUIQLVGOSA-N 450.584 0.345 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1783193444 LHVYEIZDWLATCM-DZCCDHAISA-N 483.968 0.987 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1783536628 HCYBHKULUVUEAN-XIKOKIGWSA-N 471.377 0.505 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1 1783841274 RXWKVIYBBRJEDV-XUZZJYLKSA-N 450.300 0.204 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3CCN(c4cc(OC)ncn4)CC3)CCO2)C1 1783871058 MHHLAJYYKPTJEN-VGSWGCGISA-N 481.981 0.785 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccn3)[C@H]2C1)NC(=O)NCc1ccccc1 1785929197 VWOZOUYOQCCUKE-ZJOUEHCJSA-N 481.557 0.416 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccncc1C(F)(F)F 1787662007 NSWSIRCCQJNRMP-FNHZYXHNSA-N 477.248 0.687 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccn4cn3)[C@H]2C1 1788076249 YALDJMFGXKDLIX-DCPHZVHLSA-N 463.498 0.240 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21 1788611716 UJKFRDAKQWZYAE-AJHRRDMJSA-N 459.547 0.077 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726903 ZJZQSCVDPUHTHN-QESAQDPVSA-N 488.633 0.653 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C#N)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CC1 1792979014 QTYQXGSGCKNTKJ-YVSFHVDLSA-N 484.981 0.717 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CCO)NC(=O)OC(C)(C)C 1793087826 PYWBZXUNRLFKSN-AHDPXTMNSA-N 478.384 0.635 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N[C@@H]1C[C@@H]3CC[C@H](C1)N3C(=O)[C@H](O)CCl)C2 1793112428 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WUROQSMQNAFXGK-HGKCTWBKSA-N 499.329 0.823 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799344678 QMCLWAWQSPBRBW-XLWJZTARSA-N 494.358 0.902 50 20 JCGD Cn1c(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cccc1=O 1805308169 GEAFPRAYPRNWPP-AVRDEDQJSA-N 460.299 0.094 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1807352519 GIBWNBJRWQJWRX-ZVZYQTTQSA-N 477.974 0.592 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C2CCC(CO)CC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369855 XJLYSHXCJQAKCS-KUYBLMILSA-N 465.359 0.880 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)Cn2ccnn2)[C@H]1c1cccnc1 1807676812 LVOJOSREAFZGEX-YQNFXTCNSA-N 463.502 0.513 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)COCCO)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1808633646 SSQJCLLBZRHSHF-URXFXBBRSA-N 498.584 0.443 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3nc4ccc(F)cn4n3)CC2)C1 1809973459 LXMPEKDSFXAOKO-UHFFFAOYSA-N 465.294 0.707 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc3c(c2)CNC3=O)[C@@H]1c1cccnc1 1810301701 AGECJXZBANSXRE-VGOFRKELSA-N 499.531 0.957 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1ccccc1=O 1810302048 FDJPYOMYQOBEFI-NRJQMVOHSA-N 489.536 0.823 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1n[nH]cc1[N+](=O)[O-] 1810631222 FCHCCCRDGDZUTJ-BEFAXECRSA-N 464.247 0.026 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1 1812393594 PICSSXZXGOUOAA-CORIIIEPSA-N 455.309 0.414 50 20 JCGD CN1CCC(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1 1815335784 RAQPGDSXJIPTPN-QGZVFWFLSA-N 456.377 0.781 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1ON=C(c3ccccc3)O1)CC2)c1cccc(B(O)O)c1 1815356568 JJDDYPDBKZXHJR-KSFYIVLOSA-N 492.322 0.783 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCc2ccc(O)nn2)[nH]n1)c1ccc(B(O)O)cc1 1817474273 CRHGEAHFANEQRU-GOSISDBHSA-N 464.291 0.524 50 20 JCGD COC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)cn1 1817540194 IEBTZXHPWQUSKS-GFCCVEGCSA-N 495.521 0.863 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1 1819403089 UVAXDERKJRWKFT-INIZCTEOSA-N 490.484 0.776 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1823436791 PBLJOCARIJNTRW-PKOBYXMFSA-N 455.324 0.700 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1826829068 AVLPOVLDWRSUAM-STQMWFEESA-N 468.543 0.900 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CCC(=O)NC2)CC1 1828922179 QNVPHERUDVQEGT-QFBILLFUSA-N 456.547 0.445 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1830535412 NSYHMNWNOOMEOF-YWZLYKJASA-N 485.379 0.622 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1830543007 HBMFTVYEEVKECU-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD O=C(c1cccnc1OCC1CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724839 IQOYFCMPQRQOOM-LAUBAEHRSA-N 453.923 0.540 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1 1831654158 RENFFYVJRPBBMU-AUSJPIAWSA-N 463.959 0.693 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1831831874 CNYIMEYHGKTQMH-UKRRQHHQSA-N 451.915 0.300 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)n1 1833308318 RSJNEBNDXYLETN-GOSISDBHSA-N 451.955 0.825 50 20 JCGD O=C(CNC(=O)c1cccs1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1833834872 BQHSAAYSHMBQFS-INIZCTEOSA-N 456.996 0.649 50 20 JCGD Cc1ccc(CCC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1834797354 FKUZAQIWURHAJH-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCc3ccoc3)CC2)CC1)c1cccc(B(O)O)c1 1834801546 VXQWECLVTTVSGN-UHFFFAOYSA-N 453.348 0.777 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1 1835498287 CDGUNNXUZRDXNT-WIYYLYMNSA-N 463.922 0.591 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C3CC3)C2)C1 1835934449 SQWIMRUHZONVOP-VWLOTQADSA-N 464.327 0.628 50 20 JCGD CSc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836035258 YJQWLVHDHQDUNJ-UHFFFAOYSA-N 482.415 0.982 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1C 1837455919 GPCJHSMADRLQEX-VWLOTQADSA-N 481.553 0.615 50 20 JCGD COc1cscc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457984 ZRIRAJNPWDFZCN-NRFANRHFSA-N 475.527 0.139 50 20 JCGD COc1ccc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459512 GUECGJBYILKYRG-XMMPIXPASA-N 483.525 0.386 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)Cn3cncn3)CCO2)C1 1837648803 UVZSTCFVBLAYIG-MPGHIAIKSA-N 458.357 0.544 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)Cn3cc(Cl)cn3)CC2)CC1 1837928133 MIACNXQFFVRGOH-UHFFFAOYSA-N 489.964 0.847 50 20 JCGD CC[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838527385 PZHYJWQNICIUCI-DYESRHJHSA-N 465.459 0.361 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1C(=O)OCCO)CCO2 1838568573 JFGIEBMQDCCQGJ-HSZRJFAPSA-N 494.617 0.757 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839465207 HKCCTRPXMPFHMH-XMMPIXPASA-N 476.574 0.755 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839652089 MXJDWXFESNWBJL-NVXWUHKLSA-N 461.288 0.262 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCOCCOCCOC)C2)C1 1839966518 HYDVGQVHRZIECN-PXNSSMCTSA-N 495.411 0.686 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(S(C)(=O)=O)c3)C2)C1 1840030776 WINRIKDIZMFFEV-LIRRHRJNSA-N 489.388 0.944 50 20 JCGD C=CCCc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(O)n1 1840183519 JCFZKMDOWLJDMX-XMMPIXPASA-N 489.573 0.349 50 20 JCGD Cc1ccccc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840185513 RPZRWYRKCOUCKT-DEOSSOPVSA-N 460.575 0.757 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)CCO2 1840882625 LPPHBSOAOLHIPA-PEOGOYOCSA-N 489.997 1.000 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014796 CJAPGDSWMBWNOM-VDGAXYAQSA-N 483.374 0.971 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)c2sccc2S(=O)(=O)N2CCOCC2)cc1 12597739 CJDCOCYNNSAETA-UHFFFAOYSA-N 467.525 0.695 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(S(=O)(=O)N2CCOCC2)cc1 12803486 ATNUZJMUYNZVSJ-UHFFFAOYSA-N 481.556 0.075 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc2c(c1)CCN2S(C)(=O)=O 14890531 BYTUEBYCBZCULF-UHFFFAOYSA-N 465.557 0.685 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)Cn1cnc2ccccc21 17404874 JBQMHSGRUONAEY-UHFFFAOYSA-N 473.511 0.527 50 20 JCGD O=C1Cc2cc(S(=O)(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc2N1 26318748 SHJFXGDJYROOPI-UHFFFAOYSA-N 464.525 0.589 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)C1 728367845 AINPLPMPVJNRHK-LZWOXQAQSA-N 457.574 0.549 50 20 JCGD CCOC(=O)c1cc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)ccc1F 728502624 ONYBUPITZRIKRI-UHFFFAOYSA-N 487.531 0.941 50 20 JCGD C#Cc1ccc(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC)n(Cc3ccccc3)c2=O)cn1 728858994 HLOQOLLAARIYAI-UHFFFAOYSA-N 471.477 0.265 50 20 JCGD COc1ccc(N2CCN(CCNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)cc1 728951087 ZZZDIJVYTWMBFO-UHFFFAOYSA-N 482.589 0.854 50 20 JCGD Cc1ccc(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1S(=O)(=O)NCC#N 731182556 GTCUOXAEVMSSGZ-UHFFFAOYSA-N 450.498 0.275 50 20 JCGD O=C(NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21)N[C@H]1CCS(=O)(=O)C1 750936358 QUGKGKZXDKPWDS-JTQLQIEISA-N 483.304 0.569 50 20 JCGD O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1F 751264623 XOOBQWKHSRBNKT-UHFFFAOYSA-N 488.519 0.986 50 20 JCGD COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 751294823 SYMIILWLTDSEPT-UHFFFAOYSA-N 475.527 0.529 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)NCc1ccccc1CS(=O)(=O)N1CCOCC1 806971600 PBYMQHJKPIFPIG-UHFFFAOYSA-N 492.554 0.767 50 20 JCGD O=C(NNS(=O)(=O)c1ccc2nc(O)oc2c1)c1ccc(S(=O)(=O)N2CCCC2)cc1 812542416 ARTSLSJMMDWRQG-UHFFFAOYSA-N 466.497 0.941 50 20 JCGD Cn1nc(SCC(=O)NN=C2CCOc3ccc(Br)cc32)c(=O)n(C)c1=O 818269959 RUOUXQSQDCJGIS-UHFFFAOYSA-N 454.306 0.637 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccc[nH]1 822066085 IGKNOFAYYULWCR-RCBBPTIPSA-N 454.530 0.169 50 20 JCGD CCn1c(NNC(=O)CNS(=O)(=O)c2ccc(OC)c(OC)c2)nc2ccccc2c1=O 823904366 CMLLXCHZMRSGIV-UHFFFAOYSA-N 461.500 0.855 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1OC 906497351 XCYKZNITRHYSDP-UHFFFAOYSA-N 476.511 0.289 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CC/N=C2/NS(=O)(=O)c3ccccc32)cc1 913419240 JTCSGUKHLMLFTA-UHFFFAOYSA-N 499.578 0.997 50 20 JCGD Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1C 915789093 IMYMKAWTVARNIB-UHFFFAOYSA-N 488.975 0.734 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN2CCN(c3ncccn3)CC2)nc1 916267653 RSQJMJWUWUOYTB-UHFFFAOYSA-N 477.595 0.397 50 20 JCGD COc1cc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc(OC)c1OC 916391634 JEBZQAKCSHTHPG-UHFFFAOYSA-N 485.497 0.429 50 20 JCGD CN(CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)CC(F)(F)F 916581343 ZWEVTXWQCJIXJV-UHFFFAOYSA-N 481.497 0.536 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)COCC1CC1)c(=O)n2Cc1ccccc1 918016856 LUUITAKWHDMOHG-UHFFFAOYSA-N 454.487 0.002 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 919688909 JILGCDOVLKECNA-MRXNPFEDSA-N 460.578 0.292 50 20 JCGD O=C(NCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 919788309 ILPJKORJLQZMQB-UHFFFAOYSA-N 485.522 0.711 50 20 JCGD Cn1c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)nc2c1c(O)nc(=O)n2C 920358297 OSAKBTZYOZUPKP-UHFFFAOYSA-N 473.515 0.311 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C[C@H](C)n1ccnc1)c(=O)n2Cc1ccccc1 920502873 IAAQVWOCQRQKMY-INIZCTEOSA-N 478.513 0.423 50 20 JCGD CCCC[C@@H](NC(N)=O)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 920884686 HVVQWTDBMRCNGZ-QGZVFWFLSA-N 469.564 0.015 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1 1779032306 NCAGNGQELJXFAF-FQEVSTJZSA-N 455.500 0.152 50 20 JCGD Cc1ncncc1C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779668560 IPMJZMVDYHYTDF-DEOSSOPVSA-N 481.557 0.575 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)c21 1779996855 ZVCGUVUSVAHSBO-CJFMBICVSA-N 492.341 0.400 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3nc(C)no3)CCO2)C1 1780096862 JEURGTRTDYSPJG-OAQYLSRUSA-N 473.442 0.898 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3ccnn23)C1 1781226956 OQNOSIFIJFWAJD-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)c2ccccc21 1781329613 IBRMTSATLBJWCH-APWZRJJASA-N 469.311 0.860 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1781354810 IPPMEJNLXDDIQT-KZULUSFZSA-N 454.351 0.896 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)N1CCOCC1)C2 1781901261 KAQFNPBUTBLUKW-BUIAKZPTSA-N 462.385 0.324 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(C)(C)NCCC#N)C2 1782210888 WNRLHALCWJVDKB-VGOFRKELSA-N 450.584 0.155 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC(c3ccccc3)=NN1)C2 1782213283 LKJOHEBNZWTBCU-DNRQZRRGSA-N 484.601 0.640 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1782424274 OSXXIHBRAWBVDH-YJYMSZOUSA-N 454.936 0.823 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1782921744 JRLDVNADPROIRK-XDHUDOTRSA-N 454.307 0.828 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1 1783843456 NAVJYOGLAHSIAF-YKSBVNFPSA-N 465.510 0.522 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(C)nn3-c3cccc(=O)n3C)CCO2)C1 1783875961 QDCJBYSMQBYNKG-OPAMFIHVSA-N 477.949 0.577 50 20 JCGD CC[C@H](CC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)NC(=O)OC(C)(C)C 1783934960 OHYYYDKGTDXTGS-HXOBKFHXSA-N 483.610 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)CCO2 1783935471 USQXXIAWDMJWRZ-FQEVSTJZSA-N 451.455 0.550 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C1)CC2 1786984992 HKNHKQZUCWWTMH-WRVHCEFRSA-N 492.381 0.773 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786986439 AXWLDVMONMNIIJ-QQOZLPODSA-N 451.332 0.234 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccoc4c3)[C@H]2C1 1787352857 DFZOOOKGGNLQLY-ROOHIHILSA-N 464.482 0.733 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1 1787443584 MPXMAZUIBJQFLX-SBJFKYEJSA-N 451.923 0.776 50 20 JCGD CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)n[nH]1 1787508674 GKFKMJBQCNTTSH-MZONFKNFSA-N 455.519 0.699 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3cc4n(n3)CCNC4=O)CCC2)cc1)c1cccc(B(O)O)c1 1788145964 KUWVMNMAHFVCPR-UHFFFAOYSA-N 473.298 0.368 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21 1788469001 GQMWKVBDFLUNJO-MJDBTJCESA-N 450.330 0.062 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3Cl)C[C@@H]21 1788607874 REMCRTFPEVAYLR-ZLIFDBKOSA-N 458.906 0.641 50 20 JCGD CCOC(=O)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1F 1789227974 ZLAQXNFLAMVBMJ-NDXORKPFSA-N 498.316 0.589 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21 1789870253 AZHSLILEAOPNNM-FCMVICDYSA-N 468.341 0.919 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1789933875 DODSYBDIGALQNB-RGHULWKBSA-N 451.923 0.776 50 20 JCGD NC(=O)c1nccnc1C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1789947569 JPBYRCNWKYQKDP-UHFFFAOYSA-N 459.271 0.317 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1789955553 LTZLBWLIXBHDBM-WVIPKZCGSA-N 460.535 0.901 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1C(=O)Cc2ccccc2C1=O 1793053240 ULYQWBVHDREBEQ-HPNQWNLUSA-N 477.945 0.445 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2CN1C 1793829942 XUBWGVUXKYARLA-KQWVNABRSA-N 492.580 0.767 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2)c1ncn2nc(N3CCOCC3)ccc12 1795968607 DSPFTQUENJQLDY-YWVIFJGQSA-N 483.356 0.573 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCN(S(C)(=O)=O)CC1)C2 1796892535 NJYFTALJASRPEY-XMYAHUOOSA-N 492.602 0.430 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1CNc2ccccc2O1 1797675375 FPLACAPYTPVUMQ-JEZSTIGHSA-N 480.525 0.152 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)c1)C2 1797753163 WAVPKNNEBCBMFK-OPMZPASUSA-N 494.552 0.039 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)Cc1ccccc1NC2=O)c1cccc(B(O)O)c1 1799124094 UGRKXQURMOOZMB-ACDBMABISA-N 499.336 0.743 50 20 JCGD COc1c(C)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1C 1799692921 PEBAXORWTXOGFI-XEMDLRDOSA-N 467.526 0.828 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1800769102 QBBMKWJDIYPWHW-NQNKBUKLSA-N 459.971 0.823 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc(N(C)C)c1)C2 1801010597 KKARMTCCKJWMQU-GPVSGQMNSA-N 461.563 0.094 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)nc1 1801012519 MUHQNVJNZJVDDC-UPHUGPLXSA-N 461.563 0.510 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1C 1803288296 DGELXZNEBQCKPU-JTSKRJEESA-N 476.541 0.684 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1804367954 RLQPNTMMSOPMPS-REPLKXPHSA-N 459.352 0.923 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372771 HQDBSGCVDNCDOT-HYBUGGRVSA-N 484.325 0.366 50 20 JCGD COc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1 1807373915 DOZHOQMSIABTRB-UWJYYQICSA-N 461.287 0.193 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808357912 IVFFPYIQWHSUFG-AKIFATBCSA-N 473.342 0.046 50 20 JCGD 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1819656593 KJTXPGRPSFLDKJ-AWEZNQCLSA-N 453.224 0.341 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COc1cccnc1)CC2 1819792818 BMQNLYKUEWUJAY-LBPRGKRZSA-N 467.511 0.841 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(=O)Nc1cccnc1)CC2 1819797588 GEJNHEUANOCPSE-NSHDSACASA-N 480.510 0.401 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3cccc(B(O)O)c3)CC4)c21 1821177534 BAJXGPWRGHALMY-CQSZACIVSA-N 491.338 0.955 50 20 JCGD O=C1Cc2cccc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3cccc(B(O)O)c3)CC4)c2N1 1824201487 VDIBSKTYIKPJIS-HNNXBMFYSA-N 476.323 0.857 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1 1825454772 TVWKZXSTPVQVDJ-QFIPXVFZSA-N 499.398 0.712 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)N2CCOCC2)CC1 1827680192 FTQBDZKBYYNWTH-KLGNFRBTSA-N 488.589 0.391 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)nc1F)CCO2 1829528790 AROKCKQEFQGXQG-QESWDSMOSA-N 490.467 0.564 50 20 JCGD COc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1829587350 SFTPWMYEEQBJNI-OAQYLSRUSA-N 483.953 0.187 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(N)=O)CC1)NC(=O)NCc1ccccc1 1830165344 CNOHEQIHMUQSGA-FQEVSTJZSA-N 487.605 0.621 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnn(C)c3)C2)C1 1830538968 WUTITEHKVGSPAA-DNVCBOLYSA-N 457.369 0.840 50 20 JCGD Cn1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc2c1-c1ncccc1OC2 1830723944 VELWZTOCBWIKSJ-GAJHUEQPSA-N 490.944 0.649 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)CCO2 1830818619 IPAFWYBMXWIYRW-NXWNEQKCSA-N 452.935 0.339 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1)C(C)(C)C 1831094498 RJVKCUZYNRCEFF-OHNRDTAOSA-N 462.385 0.777 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1831655419 YINIKKJLRBADAX-RXVVDRJESA-N 457.015 0.630 50 20 JCGD Cc1nn[nH]c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549436 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CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1Cl)CCO2 1839324545 OICPRADPJQGPFF-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD Cn1nncc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839743267 HFDYKLFIDVDQSF-XXFFJTNUSA-N 472.452 0.770 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1840029529 ITAWAZPFBJYTFD-PBHICJAKSA-N 450.399 0.275 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])C2)C1 1840154118 LWOAMWPAONKOJK-LAUBAEHRSA-N 484.937 0.985 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1C 1840182987 YKOITFKTMIGFGF-DEOSSOPVSA-N 476.574 0.376 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840298610 ZCIISTSIKQZLTA-UQBPGWFLSA-N 466.343 0.315 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1840381396 IWMWHAUVFWEEQJ-WBMJQRKESA-N 462.370 0.527 50 20 JCGD CC(C)(C)OC(=O)N1CCC(F)(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1 1841078817 WPMYKOGIQZRSJR-UHFFFAOYSA-N 489.353 0.923 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2nccn(Cc3ccc(F)cc3)c2=O)C1 1842242310 MTBVLEQABMFXGH-UHFFFAOYSA-N 490.300 0.241 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cn3c(Br)cccc3n2)C1 1844149744 LBECZNFNSIHAQP-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CCCS2(=O)=O)C1 1845911267 GRURWKXDFJGUCS-UONOGXRCSA-N 463.984 0.899 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cn1nnc2ccccc21)NC(=O)NCc1ccccc1 1848003105 ZGYHSWVNLATBOX-VXKWHMMOSA-N 490.568 0.979 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1 27263523 OUYCHFSXXJLWJR-UHFFFAOYSA-N 473.511 0.995 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 726088482 HICKWASIVXGVSK-ZDUSSCGKSA-N 453.546 0.416 50 20 JCGD Cc1nc2ccccc2c(=O)n1CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728323768 QQLROAZMXJAYPN-SFHVURJKSA-N 452.423 0.236 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)c1 728527488 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NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(Cl)ncn1)C2 1779372712 ZBVXYJSDUYCGRZ-IIBYNOLFSA-N 473.921 0.570 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CS(=O)(=O)N1CCCC1)C2)[C@H](F)Br 1780773540 OGZNQWDBONZBFE-UKPHBRMFSA-N 484.388 0.616 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc(Br)ccc3O)C2)C1 1781194134 GIJCYSWFEBSEQE-OAQYLSRUSA-N 497.390 0.900 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781337518 SZLOBCSMBNIEKH-RRUGBERISA-N 495.346 0.276 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1782093851 KDEWGOQKLOXUJV-XMMPIXPASA-N 452.316 0.749 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCO3)C2)C1)NC(=O)NCc1ccccc1 1783489009 XHDBUZRLWQHUOJ-CVDCTZTESA-N 459.547 0.342 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C4CC4)on3)[C@H]2C1 1783757756 VYRKRNOZYPZTDF-AXHNFQJDSA-N 454.487 0.458 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1[nH]nc3c(Cl)cccc13)CCO2 1783934543 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JCGD COc1ccc(F)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791953627 QBBBGPCSEGVRQX-ZRCAFCQKSA-N 456.279 0.421 50 20 JCGD CC(C)C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)N1C(=O)c2ccccc2C1=O 1792979090 TWCQOERNAODBTM-RFGKEDTNSA-N 491.972 0.887 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(=O)N(Cc2cccs2)C1 1793976350 MFYWVJPHEMXODQ-MBZOWXSBSA-N 469.991 0.940 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(Cl)cccc3n1)C2)c1ccc(B(O)O)cc1 1795734479 QNHXEEBEMBKVAC-YVWYUNDQSA-N 468.706 0.185 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cc(F)cc(F)c3)[nH]n1)C2)c1cccc(B(O)O)c1 1795737183 BIWLMLMSZJHFNF-MFKICJERSA-N 496.279 0.552 50 20 JCGD O=C1CCc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)nc2N1 1796104511 GIQWOMSXQYYFSP-FVCICTRLSA-N 451.321 0.955 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C 1796336630 YYBHUSPWUJDKOF-BPKGMFCQSA-N 475.970 0.466 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798441747 GYRXKJKKCKQSNW-RUGDWHBFSA-N 482.516 0.895 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1799247705 FJIGMWAQIKVQRZ-RHBQXOTJSA-N 479.933 0.957 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)NC(=O)OC(C)(C)C 1799680128 KTKHTMYVGABDLM-ZHZXCYKASA-N 464.357 0.450 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cc(C)c(O)nc1=O)C2 1800644869 ISVBFQRMOLSZEJ-XFMPKHEZSA-N 457.325 0.020 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21 1800737456 IZIZJCKCTMUYOO-XJIHWEBXSA-N 493.605 0.062 50 20 JCGD CNc1nsnc1C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1 1804847808 PECZZYASWIRLEM-UHFFFAOYSA-N 458.548 0.737 50 20 JCGD COc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1805600270 QGZOSTHTLRTOIQ-GHTZIAJQSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C2CCC(CO)CC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369858 XJLYSHXCJQAKCS-ZDNGABSWSA-N 465.359 0.880 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1C 1807376171 UCUTUSDLKQUCBY-DYESRHJHSA-N 463.303 0.137 50 20 JCGD Cc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1811086566 NUULAGKDIXVTEF-OXJNMPFZSA-N 460.498 0.812 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1 1813032318 GTDMFQDDUVMKJP-LEAZDLGRSA-N 451.999 0.977 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[nH]n1)[C@H](O)CCl 1814869839 CYZUVZLEQFBLPY-CHWSQXEVSA-N 456.912 0.467 50 20 JCGD COc1cccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815350527 XFIZIXOALGXHHS-INIZCTEOSA-N 466.328 0.695 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3nccc4nc[nH]c34)sc2C1 1816899762 ULOJRHQWGANXPP-SNVBAGLBSA-N 477.510 0.953 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)[C@H]1SC(=N)NC1=O 1818100572 JZZAFXDWVJWFHT-PLQHRBFRSA-N 478.579 0.577 50 20 JCGD CSCC[C@@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800324 NBRCNPSOEMQKNM-QMTHXVAHSA-N 464.573 0.481 50 20 JCGD CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(=O)N(C)C)[nH]n1)NC(=O)NCc1ccccc1 1820710474 UJHZGTKTSGUYAW-SFHVURJKSA-N 484.561 0.836 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1825730675 OHKZQZAULTULGK-FQEVSTJZSA-N 454.336 0.656 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060492 LTBUUSPDSBYIIB-XXBNENTESA-N 460.336 0.216 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCN(C)CC2)CC1 1828442761 BXJDADQBFNNUQB-YXMXGMKXSA-N 485.633 0.988 50 20 JCGD Cn1cnc(C(=O)N2CCN(C(=O)OCc3ccccc3)[C@]3(CCN(C(=O)[C@@H](O)CCl)C3)C2)n1 1828667155 CJEGVDBPLGEVLA-JTSKRJEESA-N 490.948 0.481 50 20 JCGD N=C1NCCN1CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1 1828984000 XMHUGPNQFLIDFK-XMSQKQJNSA-N 494.955 0.813 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2)C(=O)C1 1830730846 FEMIDDSOFUGWNI-PGRDOPGGSA-N 478.933 0.469 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1 1831282942 HXAHJMCPNXRZDP-RTBURBONSA-N 477.587 0.496 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1833263032 GZCHLEKAZLPXTO-FOIQADDNSA-N 475.428 0.240 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833313682 NAABFZBFXAWZNZ-QZTJIDSGSA-N 491.029 0.433 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCN(C)CC3)CC2)CC1 1834623335 HQZJVRUKAZWONM-FQEVSTJZSA-N 458.047 0.449 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc(F)nc1 1835883855 KQHMZYWIIGEQJA-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD O=C(c1ccc(-c2ncc[nH]2)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835941963 UXGGVVGWEWXPCV-VWLOTQADSA-N 490.325 0.140 50 20 JCGD CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1836294312 LPFXVSVOHQGKRO-UHFFFAOYSA-N 478.402 0.931 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cnn2cccc(F)c12 1836498221 CUXJVKMUBPPSFE-UHFFFAOYSA-N 493.348 0.652 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](N)Cc3cccnc3)CCO2)C1 1836506187 SDTZXMIXBJJVHL-FUHIMQAGSA-N 469.380 0.581 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3csnn3)CC2)CC1 1836942919 QEXFCMOYTOISRK-UHFFFAOYSA-N 459.532 0.463 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC#N)C2)C1)NC(=O)NCc1ccccc1 1839054388 WQNHRJATVCVQAU-HSZRJFAPSA-N 472.546 0.093 50 20 JCGD O=C(c1[nH]nc2ccncc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199709 SJNOEVSOJBYWKM-RHSMWYFYSA-N 456.272 0.718 50 20 JCGD O=C(CSc1ncccn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199751 SWTYQHJKPDRSHH-XJKSGUPXSA-N 463.329 0.716 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4cc(C)ccn34)CCO2)C1 1839602314 ACYDRACEOXTJHD-IERDGZPVSA-N 450.923 0.967 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)ccn3C)C2)C1 1839966251 ZDJSQRBEWCXCHY-HNAYVOBHSA-N 456.337 0.629 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(OC)c(O)c3)C2)C1 1840149475 QNTWNLZYFUKSIK-HRAATJIYSA-N 456.923 0.654 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1 1840155165 RONVBLOWCRDPQY-KUHUBIRLSA-N 457.867 0.624 50 20 JCGD Cc1cc(C)c(OCC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1 1840182291 DZRJEEWETKJBLG-VWLOTQADSA-N 490.601 0.820 50 20 JCGD CC(C)C1(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CCC1 1840612620 KUWMIYYFNMQBJR-QFIPXVFZSA-N 459.547 0.581 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840854813 OBUUHBOIZKWVMP-JJRVBVJISA-N 452.321 0.438 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012424 NTDKROUEZNMWTI-OSPHWJPCSA-N 469.347 0.583 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccoc2I)C1 1843136272 CJVLMCFQEFQIPW-UHFFFAOYSA-N 480.067 0.695 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2 1843416712 SBBDJTGOTGFSEO-CIRUFVMISA-N 490.561 0.600 50 20 JCGD NC(=O)NCc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 21197819 CUNZJFWKGLVFAG-UHFFFAOYSA-N 489.554 0.270 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNC(=O)[C@@H]2c3ccccc3C(=O)N2C2CC2)n1 728732639 APEHHBVGXMTHCN-FQEVSTJZSA-N 485.522 0.160 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cn3ccc4ccccc43)cc2)CCN1 729451055 GLSKQKXHMWVHBT-UHFFFAOYSA-N 455.496 0.223 50 20 JCGD CCn1c(CCC(=O)NNC(=O)N2CCOCC2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 745987953 NUTJIOWIVRFDMK-UHFFFAOYSA-N 494.574 0.083 50 20 JCGD CCCOc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2cn(C)c(C)n2)cc1OC 750662279 CPZDDDJMPOYXTL-UHFFFAOYSA-N 453.521 0.656 50 20 JCGD Cc1ccc(C)c(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1 913449255 OSRJMNMKKPEJCD-UHFFFAOYSA-N 463.512 0.969 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)cc1OC 914831051 BVMYHYHMSBDPJP-JKSUJKDBSA-N 467.544 0.671 50 20 JCGD O=C(CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)NNC(=O)CN1CCCS1(=O)=O 916033814 HJIUQYSNOYZNAP-UHFFFAOYSA-N 499.637 0.967 50 20 JCGD CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)CCN3C[C@H](C)O[C@H](C)C3)cc2[N+](=O)[O-])CC1 920279611 JBPWAKIJVGDMSJ-IYBDPMFKSA-N 476.534 0.524 50 20 JCGD Cc1ccc(COCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1779030229 KXKLDTSIVVKQNP-VWLOTQADSA-N 481.553 0.962 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1779342314 GJMHUABDYWLBFI-XQQQEEOESA-N 483.529 0.503 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)n1 1779505891 QYEQLVNNBQDSNU-WHSLLNHNSA-N 454.955 0.400 50 20 JCGD CCc1cc(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)n(C)n1 1779623170 XDRQWLMRZLVZSN-NMWDDECMSA-N 455.519 0.560 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OCCCO)cc3)C2)C1 1780127021 UNOOPBGXNGADSM-XMMPIXPASA-N 483.525 0.204 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)C#CC3CC3)CCO2)C1)NC(=O)NCc1ccccc1 1780970520 ZPCVVHKGLUIOPW-DEOSSOPVSA-N 453.543 0.576 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781331379 PZHZBCDIRWCVQL-MNUAXYBXSA-N 494.358 0.877 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2ccncc2=O)C1 1781481122 NIHDJRARYZCSCW-SPYBWZPUSA-N 455.353 0.788 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)CC1 1782213869 AATAVHUBUMPNAG-NTKDMRAZSA-N 495.621 0.742 50 20 JCGD Cc1ccn2c(C(=O)N3CC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)cnc2c1 1782488744 UPUAUBWEIYBFDG-QHCPKHFHSA-N 463.498 0.399 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C3CCN(S(C)(=O)=O)CC3)CCO2)C1 1783349887 VGAUBOJINITBMA-YJBOKZPZSA-N 480.425 0.661 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783933687 VPGYKEREXNFGIV-SBUREZEXSA-N 481.594 0.659 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1786844174 WXCRDVYHCNPLPO-JONQDZQNSA-N 491.427 0.993 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(N4CCN(C)CC4)CC3)[C@H]2C1 1789804613 GRHVUFVCLQWOFQ-XSLAGTTESA-N 471.440 0.777 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789875211 REEZYHGTQWBUFR-JBACZVJFSA-N 479.342 0.215 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C[C@@H]21 1790961343 ZYHCEGFBVIMKQR-QUSNUVHPSA-N 477.352 0.634 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791293698 BAIWGWUYEFDVCB-SZMVWBNQSA-N 474.537 0.748 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792975005 GPQGFZBQDBFURB-VJTDZRGJSA-N 454.351 0.308 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cccc(Br)c3n1)C2)[C@H](O)CCl 1792983853 QZGWKYVWWDCIRY-BAESOJJISA-N 471.739 0.900 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1C[C@H]1c1ccc(F)c(F)c1 1793045565 JJEQHXOGMVNJSK-UVNIEQTBSA-N 470.281 0.652 50 20 JCGD COC(=O)[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)NC(=O)OC(C)(C)C 1793116909 YUMDLOCVVLZSHT-KHMAMNHCSA-N 461.943 0.681 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncccn1)NC(=O)NCc1ccccc1 1794816021 HUEZBTJCCJEMIP-OPVJXMOQSA-N 467.530 0.026 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)C(C)C 1796367673 MXKNZAWEMKHUPH-FHULIHMCSA-N 490.960 0.482 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccs3)on1)C2 1797751718 QKPWELBJQXFHSK-DBWKPXFBSA-N 482.522 0.919 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799341911 ADVRSVGMHJMNKL-ULYCIKHUSA-N 486.338 0.446 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799869809 MCWPTQORJYOCEY-WJMWBRGCSA-N 482.589 0.899 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCN(C)C(=O)OC(C)(C)C 1802134704 MGJUIYIEIZNAHA-UPHUGPLXSA-N 483.610 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)C2 1802338027 MUQLOSBVYQPTEI-FLXSYLCISA-N 481.594 0.225 50 20 JCGD COC(=O)CSCC(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1 1806033967 AEUUMHSKJIQZCL-UHFFFAOYSA-N 463.560 0.436 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CSC(=N)N)[C@H]1c1cccnc1 1807002469 SEXGGLRNHJGWFR-MCUAKSGYSA-N 470.559 0.848 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807366889 VRQBXUNAIGCEKS-LDQXTDLNSA-N 496.373 0.994 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375457 OYBHYULFFIQCLG-XLIONFOSSA-N 474.282 0.519 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1810120221 GARMAJOPPKWWHJ-IGHLBYLOSA-N 451.593 0.619 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)no2)[C@@H]1c1cccnc1 1810985368 PUFOFBXMVGWNHP-UGSOOPFHSA-N 451.443 0.407 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCc2ccc(O)nn2)[C@H]1c1cccnc1 1812327067 QRKMARFGXWSNDK-OPAMFIHVSA-N 490.524 0.528 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)COc2cccnc2)[C@@H]1c1cccnc1 1813071374 SZVZBAQARXAUPF-WZONZLPQSA-N 454.531 0.934 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CNC(=O)C(F)(F)F)[C@@H]1c1cccnc1 1813099439 SVYTYUJDEMDADE-DYVFJYSZSA-N 493.446 0.078 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813411346 KDPKQWSJFKGNPX-AGHHOFFYSA-N 461.331 0.614 50 20 JCGD O=C(Cc1ccc(O)cn1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813496820 VVTQRRGVPJTEPZ-WZONZLPQSA-N 460.299 0.424 50 20 JCGD Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc(O)n1 1815341400 YFNJTKNBOXUQAA-OAHLLOKOSA-N 452.301 0.772 50 20 JCGD CC(C)(NCCC#N)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1817315847 URHYFRUZICWEPL-SFHVURJKSA-N 452.324 0.677 50 20 JCGD COCCn1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n1 1817475174 LFLGMVQROSHGGV-IBGZPJMESA-N 466.307 0.552 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=N/O[C@H]2CCCCO2)[nH]n1)c1cccc(B(O)O)c1 1817476569 WVTRHIKZJYUJER-WEEQGOHXSA-N 469.307 0.924 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1n[nH]cc1[N+](=O)[O-] 1819656534 HDZIDSVOFADFMQ-CQSZACIVSA-N 453.224 0.341 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1819695250 UDRWNORNKDMJBU-RYUDHWBXSA-N 453.569 0.136 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797729 IJAXJUOIJWIYBJ-BZNIZROVSA-N 458.544 0.941 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/C(=O)NCc3ccco3)sc2C1 1820061654 YORRHODKOCBBBG-HSBSLETESA-N 488.570 0.894 50 20 JCGD CC(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548288 ICEMNCGSLBFYNF-LAUBAEHRSA-N 451.907 0.627 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cn3cccnc3n2)CC1 1828561728 ILKYCAIBHKJFIE-NRFANRHFSA-N 461.331 0.956 50 20 JCGD CCOc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1829550616 MEWJQRCQHQZTNZ-QFIPXVFZSA-N 489.554 0.529 50 20 JCGD CNc1nsnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1829748695 DEWLLQOALPEFIE-BZNIZROVSA-N 462.370 0.681 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1 1830345271 GVFGMUQHENOGLH-OTZYPNAKSA-N 499.524 0.361 50 20 JCGD O=C(C1CCN(Cc2ccccn2)CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726296 QAGNBSJFAJRWCB-NFBKMPQASA-N 480.993 0.350 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830730750 CSMKKLGGORWIBF-KQDGPHEJSA-N 493.960 0.390 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830734915 AFEBAAYOGWNIHR-MGPUTAFESA-N 454.886 0.452 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1832904266 YEVMOAXNZMOWCD-DEOSSOPVSA-N 482.541 0.091 50 20 JCGD Cc1csc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1832980038 OZAZKHXCRJGCSL-QHCPKHFHSA-N 472.372 0.439 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C(F)(F)C(F)F)CC2)CC1)c1cccc(B(O)O)c1 1834799821 DRRXZTQXYGYJKC-UHFFFAOYSA-N 459.249 0.452 50 20 JCGD Cc1cc(CCC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)ccn1 1834799851 IDHRPAMUFUKXGU-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)/C=N/N3CCCCC3)CC2)CC1)c1cccc(B(O)O)c1 1834801040 HXRWTFDSBPGALF-NLRVBDNBSA-N 469.395 0.023 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C#N)CC1)CCO2)NC(=O)NCc1ccccc1 1835345727 XEPVUVQPQWDSRY-DEOSSOPVSA-N 484.557 0.093 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3[nH]nc4ncccc34)CC2)CC1 1835737104 WOLKPFNCFJNCHX-UHFFFAOYSA-N 491.556 0.455 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@]3(F)CCCC=C3F)C2)C1 1835933994 KVQQLLSRQXWCOB-FGZHOGPDSA-N 464.274 0.182 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3C(F)(F)F)C2)C1 1835936904 JEBPNBBXUZATFC-NRFANRHFSA-N 493.247 0.164 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cnnn3)CCO2)C1 1836150246 ILVJYTYBONNBJK-QLKYELJLSA-N 473.440 0.015 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4=O)CCO2)C1 1837140113 PKZMILWEOHWVTN-MPBGBICISA-N 480.315 0.675 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n(C)n1 1837462486 RRTIZLVNMDPWFK-UHFFFAOYSA-N 454.336 0.334 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1837479718 QCNUDCGVLFLBJA-KBXCAEBGSA-N 456.341 0.518 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CCN3CCN(C)CC3)CC2)CC1 1837807189 ALYKHNQYFVPPJV-FQEVSTJZSA-N 459.031 0.876 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C[C@@H](N)c3cccnc3)CC2)CC1 1837899899 AZFBCUMXHMSTDQ-OAQYLSRUSA-N 474.606 0.843 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)Cc3ccccc3)CC2)CC1 1838395522 YNKJTHHCYNGQKL-QHCPKHFHSA-N 495.580 0.901 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1839153167 CLGOFMKWAABGBV-RTBURBONSA-N 459.330 0.713 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1839154051 ZTFIEJCZZHYQIB-GJZGRUSLSA-N 465.252 0.785 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3ccoc3c1)CCO2 1839535163 LXLJQWLLFOWPHC-XMMPIXPASA-N 464.283 0.496 50 20 JCGD Cc1cccc2c(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)n[nH]c12 1839596864 WSAGMHRFAVMQAV-XMMPIXPASA-N 493.524 0.254 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCS1(=O)=O)CCO2 1839784336 MIDAZGDEFUMLON-GRDNDAEWSA-N 467.382 0.194 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@@H]1C[C@@H]3CC[C@H]1C3)CCO2 1839916685 RMSCRCCODWMRAH-XQQXVUDOSA-N 450.580 0.642 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1 1840030713 UQOLLGKBHNEDTN-AUUYWEPGSA-N 466.336 0.671 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCOCCOCCOC)CCO2)C1 1840076342 GHLGOAGPILXERN-NQIIRXRSSA-N 464.987 0.920 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(N(C)C)c3)C2)C1 1840185473 RIKVFJQHCZVPBG-QHCPKHFHSA-N 461.563 0.196 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840190939 WVWVPPASUBKKIO-GOSISDBHSA-N 457.351 0.316 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844265255 LFQGHWCKQXACIN-OYLFLEFRSA-N 484.557 0.759 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)C[C@](C)(O)CC(=O)O)C1)NC(=O)NCc1ccccc1 1846381780 ILXMEJKJWJQPLK-QFIPXVFZSA-N 475.546 0.152 50 20 JCGD CCn1nnc2c1[C@@H](C(=O)N1CC[C@H]3[C@@H]1CCN3C(=O)[C@@H](O)CCl)CN(C(=O)OC(C)(C)C)C2 1847556833 QEIMJFIIKZHARV-HJWJTTGWSA-N 496.996 0.934 50 20 JCGD Cc1c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nnn1-c1cccc([N+](=O)[O-])c1 105554614 YIHAOXMVMYCHKZ-UHFFFAOYSA-N 458.460 0.852 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)NNC(=O)CNC(=O)c2ccco2)N(C)c2ccccc21 725740509 GLQICUPFUXORJU-UHFFFAOYSA-N 450.455 0.827 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=S)NCC2CCC2)c1OC 727866515 MAHQUFKNTPKIPG-UHFFFAOYSA-N 472.589 0.634 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)[C@@H](C)N1CCOCC1 729624593 YIRJGPCXEIHXOM-JKSUJKDBSA-N 453.565 0.524 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 730821703 ZYBYUJUYDVZPDW-INIZCTEOSA-N 478.527 0.759 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)COCC(=O)NCc2cccnc2)c2ccccc2c1=O 731185640 BXPYBNNKIFLKCD-UHFFFAOYSA-N 452.471 0.466 50 20 JCGD C[C@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)C1 731218494 BSBYRMURZQPFLP-IRXDYDNUSA-N 493.634 0.647 50 20 JCGD CS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 733038050 CFKGJCJQTYIDDW-GOSISDBHSA-N 469.523 0.630 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCc1nccs1)N(S(C)(=O)=O)CC2 747987974 ZSINVJOREURCGD-OAHLLOKOSA-N 497.599 0.982 50 20 JCGD CS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1Cl 783621804 VXCODVJULDGNNB-HNNXBMFYSA-N 468.871 0.888 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCn2cnc3ccccc3c2=O)cc1 792988193 UDACIWZAQVQYQY-UHFFFAOYSA-N 457.512 0.563 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)C[C@H](C)O1 818030003 YLVAQPPBYDCVTO-GJZGRUSLSA-N 488.010 0.782 50 20 JCGD O=C(CSc1nnc(N2CCOCC2)n1C[C@@H]1CCCO1)NNC(=O)c1cccs1 827873127 OLWODXDUWCEAMU-ZDUSSCGKSA-N 452.562 0.909 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 863998545 CVZAYAADGBCTNT-UHFFFAOYSA-N 469.541 0.547 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1 864017827 AXGCEHNJICRSMO-UHFFFAOYSA-N 464.525 0.410 50 20 JCGD Cn1nc(C(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)c2ccccc2c1=O 915895020 UBCWNCNFALBOFZ-QGZVFWFLSA-N 450.499 0.779 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2S1(=O)=O 916766786 LVTUDMDDZLVTOH-UHFFFAOYSA-N 461.452 0.324 50 20 JCGD O=C(CNC(=O)OCc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 921298618 DRAIBHXACFXTQE-UHFFFAOYSA-N 476.511 0.395 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CSc1cccc[n+]1[O-] 1318364663 XTUVMOHDYNIDQR-UHFFFAOYSA-N 480.568 0.213 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cccnc4n3)C2)C1 1778432849 YSSUZZXWYIMCGU-QHCPKHFHSA-N 461.482 0.386 50 20 JCGD CC[S@@](=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1778822630 JZHBKMDTZPQDDF-OHWKKVTOSA-N 493.630 0.321 50 20 JCGD Cc1ccc(OCCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779029691 WVWSQJGGBAMFJV-XMMPIXPASA-N 467.526 0.906 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccc(O)cc1 1779036554 AROFENQJFVQMIS-CMJOXMDJSA-N 453.499 0.638 50 20 JCGD O=C(CS[C@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779409433 YQNXNMALVWRQJF-UNWVZKJWSA-N 476.404 0.754 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)CC(C)(C)O)CCO2)NC(=O)NCc1ccccc1 1780969865 KSEINUNZEIYMCH-QHCPKHFHSA-N 461.563 0.324 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)[C@@H](O)C1 1781115834 WWEVXNAPLFUDGL-PNLZDCPESA-N 485.654 0.896 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781230000 MDLJTXOPSSRIPO-MJXNMMHHSA-N 458.346 0.661 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)n1 1782211953 IYTUFJOZZIXTIR-OPAMFIHVSA-N 492.533 0.499 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2C[C@@]2(F)Cl)C1 1782287559 PYUKQRKQUQRMQO-IONDEXAJSA-N 453.902 0.737 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1782629228 LFKATJXUQKWQSK-FTCDTSOASA-N 486.573 0.202 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(I)cnn3C)CCO2)C1 1783874132 CJBUXVYPRYSXPB-ZBEGNZNMSA-N 496.733 0.722 50 20 JCGD COc1ccc(Cl)c(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1F 1784054868 SONBGXCXYSQBGJ-HSZRJFAPSA-N 490.724 0.854 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21 1784444229 IKVOOULERSDONK-QMVSFRDZSA-N 454.387 0.077 50 20 JCGD COc1cc(Cl)cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1785137933 VNRYHOLAKKSTQS-JOCHJYFZSA-N 458.707 0.786 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1785581914 KMBOZPUUQXUIFY-WDSOQIARSA-N 489.573 0.613 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4[C@@H]3O)C[C@@H]21)c1cccc(B(O)O)c1 1786982853 IVBZWRGIDOPDMS-NHKCCNDQSA-N 478.354 0.256 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4C3)C[C@@H]21)c1ccc(B(O)O)cc1 1786982905 CMHQVPZDEZDJBU-WMIMKTLMSA-N 462.355 0.765 50 20 JCGD Cn1ccc2cccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)c21 1786982933 IDCNTLKVJQXJQJ-NYVOZVTQSA-N 461.327 0.765 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3ccccn3)[C@H]2C1 1788778532 PTOXSXMEJAGLPZ-NUMGXUNFSA-N 481.557 0.996 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(N4CCN(C)CC4)CC3)C[C@@H]21 1791060691 HZQFVMGNSDQBKM-QZWWFDLISA-N 457.413 0.530 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1792452923 XVIYAWBCYKMHQQ-KWCBCURJSA-N 489.997 0.184 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(Br)ccn3n1)C2)[C@@H](O)CCl 1792981144 FUEWCEBCZZDBIF-OJXGSEEGSA-N 471.739 0.900 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793456371 DQCJVTOZOLOWJR-RSPOEFSDSA-N 472.590 0.886 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cccc([N+](=O)[O-])c1 1793699975 XHDNVMOWVMCIIB-VPTLXERWSA-N 482.497 0.429 50 20 JCGD Cc1ncc(Br)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1794317349 VLKCLDRPEDAEIK-CCWDJLKJSA-N 488.147 0.349 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797958944 CINBGVGGENZMQF-KRXQYRFLSA-N 486.642 0.196 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnncc1C(=O)O 1798101304 PHQYYGPYLMJEIS-DBWKPXFBSA-N 499.436 0.525 50 20 JCGD CNC(=S)NCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798446282 SUCAOTSLUVWICG-REPLKXPHSA-N 489.646 0.455 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2 1800640470 ZQJAJGCMQIBRIV-APLFDDQLSA-N 483.363 0.756 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NCc1ccc(OC)cc1)C2 1800979749 YRBYOYUABBBQAR-ZRAXVTTISA-N 481.977 0.935 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Oc1cccnc1 1801402551 XCOZBSDODRPUAG-WYQRWVTPSA-N 468.514 0.573 50 20 JCGD COc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1805207769 GFWGTLZYBNCFJE-XMSQKQJNSA-N 460.299 0.798 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1807360951 DUTARWQDPFOWOV-AVRDEDQJSA-N 488.309 0.576 50 20 JCGD COc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1 1807373903 DOZHOQMSIABTRB-DYESRHJHSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1n[nH]c2c1CCCC2 1808042611 KQCKINNNJLWPBH-WZONZLPQSA-N 473.342 0.997 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)COCCO)[C@H]1c1cccnc1 1808611859 BFCHKEBGHSIIOK-MFWRVWTKSA-N 456.503 0.230 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809978659 IRLRFSYNHJQNHQ-QGZVFWFLSA-N 451.336 0.502 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810249664 NQLHYSUOXOIUHF-UXPWSPDFSA-N 466.542 0.973 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CCC3(CCCN(C(=O)[C@@H](F)Cl)C3)CC2)N1 1810913530 QSUOZRVFODCNKW-SQWLQELKSA-N 474.986 0.932 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1812774385 RKSRIQUYMSTRTN-ZQIUZPCESA-N 466.336 0.813 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1C 1813073648 SBBAIQNKUALLKE-KKSFZXQISA-N 457.535 0.516 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3nc4ccccn4n3)sc2C1)c1ccc(B(O)O)cc1 1816650695 XVMWLYXDXFZHAE-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3ON=C(c4ccccc4)O3)sc2C1)c1cccc(B(O)O)c1 1819586977 YWNXRJFGZHLYTQ-KSFYIVLOSA-N 492.322 0.783 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cn1 1819797204 PLGLJRZYWBYEFY-GFCCVEGCSA-N 495.521 0.863 50 20 JCGD C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](O)N3CCOCC3)sc2C1 1819877389 UAMVKPYZKFCSSJ-GDLVEWKHSA-N 461.382 0.737 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1 1824186213 PFAZFQDLURNJPH-QYZOEREBSA-N 453.971 0.676 50 20 JCGD CSCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1826130238 BYHGOJZJUVSQJX-HZMBPMFUSA-N 464.573 0.481 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCc2nc(NC(=O)CNC(N)=O)sc2C1 1828324430 MXEZAAREXXSGSG-JTQLQIEISA-N 476.471 0.871 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830722355 AQIOCSITFRVQCY-GCJKJVERSA-N 470.950 0.693 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1831640375 LXJJFVCKCHJVRY-HRAATJIYSA-N 454.955 0.999 50 20 JCGD CC(C)(C)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549225 HUPLUTFBPYVXAY-KSFYIVLOSA-N 491.029 0.963 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(NC(C)=O)n3)CCO2)C1 1833339742 RHMRLUREULKGBN-FOIQADDNSA-N 454.911 0.364 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(=O)c1ccco1 1833754461 VKWHIMHBNSQLAY-UHFFFAOYSA-N 453.304 0.028 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(C)C 1834798688 YDMAHXCZSCCCML-JOCHJYFZSA-N 473.379 0.139 50 20 JCGD O=C1NCc2cc(C(=O)N3CCOC[C@]4(CN(C(=O)CCBr)CCO4)C3)ccc21 1834823479 WMRZPMTUHUQFCY-FQEVSTJZSA-N 466.332 0.785 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C)c1 1835931385 PTSUJKQSJBITJH-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD O=C(c1cc(F)cc(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835941139 IZTWZORQXXPQRY-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3)C2)C1 1837460245 YGUBDRFRTSTQEI-QFIPXVFZSA-N 457.462 0.208 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](COC(C)=O)OC(C)=O)CCO2 1837503478 VJBAQGDAASTLJH-TXPKVOOTSA-N 493.351 0.111 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C(F)F)C2)C1)NC(=O)NCc1ccccc1 1839054003 BCCHQGPGQGPMIP-OAQYLSRUSA-N 469.489 0.054 50 20 JCGD CC1CCN(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)CC1 1839198728 NDVLNAPUOPKFTN-WMZOPIPTSA-N 450.349 0.865 50 20 JCGD COc1ccc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839360661 RWRMMKYSEWHFTK-QHCPKHFHSA-N 462.547 0.447 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(O)c1OC 1839375800 MLJUXEWDRSZMLW-VLIAUNLRSA-N 458.895 0.079 50 20 JCGD Cn1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Br)Cc2ccccc2)CCO3)n1 1839801737 APOZLMDXVWBNBU-LAUBAEHRSA-N 492.374 0.891 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)nc3OC)C2)C1 1839963689 SCFIDFZKXQHINN-KSSFIOAISA-N 459.341 0.672 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1839965543 BTHZHNHASMEFBT-QRWLVFNGSA-N 496.362 0.575 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1 1840152678 PNTZSWLEDZHTGB-FZKQIMNGSA-N 450.870 0.682 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(F)(F)F)nn3C)C2)C1 1840153733 YOVBRRCOKHLYLE-YVEFUNNKSA-N 468.860 0.763 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1840154443 XCQHVDSLSXYVSX-ORAYPTAESA-N 470.935 0.080 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C2)C1 1840184355 HXKAZMJLZPAPRD-GBXCKJPGSA-N 487.557 0.333 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccc4[nH]3)C2)C1 1840185108 IRGUNQRNWOULPD-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1840370068 DLOQTGMSYAFIDE-DYESRHJHSA-N 469.970 0.178 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1ccnc1C)CCO2 1840491836 VPHGJYTVQQNGSY-DANYPQMUSA-N 485.545 0.343 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@@H]3CCOC3)CCO2)C1 1840587515 XDAGYXKNRRVIPW-UAZFOLIYSA-N 475.546 0.394 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840737275 VMZXWGCPPIZKSK-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)CC1 1840817901 AGFLISPWFNPMAS-UWJYYQICSA-N 475.970 0.565 50 20 JCGD CC1(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CN(C(=O)OC(C)(C)C)C1 1840954982 RDURVCIDKZFNEO-AOMKIAJQSA-N 489.997 0.690 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(-c3ccc(O)nn3)cc2)C1 1845549658 KHQQVDKUTNITRV-UHFFFAOYSA-N 458.283 0.660 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1 9931151 WWIFLSJUTIHISX-AWEZNQCLSA-N 467.525 0.692 50 20 JCGD COc1ccc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)cc1OC 26219581 CFDKCPXGBFKQFO-UHFFFAOYSA-N 455.514 0.768 50 20 JCGD Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(F)c1 729662018 GPFXPNBWFXMPHS-UHFFFAOYSA-N 457.505 0.778 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 731050390 IYEBBQOMZALCFV-UHFFFAOYSA-N 483.890 0.690 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCCN2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2c1=O 744896118 JWIQXOYCVHJFAN-UHFFFAOYSA-N 473.534 0.430 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCC1CCOCC1)N(S(C)(=O)=O)CC2 749187342 BLLMLTLJRQAIDM-KRWDZBQOSA-N 484.575 0.710 50 20 JCGD Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 811843401 RVGUVVIYBCGCRD-IBGZPJMESA-N 489.506 0.580 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNc3ccccc3)cc2)CC1 823327733 CDZZBRDSPFDMSD-UHFFFAOYSA-N 459.528 0.413 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCC[C@@H](NS(C)(=O)=O)C1 918777414 ITTXUFOYYCTMAP-DGCLKSJQSA-N 463.354 0.971 50 20 JCGD COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 919884398 GEJUFWKOQXUPLG-AWEZNQCLSA-N 482.540 0.627 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 920848688 GSIXOVADNKXRAY-IUYQLWOBSA-N 457.512 0.644 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)Cc1cccnc1 1115984550 KFSIBIAXYUXTGE-INIZCTEOSA-N 497.371 0.767 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[n+]([O-])cc1)C2 1778092544 GAGUDGXTNFOGHZ-LVGVVDSRSA-N 468.514 0.582 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1F 1779370978 ARGRQRLWFFPJAU-OPAMFIHVSA-N 473.509 0.307 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1780738559 OQSPUQCJPVZBRT-WZONZLPQSA-N 473.530 0.322 50 20 JCGD CN1CCN(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)CC1 1780771511 JOMCSZKDYQGGTB-HHXXYDBFSA-N 463.392 0.828 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781234568 VQNPOCKXGJQQEN-LZQZEXGQSA-N 460.362 0.523 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1[N+](=O)[O-] 1781306138 XIMSKCJMUVRABV-HSZRJFAPSA-N 482.497 0.588 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1783614876 GIWCLKAXTYAQGW-JXSLOMFPSA-N 475.970 0.440 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]3C[C@H]3N1C(=O)OC(C)(C)C)CCO2 1783932938 KXQRLWDRQGTPLP-RTPKDJLFSA-N 493.605 0.587 50 20 JCGD COc1ccc(F)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1785023313 JWIIQPKXOYDUNX-QFIPXVFZSA-N 457.462 0.590 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(N4CCCNC(=O)C4)n3)[C@H]2C1 1785786587 TZQALJUOODFHHI-DWRORGKVSA-N 493.992 0.255 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1noc2c1CCCC2 1787305044 PGELRLFHAJJZPL-QSFXBCCZSA-N 453.304 0.140 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)CC1 1788141096 KMLNJORZVRQZFB-UHFFFAOYSA-N 478.358 0.278 50 20 JCGD Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c2cccnc21 1788463342 BDRFEEOYNLFCNT-LRQRDZAKSA-N 462.315 0.160 50 20 JCGD C[C@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cnccc5C(=O)NN)[C@H]4C3)n[nH]c21 1788610190 ITYKDIGEQJWRRY-LUVWLHFXSA-N 467.530 0.365 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CNC(=O)C3)[C@H]2C1 1790861497 SNFMLYBSXZUZOH-OOPWCRBXSA-N 458.465 0.988 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C[C@@H]21 1791255345 NHWHWSWOMFBICN-QAETUUGQSA-N 454.955 0.520 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS[C@H]3CCCCO3)C[C@@H]21 1791291081 LBYJWBTYRRSSOU-IAGYGMIVSA-N 456.609 0.599 50 20 JCGD C[S@@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1792795041 GWBUWGKIGOHNQM-QAOBWAITSA-N 483.990 0.772 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C 1792884725 WOJDZRLVTFVJRN-RMEBNNNOSA-N 478.384 0.493 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1 1793044591 BDXDADMUFKFCGS-YNKYUYGSSA-N 470.281 0.652 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(Br)nc1F 1794239956 WTDINWXHPDDGEI-INTNWOOBSA-N 450.692 0.786 50 20 JCGD COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1C 1795732743 FWEJUBZTHOMTOS-BBIADKPPSA-N 452.316 0.129 50 20 JCGD Cc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1[N+](=O)[O-] 1795739693 BNIWYHWOAVNXGP-OPMZPASUSA-N 467.287 0.029 50 20 JCGD COc1cccc(Cl)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795740906 NUKGLDNVTNLILG-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)nc1C 1798311095 DMDWABXWHRWMEU-RVQRMFQJSA-N 456.478 0.866 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc3c1NC(=O)C3=O)C2 1798440597 SFWVBEUVDZGDKB-CLLJXQQHSA-N 462.466 0.386 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1799830273 NOZHXTBJEUZMJZ-VTEUUUEMSA-N 463.491 0.185 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1800056692 VZOFYNHPJMZICV-REPLKXPHSA-N 475.351 0.160 50 20 JCGD CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1800073203 UUGQEZCSHYIZGQ-GTDBDLECSA-N 456.996 0.822 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1800741521 GTLFJDWGQQRLRJ-SOVHRIKKSA-N 453.923 0.491 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1800979043 PGESSKTYQBDISU-ZDFLXESQSA-N 469.878 0.977 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(CCO)CCO)C2 1801438450 NYNUEGXFYHLSRD-ZCZGSMFASA-N 462.497 0.797 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)CC1 1801965782 GLBPPBVABSRPDA-YALNPMBYSA-N 462.950 0.663 50 20 JCGD COCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1802083238 IGTXPWYMFNBZFZ-BJWYYQGGSA-N 463.535 0.007 50 20 JCGD O=C(COc1ccc(O)cc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1802886161 BYJMPRSIMKECBH-YADARESESA-N 475.310 0.866 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1803007570 DKPFUQOLZYEGOL-DSRCVFDASA-N 466.336 0.717 50 20 JCGD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1cnnn1 1803092521 UIIASHIGZMRVEP-KANFNMMFSA-N 469.550 0.219 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cn2nnc3ccccc32)[C@H]1c1cccnc1 1804019371 UAXWKJVLMVNRJJ-UZUQRXQVSA-N 499.535 0.845 50 20 JCGD CCCNC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807359937 NKYVZOKWJMGGOG-AUSIDOKSSA-N 466.347 0.387 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1 1808323262 JMTFGPAMWWGWAO-GPXOXTDOSA-N 484.365 0.796 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCS(C)(=O)=O)[C@H]1c1cccnc1 1808416248 IXEHESRUINFVGR-QGJUGNDFSA-N 488.570 0.656 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303265 RRQGKVSQADFRKP-KKVAFCGZSA-N 465.514 0.090 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1 1813075265 ZSMCJFTWKQLTOU-ABSDTBQOSA-N 465.576 0.038 50 20 JCGD C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1 1814762067 LFYHTHWEVBEFKW-IUCAKERBSA-N 469.298 0.811 50 20 JCGD CCS(=O)(=O)CC(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817275908 GNRROVNXMYJIHI-ZFILKEQLSA-N 480.572 0.624 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)c2ccco2)n[nH]1 1817605396 AEUFIZSHSYCDBB-HNNXBMFYSA-N 459.507 0.798 50 20 JCGD O=C1Nc2c(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)[nH]n3)cccc2C1=O 1819194742 VNJCKRUDRRAETD-GOSISDBHSA-N 487.281 0.844 50 20 JCGD CC(=O)NC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819794092 ZMGHAFGRABCIEC-NSHDSACASA-N 459.532 0.282 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1827303529 FOCYCRCMDNJBNR-AEFFLSMTSA-N 456.377 0.922 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NNC(=O)C2)CC1 1827680547 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(=O)OC(C)(C)C)CCO2)C1 1831993065 PLQJFNXOCFZBJS-DZQSVEARSA-N 491.545 0.309 50 20 JCGD C[C@](O)(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)C(F)(F)F 1832162636 QGSMZMFMLIKKLU-SOUVJXGZSA-N 451.269 0.992 50 20 JCGD O=C(/C=C\c1c[nH]c2ccccc12)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832734042 QPIHMAPFGODALI-LNCAXPMHSA-N 489.337 0.631 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833313494 HHYHQRXXFBUMJO-ZWKOTPCHSA-N 491.029 0.433 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3n[nH]c(C4CC4)c3F)CC2)CC1 1834022689 GEDRIYYSLRGZFJ-UHFFFAOYSA-N 477.585 0.984 50 20 JCGD COc1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)cc1C 1834578955 LXJXVXTXWIUJNO-FXZATJRASA-N 498.540 0.603 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)OCCO4)CC2)CC1)c1cccc(B(O)O)c1 1834799927 FLXKZKPPJUUQTQ-UHFFFAOYSA-N 493.369 0.637 50 20 JCGD Cc1ccc(OCCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835926635 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2 1839127468 XASFRWVRBAOHNH-KTDDNLLNSA-N 457.531 0.933 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1 1839390024 FZLKNUWOIPNVKR-QDVHYIHRSA-N 484.347 0.996 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)CCO2 1839727176 DQJOUADHYRZEAO-IBPRQYQWSA-N 496.004 0.332 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2 1839737648 VDIKQTCNLHULKX-OMPKRAJASA-N 480.871 0.199 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839880997 IOAHDMSXGMPITQ-KPCRFSNUSA-N 476.480 0.853 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1 1840153244 IJWXQBGELIGJAX-XXBNENTESA-N 479.961 0.743 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(C(=O)OC)cc3)C2)C1 1840156506 QBJXDCBMPIVFDJ-PGRDOPGGSA-N 484.933 0.562 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1OC 1840185417 QKUIBCNVFBYZRW-XMMPIXPASA-N 492.573 0.455 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cn3ccc(Br)cc3n2)C1 1843989866 OZAYVFUERNQLHY-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)no1 1845038881 CPRONXZNJCVRRS-UHFFFAOYSA-N 497.556 0.262 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)N1 1845874294 QGIJUTPEQWRLJE-DMDPSCGWSA-N 477.356 0.060 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccccn1)c(=O)n2Cc1ccccc1 10161507 MTVSAEBHQMGNFU-UHFFFAOYSA-N 475.509 0.920 50 20 JCGD O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 15524979 HCFCACDSYMOQHN-UHFFFAOYSA-N 464.456 0.456 50 20 JCGD CCn1c(=O)c2ccccc2n(CC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1=O 16364882 OYGBRBJDPDFPLT-UHFFFAOYSA-N 469.410 0.096 50 20 JCGD Cn1c(CCC(=O)NNC(=O)c2ccccn2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 17328785 WIPDRHRFZZIVRL-UHFFFAOYSA-N 472.527 0.383 50 20 JCGD Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)cn1C 726765376 LDELSHIBOZGRNU-UHFFFAOYSA-N 482.522 0.772 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 728512943 ZGYQGIOPXLFOMK-LJQANCHMSA-N 475.509 0.822 50 20 JCGD COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cn1 729691941 VQXSPGPJMYCNJI-UHFFFAOYSA-N 454.490 0.685 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)Cc1ccccc1F 731329303 AOPQUQLGLDZBDM-UHFFFAOYSA-N 476.530 0.829 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1 747864971 BRANYFUCNWMOLN-UHFFFAOYSA-N 465.532 0.364 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)OCC(=O)N2CCNC2=O)cc1 782543992 KIDXSLYTBOBMPO-GDNBJRDFSA-N 466.454 0.436 50 20 JCGD O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)c1ccc2c(c1)OCCO2 791011603 VXZMXNFWDSNYSC-UHFFFAOYSA-N 465.459 0.693 50 20 JCGD CC(C)(C)NC(=S)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C/c1ccccc1 825164359 UFEKIIGEGXOBEV-NRMKIYEFSA-N 476.646 0.674 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(C2CCCCC2)C1)c1cccc(S(=O)(=O)N2CCOCC2)c1 914710466 SVICTRJNOYSAIA-KRWDZBQOSA-N 478.571 0.650 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1)c1cccc(S(=O)(=O)N2CCOCC2)c1 914710467 SVICTRJNOYSAIA-QGZVFWFLSA-N 478.571 0.650 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNS(=O)(=O)c1ccccc1)N(S(C)(=O)=O)CC2 916105679 KPTXAOHUIMXDAE-QGZVFWFLSA-N 483.568 0.962 50 20 JCGD Cc1cc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(CC(=O)N(C)C)CC2)c(C)n1C[C@H]1CCCO1 917240282 DKEFSRDDGVNWFR-WCCCRJGXSA-N 485.585 0.967 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3cc(Br)c[nH]3)n[nH]c2n1 917392403 UMMTYPNYXHXGJQ-UHFFFAOYSA-N 483.356 0.449 50 20 JCGD CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)s1 918399165 MSBMPVXWWYPXMO-QMMMGPOBSA-N 480.977 0.869 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2cccc(OC)c2O)c1 919756686 HWFPRIRHPLPUOF-UHFFFAOYSA-N 452.489 0.054 50 20 JCGD O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 920426220 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CN3CCOC3=O)CCO2)C1 1780095495 PUXIKGFLHCOFEC-OAQYLSRUSA-N 476.442 0.416 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(O)[nH]1)C2)NC(=O)NCc1ccccc1 1780559631 XGKPTHWBUNBFMS-NTKDMRAZSA-N 499.572 0.589 50 20 JCGD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c(F)c1 1780899650 CHMSEUALUCAAIJ-ZJSXRUAMSA-N 470.306 0.955 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)C1 1781049775 UGHATKZFTWAFFA-DHYLWCPWSA-N 463.959 0.597 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781324948 GAKOCMPVKSFVDY-VBHSOAQHSA-N 482.347 0.783 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)C1=O 1781332255 XCANPWJXADQNGZ-KSSFIOAISA-N 454.252 0.955 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4ccnn34)C2)C1 1782224432 CRBQPOHUNXSVMF-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCNC(=O)C2)C1 1782269230 FJRNTXNYROEMKX-GGGSDYILSA-N 472.546 0.161 50 20 JCGD COC(=O)CCCCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1782277853 MDNPAHMUOIRXIX-WZONZLPQSA-N 468.595 0.997 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(-c3cnccn3)c1)CCO2 1783934463 AMVZHBUMYUAILL-XMMPIXPASA-N 466.542 0.960 50 20 JCGD Cc1nc[nH]c1CSCC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936742 ZTBZFRWTTUIRIS-HXUWFJFHSA-N 452.581 0.154 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCS3(=O)=O)C[C@@H]21 1783974291 LBZCYPRTJOIQKP-CAEXGNQWSA-N 451.383 0.574 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784093178 PWGCYHLWHHJRIS-DFJGONKVSA-N 455.914 0.523 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3cnccn3)C2)C1)NC(=O)NCc1ccccc1 1784621176 XJXQUIAFBVHZHX-NJFIGMEYSA-N 493.568 0.666 50 20 JCGD 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CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21 1790958233 MVXFTVICTHNPMZ-MHEUCROKSA-N 458.313 0.945 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCC(=O)OC(C)(C)C)C[C@@H]21 1791287961 IEXPRCVCHLTPRX-BZSNNMDCSA-N 468.595 0.851 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cncnc1)C2 1793878334 SRYCYBSOHDJJTG-DFGXFYAUSA-N 467.954 0.741 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1794210899 YJTGKLISMDWLOH-WRHDZBKDSA-N 497.600 0.455 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Br)nc1F 1794241092 FWRMUHVBUNFROO-DPIQGUFMSA-N 486.342 0.559 50 20 JCGD O=C(C[C@@H]1COc2ccccc2O1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796189794 BFTVPQVFJDFYEX-IYWMVGAKSA-N 450.300 0.848 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3o1)C2 1797754151 WTAJVZZSRIFJHR-IVWMJMPLSA-N 450.455 0.343 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 1799198316 UIHWWKVXOZSCHV-DBWAAGBOSA-N 459.971 0.821 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2 1799281994 FUPNLMPFTBLKNW-HMVGFALLSA-N 454.401 0.673 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](c1ccc(Cl)cc1)N(C)C)C2 1801012738 HZMBLBUUOATSKO-YVCBRDFCSA-N 480.009 0.905 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1 1804360638 DWAAPKLBPAQKCU-BCDXTJNWSA-N 464.526 0.675 50 20 JCGD Cn1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1=O 1807363876 FZJUVIYLQPQJBT-RXVVDRJESA-N 460.299 0.094 50 20 JCGD COc1cccc(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1807369326 GQYWDFLDTYHZOH-CYFREDJKSA-N 474.326 0.727 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCNC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369824 WXTMOCGGXHSEOD-WMZHIEFXSA-N 489.341 0.229 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)N1CCN(C)CC1 1807864926 FZWNBLJDDXTAPA-LZNRXBQRSA-N 494.600 0.036 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1 1808174308 YMIXIBGLDSCSPT-IERDGZPVSA-N 485.508 0.756 50 20 JCGD Cc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1811086564 NUULAGKDIXVTEF-JXFKEZNVSA-N 460.498 0.812 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)c21 1811275377 IQOLCHPCJFBHBQ-XMSQKQJNSA-N 499.336 0.987 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cn2cccc([N+](=O)[O-])c2=O)[C@H]1c1cccnc1 1812411151 QVJSMAKUQULKIM-HTAPYJJXSA-N 499.528 0.231 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1 1812866972 VAVVBDBSQMVHIW-OWIUFQIYSA-N 455.353 0.521 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cncc(O)c2)[C@@H]1c1cccnc1 1812909256 DGGAGXPOQHOBJN-YWZLYKJASA-N 461.482 0.814 50 20 JCGD CN1CCN(CCC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CC1 1813070165 DJLOYZVQOSYNLP-YKSBVNFPSA-N 473.622 0.098 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1 1813499825 WDCCWEKJGQQUSQ-SBUREZEXSA-N 454.531 0.804 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1 1814876679 XOGYRHKLGLXDCZ-BFHYXJOUSA-N 486.957 0.770 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1-n1nccn1)CC2)c1ccc(B(O)O)cc1 1815343882 UXFVXQOFDGOTKI-INIZCTEOSA-N 488.338 0.943 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cccnc3)sc2C1 1817192520 MJBKQGZHUWRBJL-CABCVRRESA-N 459.576 0.393 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2[nH]nc3ccncc23)[nH]n1)c1cccc(B(O)O)c1 1817475043 JOLYNIOKYUMFSH-SFHVURJKSA-N 459.275 0.981 50 20 JCGD COC(=O)C12CC(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)c4cccc(B(O)O)c4)n[nH]3)(C1)C2 1817479494 NYIZDGXFLKAOLV-UIFUMHDPSA-N 466.303 0.739 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)[nH]n1 1819403146 WBOHYRBQEJCKIZ-DOTOQJQBSA-N 483.558 0.741 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccncc3O)sc2C1 1820333332 SZLLNKHNVFECFP-SNVBAGLBSA-N 453.484 0.782 50 20 JCGD Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)nc2nccn12 1824114980 CFBHFOXVKCTQAG-HNNXBMFYSA-N 476.327 0.714 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1824599883 YJVSLSSIHASAQA-SMDDNHRTSA-N 461.305 0.610 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1 1824772589 QMYPJTXYXAUXLD-IBGZPJMESA-N 482.541 0.234 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CS(=O)(=O)N1CCCC1)CC2 1825998308 HWGGIYCQDQSPDT-NEPJUHHUSA-N 464.997 0.735 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2)n1cncn1 1826790142 OJRHXHHTRFKJKN-WDEREUQCSA-N 455.504 0.220 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826842319 YLSHLOGNFZSDGI-MRXNPFEDSA-N 467.360 0.642 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828922186 QRUHLGFZJNSAME-WOJBJXKFSA-N 458.563 0.833 50 20 JCGD O=C(Cc1ccc(Cl)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830294851 SMPMSJLVJLBPIG-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc4[C@@H]3O)C2)C1 1830719507 FKVWVKIPYHCOQI-WEMPKCCASA-N 452.935 0.339 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)C1CC1 1830719936 PDSBCIZLLPMJHU-DRSNIGMVSA-N 489.997 0.736 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1831647101 QLDUSDOGXOYUCC-FXAWDEMLSA-N 480.027 0.522 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873623 QPOJSOMMTIHAIE-PMACEKPBSA-N 482.578 0.474 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CSc1ccncc1)CCO2 1832713259 WNKJOTJQMRPWEN-OAQYLSRUSA-N 465.576 0.003 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n(C)n1 1834157567 GUBPATMFTNAFJA-KSFYIVLOSA-N 499.996 0.931 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799112 OGEYANWVMSYINX-GOTSBHOMSA-N 497.401 0.307 50 20 JCGD COc1cc(C#N)cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834801129 MQIOOZQBYQCRFG-UHFFFAOYSA-N 490.369 0.746 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1 1834821448 LAUJNHAAPSRWJG-GHTZIAJQSA-N 466.376 0.942 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C3CN(C)C3)CC2)CC1 1835118131 SDVZQDSKBSTCRB-WGOQTCKBSA-N 457.579 0.254 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cncn3C)CC2)CC1 1835118252 KSOHVGGQUQFCTL-JVWAILMASA-N 468.562 0.739 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1835644759 FXKCRJFRPMJFQG-ZFWWWQNUSA-N 467.336 0.313 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)CC1 1835738249 PDAMZXFCAPHWDL-MRXNPFEDSA-N 494.600 0.399 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4ccc(Cl)cc4[nH]3)C2)C1 1835926497 PDBXJSSSKPPQEK-XMMPIXPASA-N 497.744 0.885 50 20 JCGD Cc1csc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835927487 PUXFMOUOXJUJAJ-HSZRJFAPSA-N 472.372 0.439 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccsc4[nH]3)C2)C1 1835932199 SRQGTRNRZGDUEA-QFIPXVFZSA-N 469.328 0.293 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1835933735 BPRIRSZNOKJFIY-BVZFJXPGSA-N 482.342 0.249 50 20 JCGD Cc1cc(F)ccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835933893 IEHMWZUYVCUKCC-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD COc1nc(C)ccc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835999343 RTBCWDSEGHVYMF-UHFFFAOYSA-N 480.374 0.577 50 20 JCGD CCOc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cnc2c1cnn2C 1836378265 UWRCLJLHARQHRQ-KKSFZXQISA-N 481.937 0.037 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461092 NVGOQGXHFCBXCL-JOXKVKLASA-N 495.536 0.477 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1837715115 WMLBCMNJIWGEAA-INIZCTEOSA-N 465.505 0.745 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(C)c1)CCO2 1837937499 FMXFOFJRJOJXNX-NWJFTTBMSA-N 468.514 0.594 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncon3)C2)C1 1838528024 ALMIWNFJVPIHLA-FQEVSTJZSA-N 475.414 0.287 50 20 JCGD O=C(c1nn[nH]c1C(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201895 MYLMYVWXOLMOMG-GXFFZTMASA-N 474.209 0.584 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1 1839373468 HXBZGTKDURGWBM-VOJFVSQTSA-N 459.293 0.657 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3nscc13)CCO2 1839577203 FTHHPKYTDGUODV-QFIPXVFZSA-N 475.571 0.739 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1 1839964399 QHDGGBNSPQAVNI-QRWLVFNGSA-N 495.378 0.985 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@H](C(=O)OC)CC3)C2)C1 1840150112 FPQQILTXJSPBCC-BZLDKRAPSA-N 460.955 0.676 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sc4nccnc4c3N)C2)C1 1840152040 VKMBAFLBHXSHJW-BUXKBTBVSA-N 469.951 0.597 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)CC1 1840156356 NFHWSQHCLWCGSQ-UTKZUKDTSA-N 475.970 0.565 50 20 JCGD C/C(=C\c1cccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185218 MNGDCAOPMCPVOP-HKRNCWMRSA-N 459.547 0.314 50 20 JCGD CO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1840209837 AGXIZJUDRXZQSL-SPLOXXLWSA-N 465.459 0.625 50 20 JCGD COCCOCCOCCOCC(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2 1846257282 ZILDEPAAWIBSDT-HNNXBMFYSA-N 455.321 0.577 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CSc2nc[nH]n2)C1)NC(=O)NCc1ccccc1 1846568875 QFBKKTGISPJPPL-UHFFFAOYSA-N 472.575 0.446 50 20 JCGD C[C@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1cccn1 1846619355 ILYLEWWZIXYIPD-GOSISDBHSA-N 453.547 0.994 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccoc1C)c(=O)n2Cc1ccccc1 14056436 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CCN(CC)C[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1782695610 RZGHKDCFVCVHFM-DSGVOVKDSA-N 460.579 0.928 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2 1783534671 NDGHWLRADHGASX-LXIYXOSZSA-N 464.357 0.485 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(Br)ccc1O)CCO2 1783935417 RPXQMJYHCVEMDY-FQEVSTJZSA-N 483.363 0.971 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1ccc([N+](=O)[O-])cc1F)CCO2 1783936021 AIUGQWDBSSWRMH-OAQYLSRUSA-N 465.482 0.479 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@@H]1CC(c2ccccc2)=NO1 1784404805 UGGXEHWZAHFPSJ-HMNCIZAVSA-N 477.326 0.153 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1784414746 YATWSKSOKUYXGM-OPAMFIHVSA-N 455.345 0.386 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1)NC(=O)NCc1ccccc1 1784851863 IQZHIHCNTZJEQL-RLIDHQHUSA-N 471.558 0.055 50 20 JCGD 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O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc(Cl)nn1 1810681862 WVWLIBKEHTZVRL-JXFKEZNVSA-N 465.706 0.838 50 20 JCGD COC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1812690183 NLGTZYGAHIPKBB-CRAIPNDOSA-N 466.498 0.353 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1)C(Cl)Cl 1813075715 IKHOMENYJUOFMU-SMDDNHRTSA-N 450.286 0.936 50 20 JCGD Cc1c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn2[nH]cnc(=O)c12 1815360802 NUJWHFROCDSTEA-CQSZACIVSA-N 492.326 0.007 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361771 RGXQSUIZJNTLSN-CZUORRHYSA-N 466.328 0.911 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCS(=O)(=O)CC2)n[nH]1 1815672799 GFPFGAIJTRHCHP-DZGCQCFKSA-N 461.972 0.386 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3ccccc3-n3nccn3)sc2C1)c1cccc(B(O)O)c1 1823548005 MKISMSSEHQKIEV-INIZCTEOSA-N 488.338 0.943 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCCNC3=O)CC2 1826085972 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CC(C)(C)OC(=O)N[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)C1CC1 1830853652 SSKJZJHDMCAAQP-DRSNIGMVSA-N 489.997 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2 1832388732 HIXSZMDVIQSHBW-DEOSSOPVSA-N 497.527 0.626 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832730055 VAGZLTIVJKEAEC-OXJNMPFZSA-N 483.363 0.441 50 20 JCGD CC(C)c1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)no1 1832790604 AOTZLCNZSFCRKN-RHSMWYFYSA-N 463.304 0.882 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1)c1cc2n(n1)CCNC2=O 1834329150 VKRBDBKNTGBMDZ-UHFFFAOYSA-N 457.362 0.615 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccn4cncc34)CC2)CC1)c1cccc(B(O)O)c1 1834801269 UVTYIRCNXMUBAP-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1 1835929115 ABGYLCCADLNFKQ-IBGZPJMESA-N 470.253 0.169 50 20 JCGD O=C(c1cc2n(n1)CCCO2)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1836972283 UUNTYWMRENPORZ-RHSMWYFYSA-N 461.288 0.426 50 20 JCGD Cc1cc(C)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459560 KBWIZZIDVSLFPA-XMMPIXPASA-N 467.526 0.686 50 20 JCGD N#Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1Cl 1837460279 ZBSFGKZWUFYERA-HSZRJFAPSA-N 498.927 0.594 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837637076 UVBUTDNYASBYGX-BMSLLPBFSA-N 484.347 0.692 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1 1838429738 LHJQJNHBKUTRDC-LJQANCHMSA-N 457.644 0.988 50 20 JCGD O=C(c1cccn2c(O)nnc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199283 LRZSOOBPMFWUNL-YVEFUNNKSA-N 472.271 0.195 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])CCO2)C1 1839234188 XXSMFJRMYRAXKO-UTKZUKDTSA-N 485.921 0.856 50 20 JCGD CN(C)[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccccc1Cl 1839731751 POEXMAMTWGXBAI-LVCYWYKZSA-N 474.385 0.999 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3cccc(Cl)c31)CCO2 1839740743 SKPLQHONNKUWAL-CJFMBICVSA-N 498.772 0.820 50 20 JCGD Cn1ncnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802175 NPTJAJUIAFIWLO-LAUBAEHRSA-N 492.374 0.891 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(O)C(F)(F)F)C2)C1 1839962540 JLJZTXPWMZEVJC-TUKIKUTGSA-N 461.275 0.930 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)nn3C(F)F)C2)C1 1840154327 SIDUKLPUAIYFQY-SCLBCKFNSA-N 450.870 0.910 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840182698 PXLMBZGWTRVMME-QHCPKHFHSA-N 463.579 0.394 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2 1840258893 QUFQHVXPLQNJGU-CJFMBICVSA-N 479.537 0.485 50 20 JCGD COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc1NC(C)=O 1843011833 YJEUUYCZGQWCTJ-UHFFFAOYSA-N 451.288 0.464 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CC1CN(C(=O)OC(C)(C)C)C1)C2 1846386458 OJFVDWVWZIZTPE-UHFFFAOYSA-N 451.568 0.820 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)Cc2cnn(C)c2)C1)NC(=O)NCc1ccccc1 1846637147 RPMPZEODNXVYMO-UHFFFAOYSA-N 453.547 0.512 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cnc4nc(O)nc(O)c4c3)cc2)CC1 728216239 VPFPYNHBGWKAKF-UHFFFAOYSA-N 459.488 0.129 50 20 JCGD Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 729283965 NQZPPHRTZKYMHZ-UHFFFAOYSA-N 472.527 0.840 50 20 JCGD Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)C2=O)c1 730767989 VTGAXSDSDSIBOU-SFHVURJKSA-N 487.538 0.912 50 20 JCGD N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)N1CCO[C@@H](C(N)=O)C1 747775608 FOVNTQKNDVEJHN-RKCSUWQLSA-N 456.890 0.699 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)Cc2ccccc2)CC1)c1ccc(-n2cnnn2)cc1 807134558 BSRUQJHHAYNOJY-UHFFFAOYSA-N 470.515 0.164 50 20 JCGD CCOC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1 818781550 BZYCBGSRQVBDON-UHFFFAOYSA-N 465.517 0.631 50 20 JCGD C[C@]12CCC(=O)N1[C@@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N3CCOCC3)cc1)CS2 863950039 MQILDOYSKXVZIY-UTKZUKDTSA-N 496.611 0.242 50 20 JCGD CCCCn1c(CCC(=O)N2CC[C@H](B(O)O)C2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 864232275 YUUMNOKPZWRAJK-KRWDZBQOSA-N 492.407 0.865 50 20 JCGD N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 913151567 NLVYSPURXMUJFX-UHFFFAOYSA-N 491.551 0.082 50 20 JCGD C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)OCC(=O)NNC(=O)c1ccccc1 914633519 ZSRQEMAYCSCPND-HSZRJFAPSA-N 450.451 0.990 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1C 915922153 ZJRHOGJDARPHHU-UHFFFAOYSA-N 489.554 0.793 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1nnc2ccccn12 916222008 OPWRUXVOAUQHCT-AWEZNQCLSA-N 473.515 0.455 50 20 JCGD C[C@H]1CN(C(C)(C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C[C@H](C)O1 916235063 XZFGNXHGWZBSRE-IRXDYDNUSA-N 497.618 0.539 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)N[C@H]3CCS(=O)(=O)C3)CC2)cc1 920379557 YGSRPXQJIFVOGI-INIZCTEOSA-N 471.561 0.272 50 20 JCGD C[C@H]1CCc2c(C(=O)N3CC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)n[nH]c21 1777849285 DVFBHLDWFPULBL-WHEQGISXSA-N 453.503 0.215 50 20 JCGD O=C(c1nc2c(=O)[nH]c3ccccc3n2n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1778055578 LBAJOXSGKBEBBC-BFUOFWGJSA-N 493.293 0.705 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1noc3c1CCCC3)CCO2 1779030292 NSDNVWQCBMXTII-QFIPXVFZSA-N 454.487 0.309 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc(F)c(F)c3)CCO2)C1 1779030765 HSJHSSQACBXZBZ-QFIPXVFZSA-N 459.453 0.650 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnc(Cl)n2)C1 1779679417 WCXIABNFGJPWSD-IIBYNOLFSA-N 473.921 0.570 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncccn1)CCO2)NC(=O)NCc1ccccc1 1780968825 FVAJDABJGVDGQB-HSZRJFAPSA-N 467.530 0.266 50 20 JCGD Cn1cc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)ccc2n1 1781236906 URHYTHNBGSXCJP-RCZVLFRGSA-N 476.342 0.694 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc([N+](=O)[O-])c1OC 1782119674 KENFYQPCNXLUON-QFIPXVFZSA-N 493.517 0.429 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)CCO2)C1 1783874260 FQVZYEJRSVYLPZ-VFNWGFHPSA-N 450.923 0.574 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1nnc(-c3ccccc3)o1)CCO2 1783934244 BCIUVXFPCXFRDT-JOCHJYFZSA-N 456.503 0.553 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(C(F)(F)F)nn1C)CCO2 1783934519 CGOYMZZJFLIHTJ-SFHVURJKSA-N 460.457 0.255 50 20 JCGD C=C1C[C@@H](C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)N(C(=O)OC(C)(C)C)C1 1784089049 XBXXMKIWBWWENX-UUOWRZLLSA-N 493.605 0.755 50 20 JCGD O=C(C[C@@H]1COc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784391934 KCTAQEYBZGSNIR-USKVXJDGSA-N 480.326 0.190 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CNC3=O)[C@H]2C1 1784952723 LEZSTZOABPAKMH-JLBONTIYSA-N 487.463 0.403 50 20 JCGD C[C@@H]1[C@H](C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CCN1C(=O)OC(C)(C)C 1785744784 XESQAFWLTMSZQH-GGUMNFRJSA-N 495.621 0.835 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C=CCN3)[C@H]2C1 1787403061 NRQGILJPIFKGLZ-RNVRALISSA-N 458.471 0.641 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@@H](O)C3)[C@H]2C1)NC(=O)NCc1ccccc1 1788120626 HQSDZVOXNNYLDL-WHZJULEDSA-N 473.574 0.083 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788140124 JEWBLIQJBBHXGS-HNNXBMFYSA-N 458.345 0.795 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1788225887 UMKKRQNIWVSGFL-FKAQHNMISA-N 477.961 0.915 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)c1ccccn1 1788611272 QYRZKWRYLCXFDG-QIJLZVCCSA-N 452.515 0.477 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3[nH]cc4c3CCC4)[C@H]2C1 1789162618 XQBGGAPAELSXOO-JVPBZIDWSA-N 452.515 0.409 50 20 JCGD CN(C)c1c(F)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1F 1790297833 ZCISYOYMGYVJMO-XERREHJYSA-N 487.312 0.618 50 20 JCGD 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCc2nc(O)nc(O)c2C1 1794383976 BODLDLUMIQVGKH-MZFCXCTDSA-N 495.540 0.765 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCCNC(=O)C2)n1 1794842509 LLWIHKMMLUSSKH-BCDXTJNWSA-N 485.589 0.033 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1C1CC1 1795005129 PCOYKCSUBNRXBK-YFXMYTFBSA-N 454.487 0.889 50 20 JCGD Nc1nc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)ccc2s1 1795657951 OMOFXECIKAVAKJ-CCWDJLKJSA-N 466.328 0.075 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795735744 CQBVMAKALUXCDP-OPMZPASUSA-N 452.316 0.509 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccn(C)n1 1795812342 OTQLDGAXQIORFB-USGNIVHTSA-N 471.470 0.700 50 20 JCGD C[S@@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796361327 NYQXZSGJRCFFHY-ABZPIPFJSA-N 483.990 0.772 50 20 JCGD 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499.276 0.226 50 20 JCGD Cc1cccc2cc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)[nH]c12 1835930724 WIQZDEVQFRHSPK-RUZDIDTESA-N 477.326 0.540 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1 1835937989 DLEFBMGFLZGMEM-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD COc1cc(F)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(F)c1 1835939544 RZKXABPLYLPHAA-HSZRJFAPSA-N 490.268 0.037 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3ccnnc3O)CC2)CC1 1836063924 OULMSKYJHXWASW-JFLMPSFJSA-N 482.545 0.501 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3c(F)cccc13)CCO2 1837057462 JPKJQLRBLNGXNX-QHCPKHFHSA-N 497.487 0.084 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1cnccn1)CCO2 1837476791 DMAVVGIGMZTYTA-ZRGWGRIASA-N 470.368 0.764 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](COC(C)=O)OC(C)=O)CCO2 1837497287 UDQVFKJBRFWLCV-QKLQHJQFSA-N 462.927 0.345 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 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C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccc(O)cc1 1840185818 YBGLRVYJCZCOLO-GAJHUEQPSA-N 462.547 0.325 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2 1840362294 MQTHARFFERZZEP-KUHUBIRLSA-N 455.353 0.756 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840896982 GESQURKYKQNXJH-DLBZAZTESA-N 484.427 0.539 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1 1840905529 GHWQETQCPZXJHB-PXNSSMCTSA-N 486.338 0.872 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)C(C)(C)O 1840916677 XHUHDVITJQXLOY-ZUOKHONESA-N 498.404 0.911 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCCC(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841352872 RCGKCGMNQKTLNJ-INIZCTEOSA-N 477.986 0.738 50 20 JCGD COc1cc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c(F)c(OC)c1F 1845478172 JQPATNWYDUZTKF-UHFFFAOYSA-N 460.242 0.793 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@]13C[C@@H](CO1)N(C(=O)OC(C)(C)C)C3)C2 1846385541 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O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1 751207220 SRLNMSRQYVBYGY-UVTDQMKNSA-N 460.512 0.870 50 20 JCGD COc1ccc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNC(=O)c2cccs2)c(OC)c1 751209607 SZJUHIPTBPFRHF-OAHLLOKOSA-N 460.512 0.947 50 20 JCGD O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1Cl 751267126 DQAZOEUFNHGJMR-JTQLQIEISA-N 454.910 0.328 50 20 JCGD O=C(NNC(=O)C1CCN(c2cnccn2)CC1)c1cccc(S(=O)(=O)N2CCCC2)c1 914046299 AXWYFBBHNYCRBC-UHFFFAOYSA-N 458.544 0.939 50 20 JCGD O=C(COc1ccc(F)cc1)NNC(=O)NCc1ccccc1CS(=O)(=O)N1CCOCC1 916229693 VGCSKAGGXQRBSV-UHFFFAOYSA-N 480.518 0.897 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCC(=O)N2CC(=O)Nc3ccccc32)cc1OC 916529768 JYXVPKJUDJCQHS-UHFFFAOYSA-N 484.465 0.774 50 20 JCGD O=C(NC[C@]1(N2CCOCC2)CCSC1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 916637227 VMWBWNYOSPYESH-OAQYLSRUSA-N 497.643 0.623 50 20 JCGD Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)cc1 917733241 NMGBXAHLMUIEEO-AWEZNQCLSA-N 488.565 0.507 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1 918138486 UOCQTIHTYPKHKT-UHFFFAOYSA-N 487.517 0.601 50 20 JCGD CN(c1ccccc1)S(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 919883962 FJXBGVYGHNQVAE-OAHLLOKOSA-N 466.541 0.643 50 20 JCGD CCOc1ccc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)[C@@H]3CCS(=O)(=O)C3)CC2)cc1 919987515 XYLGVKVXLDMUDX-BLMOFCDVSA-N 467.569 0.653 50 20 JCGD C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 921247297 CXBQYHJKTRMWCZ-GFCCVEGCSA-N 469.451 0.810 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn(C)n1)C2 1778091436 QQJCOONISWKDKX-UYVYXKLWSA-N 455.519 0.682 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc4sccc4[nH]3)CCO2)C1 1779032757 XTOUEIIPXZYEQX-OAQYLSRUSA-N 454.512 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1CCOCC1)C2 1779373439 RTPQGOOTOUDVNO-AUSIDOKSSA-N 459.547 0.629 50 20 JCGD O=C(/C=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)NCc1ccco1 1779491189 CWVUJAGVMMVEOR-PTSNIHHZSA-N 453.923 0.566 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Br)C2)CC1 1780774969 RHNSIAJTLVMPDO-IIDMSEBBSA-N 498.415 0.862 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1CC(c2ccccc2)=NN1 1781446656 QFNWFTCDMZKIEF-JQYIIUTOSA-N 490.369 0.260 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1 1782942847 MFAVFBBKWRUJNX-QFIPXVFZSA-N 473.530 0.062 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1sc3nccnc3c1N)CCO2 1783934039 UKXCIMBWRXKCHN-FQEVSTJZSA-N 461.548 0.090 50 20 JCGD Cc1c(Br)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)nn1C 1784092492 IWVOIPADEXEATK-CYDGBPFRSA-N 463.760 0.684 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCC(=O)N3C(=O)OC(C)(C)C)C2)C1 1784190029 CCONOYNREYWZHG-GXZWQRSESA-N 473.954 0.996 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3cnccn3)C2)C1 1784618984 DGKOSVRVPFKLDI-RTMAMBHISA-N 451.487 0.454 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784831064 IONBUWGAQJDOPQ-VHFSOBRXSA-N 476.260 0.620 50 20 JCGD COc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)ccc1[N+](=O)[O-] 1786984726 BHVCWMCPSCLOAL-JLMWRMLUSA-N 497.313 0.119 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21 1787507308 NUQVCCMZZCKVDH-JKYBXLBGSA-N 473.921 0.857 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCCS3(=O)=O)CCC2)cc1)c1cccc(B(O)O)c1 1788149315 JAQFBPIIHKGXDW-IBGZPJMESA-N 456.329 0.691 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1)n1ccnn1 1789726682 MTHINUVYXDBYIS-VMXMFDLUSA-N 498.588 0.165 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C[C@@H]21 1791254438 MLVHARYAIVGQQG-JKQORVJESA-N 450.923 0.813 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792975648 SXCJAMWJWJPEHZ-VTMBPIDISA-N 463.959 0.104 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1[nH]nc3c(Cl)cccc13)C2)c1cccc(B(O)O)c1 1795739901 OBEWTNUQMOGKNR-USGNIVHTSA-N 482.733 0.342 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@H]1CC(=O)N(C2CCCC2)C1 1796188020 VOMILMPLSVPDLA-YRLHULLVSA-N 453.348 0.409 50 20 JCGD COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1 1796441300 VUEHBCJESHEELU-RRCBXWCQSA-N 467.526 0.961 50 20 JCGD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1)n1ccnn1 1799869728 ZIXQNMDULCRRBB-RSPOEFSDSA-N 468.562 0.824 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2c(c1)CCNCC2 1800246170 VMAOIBCZJQFLGG-PTOXDTDZSA-N 451.365 0.756 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NCc1ccc(OC)cc1 1800281238 ZCCAVSVDFAMQNO-ZRAXVTTISA-N 481.977 0.935 50 20 JCGD CC#C[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)c1ccc(O)cc1 1801012187 MQZIYDWYWJYTOZ-KSYXXAMZSA-N 470.570 0.852 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[C@H]1c1cccnc1)[C@@H](O)CCl 1803139221 VKNPDTHDEFSWSE-NUTKFTJISA-N 467.935 0.152 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)c1F 1805150170 MBHYIVWHTLJTGK-OXQOHEQNSA-N 459.526 0.955 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C2CCC(CO)CC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360406 AXKFLAHUYLIGHV-JAUAWXEUSA-N 465.359 0.880 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371302 SAIBWVYQGQPLCU-WIYYLYMNSA-N 470.298 0.438 50 20 JCGD COCc1c[nH]c(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1 1807373524 BJSRWNOGKWYYQG-KNQAVFIVSA-N 462.315 0.869 50 20 JCGD CN[C@H](CC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1)C(=O)O 1808414043 DPPBVXLULHFSBH-HGWFVYMKSA-N 483.529 0.284 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809973345 IJXDKONACIKBRM-SFHVURJKSA-N 478.358 0.425 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)C1 1809977458 HEWYSBAYQVQJOZ-OALUTQOASA-N 456.348 0.801 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)cco2)[C@H]1c1cccnc1 1810300602 ZIKNEXYSODQUSV-YWZLYKJASA-N 462.466 0.667 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccncc2O)[C@H]1c1cccnc1 1810303234 QXQDPPBDCVXMRQ-YWZLYKJASA-N 461.482 0.814 50 20 JCGD O=C(CN1CCCCC1=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1812973145 ASHZOXAPUGIQPH-AUSIDOKSSA-N 464.331 0.094 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813091095 LDFSXQOSEWNMLO-YSIASYRMSA-N 457.361 0.195 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)C(=O)N(C)C)n[nH]1)NC(=O)NCc1ccccc1 1817174102 VHEOWTXUVFBWMC-SFHVURJKSA-N 484.561 0.836 50 20 JCGD N[C@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cccnc1 1817405833 PUWBMTNGQQJZCH-UYAOXDASSA-N 462.319 0.881 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])[nH]n1)c1cccc(B(O)O)c1 1817475402 PURWGJDDTNGGQD-CQSZACIVSA-N 453.224 0.341 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1)c1ccc(B(O)O)cc1 1819023978 FVKLHKHMCXGNRG-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)sc2C1 1822628858 AYDHOTREPXZCEN-ZNMIVQPWSA-N 476.603 0.829 50 20 JCGD CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN(CCO)CCO)sc2C1 1825329320 RJNXJSOONIUKPB-NWDGAFQWSA-N 463.398 0.515 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826842004 SQTASHCFOPACJC-INIZCTEOSA-N 467.360 0.642 50 20 JCGD Cc1cc2nnc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)c(C)n2n1 1828148518 KXPNZJBTDOFVEP-OAQYLSRUSA-N 490.373 0.968 50 20 JCGD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn2[nH]cnc(=O)c12 1829597321 VGOYZLYIBIJSOS-NRFANRHFSA-N 491.357 0.558 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C1CC1 1830719535 FTAWNVLKVNVVCK-HRAATJIYSA-N 475.970 0.442 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830726570 QUNCBRVHUWWCTK-HRAATJIYSA-N 473.954 0.220 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830850791 GGAWROAFJVJCGL-YDHSSHFGSA-N 481.977 0.641 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1COc3ccccc3O1)CCO2 1832499621 VLCVADGQNYLYDW-UQASEVPWSA-N 454.907 0.537 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1834556368 FZUXZMNJEVIESM-JOCHJYFZSA-N 488.932 0.426 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCNC3=N)CC2)CC1 1834704843 IDGZIJHKNLTDDQ-INIZCTEOSA-N 457.417 0.571 50 20 JCGD NC[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)c1ccccc1 1834757199 VUDHAUXQXDCKOX-JOCHJYFZSA-N 493.612 0.613 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccnc(Cl)c3)CC2)CC1)c1ccc(B(O)O)cc1 1834797466 LLSYMCJOEGGNQS-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nnsc3C3CC3)CC2)CC1)c1cccc(B(O)O)c1 1834800214 YNRZEVYOGROEJS-UHFFFAOYSA-N 483.403 0.594 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834800668 WZXRJAADMNZWDZ-QHCPKHFHSA-N 470.423 0.424 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1 1835117601 CFGSUCHTTWETCC-RWPZCVJISA-N 498.592 0.025 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1 1835321720 GZSIMWPEECNBPE-CPUXBYDOSA-N 473.452 0.919 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(N2CCC(NC(=O)C3(C(F)(F)F)CC3)CC2)CC1 1835494305 IVZQZSLAAJSBGN-UHFFFAOYSA-N 467.297 0.894 50 20 JCGD N[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)c1cccnc1 1835829138 UWQJOZQOQDFDOV-LPHOPBHVSA-N 455.353 0.713 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ncsc34)C2)C1 1835930463 IVTFTTOUKKXSRZ-QHCPKHFHSA-N 481.339 0.360 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835932210 UEYYWBGGWIRBNT-VIDGFWFCSA-N 480.326 0.158 50 20 JCGD O=C(c1ccc2scnc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937194 RVZMNCVFVBBWFZ-HSZRJFAPSA-N 481.339 0.360 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1cccc1C=O)CCO2 1835953636 FOCQOONMILPBQB-RSXZNIESSA-N 498.540 0.452 50 20 JCGD O=C(/C=C/c1cccs1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835964935 ZCFFRTGMWWVBJN-WMWRJIBUSA-N 456.329 0.211 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3F)C2)C1 1837460573 HKIMSCHLDRWWCT-QHCPKHFHSA-N 489.479 0.276 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(C)C 1837919126 HGSQNANUJUHCGQ-JOCHJYFZSA-N 474.363 0.566 50 20 JCGD C#CCO[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838527146 JNOSFFRTLIPFJX-WAIKUNEKSA-N 489.481 0.628 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839040293 CNIRDYACBKEJGN-PGRDOPGGSA-N 480.949 0.578 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1 1839200539 MIOAGIPWOHCEHJ-IFIJOSMWSA-N 452.321 0.438 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3occc3c1O)CCO2 1839566530 YGUZIOWBTHHZEC-HSZRJFAPSA-N 474.514 0.581 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc3c(O)cccc13)CCO2 1839606122 FWYIRDALPGDWTD-VWLOTQADSA-N 491.309 0.004 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1 1839625095 BMQUAILQZMJCSX-LIRRHRJNSA-N 455.874 0.192 50 20 JCGD CCOC(=O)C1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CC1 1839761791 BMIABNDSFZUIBN-WBMJQRKESA-N 451.289 0.477 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1839966149 VXFKSPWTGVCJQO-JXFKEZNVSA-N 480.363 0.902 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)c3cccn3C)C2)C1 1839967535 PSKZCQUFJDJKDB-AUUYWEPGSA-N 456.337 0.838 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1840034007 XQGWHGGQPFAIOL-BMSLLPBFSA-N 484.347 0.692 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840045942 HNGVJRALHSVXEZ-XFQAVAEZSA-N 475.970 0.442 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(C)(C)C)nc3)C2)C1 1840182894 KXCSCZUBNKIHIL-DEOSSOPVSA-N 475.590 0.822 50 20 JCGD NC[C@H](N)C(=O)N1CCOC[C@]2(CN(C(=O)CCCCCCCCBr)CCO2)C1 1840937044 RRJBTFMOTWYSOB-PXNSSMCTSA-N 477.444 0.854 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CC1=O 1843010634 MUZQSQABOIWOCI-HXUWFJFHSA-N 475.354 0.853 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1845752728 FZHFETOUPZJXPU-SFQUDFHCSA-N 456.547 0.576 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN 1848323454 KICJNOLPUOXGPU-ROUUACIJSA-N 466.498 0.775 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1 9930987 ZRSWJCFLASDYKE-KRWDZBQOSA-N 469.585 0.158 50 20 JCGD COc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1S(=O)(=O)N(C)C 10682105 TYFLYGVGAXGNBT-QGZVFWFLSA-N 493.494 0.090 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1ccccc1 10777976 SXMKHNRRVUNNAD-UHFFFAOYSA-N 470.301 0.732 50 20 JCGD CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1=O 15191646 ZSOFPQMJWAOFKA-UHFFFAOYSA-N 478.553 0.543 50 20 JCGD O=C(CCCn1c(=O)oc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 15524833 QSASUVYRBIWTFE-UHFFFAOYSA-N 488.522 0.857 50 20 JCGD O=C(NNS(=O)(=O)c1ccc2c(c1)OCCCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1 16128179 DTKPSSRMLBFVCV-UHFFFAOYSA-N 497.551 0.492 50 20 JCGD O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)[C@@H]1COc2ccccc2O1 729233823 WUYFMIPHYAUHSY-IBGZPJMESA-N 455.519 0.549 50 20 JCGD C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)C[C@@H](C)O1 729506998 LSDHSKLAVVMAFG-CALCHBBNSA-N 478.575 0.354 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2ccc(OC(=O)c3cccc([N+](=O)[O-])c3)cc2)c(=O)n(C)c1=O 730569071 LYBNSYQSBSSYGA-UHFFFAOYSA-N 498.477 0.849 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)[C@H]3Cc4ccccc4O3)n[nH]c2n1 748273437 GNQJZNDWGRKTEA-CYBMUJFWSA-N 457.520 0.048 50 20 JCGD CSC[C@@H](C(=O)NNC(=O)CNC(=O)c1cccs1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 751211814 VLRZMLHDGACFAI-XQQFMLRXSA-N 452.558 0.532 50 20 JCGD O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1nn(-c2ccccc2)cc1O 789852770 GVMQEBSKORACRI-HSZRJFAPSA-N 460.450 0.732 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1 913415655 HDELOEFXSOLXBM-UHFFFAOYSA-N 465.484 0.620 50 20 JCGD O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1ccc(S(=O)(=O)N2CCOCC2)o1 914830685 PTJZBHOROCEHSL-UHFFFAOYSA-N 461.456 0.267 50 20 JCGD Cc1cc(C)c(CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(O)n1 916216487 LSBKFOUWDUCSKD-UHFFFAOYSA-N 491.570 0.888 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=S)NCC(=O)N(C)C)c1 918715948 MISNSUAJYAGKTC-UHFFFAOYSA-N 465.557 0.693 50 20 JCGD C[C@@H]1CCCN(C[C@@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1 919914469 HGWYZUUZCPCOFU-IAGOWNOFSA-N 453.613 0.764 50 20 JCGD CCn1nc(C(=O)NNC(=O)CNC(=O)[C@H]2c3ccccc3C(=O)N2C2CC2)c2ccccc2c1=O 920275903 NZAGMDGMEVCPBP-OAQYLSRUSA-N 488.504 0.653 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc[n+]([O-])c1)C2 1778091658 LIFMSPNFWQERET-LVGVVDSRSA-N 468.514 0.582 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)ccn1 1779372593 LXMQPUOHFYFDCI-AUSIDOKSSA-N 452.515 0.830 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CCn3ccnn3)CCO2)C1 1780098965 MEIXHPUANNDOJF-OAQYLSRUSA-N 472.458 0.645 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(Br)CC2)C1 1780780733 WCZCNHSHHLOJTI-VQIMIIECSA-N 465.153 0.421 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780891960 HMVLSVLTVASSFD-VWLOTQADSA-N 490.325 0.493 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969300 KSNPBNRJODUFHJ-UQBPGWFLSA-N 497.600 0.929 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969468 MMGYEOKKVRIZGC-YKSBVNFPSA-N 488.589 0.077 50 20 JCGD C[C@@H](C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccc(O)cc1 1781261061 FTAOZUJVQXNISW-IQMFZBJNSA-N 453.499 0.638 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4c3CCC4)C2)C1)NC(=O)NCc1ccccc1 1782319715 MHFHFEFSJJPOCB-VWLOTQADSA-N 495.584 0.619 50 20 JCGD CC(C)(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cn1 1783406787 HBGNSQMBNMLALI-JBACZVJFSA-N 465.359 0.966 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1783851463 FZHQEASQCGFYHB-PUOZZTSBSA-N 485.541 0.706 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1ccc(Br)nc1)CCO2 1783935728 VYPHWQBXAJZPLY-HXUWFJFHSA-N 482.379 0.590 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784093089 PPZGKPQIKCPEGF-FKAQHNMISA-N 477.961 0.915 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H]3NC(=O)NC3=O)[C@H]2C1 1785154729 JBKUDXYMKHDKPW-UGNSWCHMSA-N 487.463 0.450 50 20 JCGD NC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1785633766 UWOWIOYQMLFRSE-KXBFYZLASA-N 453.337 0.491 50 20 JCGD Cc1ccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1786590466 KBFXWUAVRIYIDX-NYVOZVTQSA-N 452.316 0.347 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc4c3CCCO4)C[C@@H]21)c1cccc(B(O)O)c1 1786984382 JLXYJGJAEPBTBE-QSFXBCCZSA-N 470.356 0.660 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(CCN2CCCC2)nc1 1787554304 PPJAMMNCCPBWIQ-WJMWBRGCSA-N 464.994 0.913 50 20 JCGD COc1ccc2[nH]cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)c2c1 1788325407 AWGYOZFAVVXWSZ-YROCYRMSSA-N 477.326 0.763 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1 1788610824 WFNLCJUUBATHFM-NDXORKPFSA-N 467.526 0.530 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1F 1788611227 PGDIKVPLVUWASQ-XERREHJYSA-N 485.516 0.669 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncon3)C[C@@H]21 1789221936 SWXJQBBSYCEPBH-NUTKFTJISA-N 459.415 0.810 50 20 JCGD 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CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1 1811620340 CLGIOGMZXJBWPX-PGRDOPGGSA-N 475.314 0.584 50 20 JCGD NC[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccccc1 1815160523 YAZUMEVMBDQUIB-ZWKOTPCHSA-N 464.356 0.791 50 20 JCGD O=C(CNC(=O)c1cccs1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336753 BXYIBOJSZSSRSE-AWEZNQCLSA-N 484.368 0.540 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCC3)CC2)c1ccc(B(O)O)cc1 1815344170 MABRCPLADIOKKA-AWEZNQCLSA-N 451.317 0.505 50 20 JCGD CC(=O)Nc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)o1 1815344192 NDWPPWIFHUYFTH-AWEZNQCLSA-N 468.300 0.914 50 20 JCGD O=C(CCNC(=O)c1ccccc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347723 MKTITNPFZOFLMP-SFHVURJKSA-N 492.366 0.869 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)COc2cccnn2)[nH]n1)c1cccc(B(O)O)c1 1817478836 CJIMVVOBGVTGFK-KRWDZBQOSA-N 450.264 0.264 50 20 JCGD COCCn1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)n1 1817610816 OCEYPEPTJTXYIQ-HNNXBMFYSA-N 469.332 0.205 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ncccn1)CC2 1819793104 KTKBTRIYGNFSAH-LLVKDONJSA-N 452.500 0.400 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CC[C@H](O)CC1)CC2 1819800916 VCFDIDHRODSLEB-AVGNSLFASA-N 458.544 0.919 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)COc2ccc(O)nn2)n[nH]1 1821666925 RQKHVXMDNUAFIZ-HNNXBMFYSA-N 481.473 0.289 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827055097 PVABFGPKVKLXGA-SFHVURJKSA-N 489.428 0.460 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924443 STELTUSPRSTDSZ-KXBFYZLASA-N 473.578 0.626 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2ccccc2=O)CC1 1828927058 YVVTZJJKAKECFQ-FQEVSTJZSA-N 466.542 0.780 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830363784 KWHBRQSTDSSBGE-ZHRRBRCNSA-N 492.013 0.984 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830533700 SAOLQJKBDKQVCX-FDVMBTMHSA-N 458.353 0.332 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1830542618 ASCXCGZQYRCBDD-XLIONFOSSA-N 487.439 0.254 50 20 JCGD O=C(c1nnc(-c2ccccc2)o1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732173 VRTGMEFCEIIDAU-MGPUTAFESA-N 450.879 0.406 50 20 JCGD CCOc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1OC 1830738844 VPJYCEYTTDDXJU-VGSWGCGISA-N 470.950 0.693 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1833452077 VFKKVQVGOXGZBM-WFASDCNBSA-N 485.420 0.576 50 20 JCGD CN(C)c1cncc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1833931401 GTKIDNCAQHJNRI-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD Cc1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1834799815 CDPYDBAQQJHMAE-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD O=C(CC1Cc2ccccc2C1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940787 AESRVWGLFIUIFU-SANMLTNESA-N 478.354 0.242 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1836592454 OMBHAKFMRPRNGB-DEOSSOPVSA-N 496.369 0.721 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1c1ccc(Cl)cc1)CCO2 1836596697 BRZKHLGWJYPSMB-SLSDLSHTSA-N 498.772 0.894 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(F)c1 1836689736 PGZSPQOSJFLMGZ-WIYYLYMNSA-N 458.914 0.823 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837171195 DDLBWJLSWCFCDB-KXBFYZLASA-N 466.336 0.973 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)c1 1837460014 QQNMSSCCRVHYJW-XMMPIXPASA-N 483.525 0.386 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3C[C@@H](O)C3)CC2)CC1 1838101279 DTNDJYBNUNVZNH-RDVZPDDCSA-N 459.547 0.890 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CNC(=O)c3cc(C)on3)CC2)CC1 1838408954 ZQEBWPQEEHZNKU-KRWDZBQOSA-N 470.954 0.965 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)ccc1F)CCO2 1838858810 UZDDUDLHDXVWCY-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD CCOc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nn1 1839201925 NPJZNLDNYPOXEV-YOEHRIQHSA-N 461.288 0.636 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc2s1 1839524050 SLYQTGCTQSQPBJ-QHCPKHFHSA-N 483.355 0.601 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1 1839965405 XQQBGNDPGHNZFP-DOXZYTNZSA-N 470.368 0.907 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1840184795 BVYAPPJKCRMZIM-QZTJIDSGSA-N 453.367 0.052 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)n2)C1 1843357161 XOJQEGDTFRSHFG-LBPRGKRZSA-N 455.899 0.837 50 20 JCGD NC(=O)[C@@H](N)CCC(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1 1845941171 IVSNTDKRMDTTFA-HOTGVXAUSA-N 451.365 0.789 50 20 JCGD CC(=O)N(C)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1 1848023263 QCFOTYXIQZMRMB-PMACEKPBSA-N 458.563 0.403 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)COc1ccc([N+](=O)[O-])cc1 28663324 QNXFDRHIPDXPSN-UHFFFAOYSA-N 492.510 0.775 50 20 JCGD Cc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1-n1cnnn1 106011647 ALAOXWOLINRKMB-UHFFFAOYSA-N 455.500 0.830 50 20 JCGD Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)ccc1[N+](=O)[O-] 726527740 IZSNRQGJDXWZOP-HIFRSBDPSA-N 453.477 0.025 50 20 JCGD C#Cc1cccc(NC(=S)NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)c1 727499189 DTEJUXAAUJOAJQ-UHFFFAOYSA-N 460.317 0.892 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc2c(c1)C(=O)N(C[C@@H]1CCCO1)C2=O 728846383 YSIRDDNFAIHPNO-KRWDZBQOSA-N 478.509 0.929 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728846420 YYAZVXKLJPGSOT-UHFFFAOYSA-N 489.558 0.120 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1 729276226 ZSXHZDBVHRIGQE-SNVBAGLBSA-N 492.938 0.979 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)NCc1ccccc1CS(=O)(=O)N1CCOCC1 730820176 GVJWWBRHIJYTOX-UHFFFAOYSA-N 478.527 0.464 50 20 JCGD O=C(COC(=O)Cc1csc(N2CCCC2=O)n1)NNC(=O)[C@H]1COc2ccccc2O1 749985619 LFMJNESSSOECNO-OAHLLOKOSA-N 460.468 0.343 50 20 JCGD O=C(COC(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)[C@H]1COc2ccccc2O1 784364332 DAOFFHYDGCNPGV-JKIFEVAISA-N 459.455 0.082 50 20 JCGD CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)o1 915062573 XDNHQQHBYJKAQJ-UHFFFAOYSA-N 456.502 0.047 50 20 JCGD CC1(C)NC(=O)N(CC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)C1=O 917359440 LULVGBXDMCGLOL-UHFFFAOYSA-N 465.513 0.640 50 20 JCGD Cc1c(/C=C(/C#N)C(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc(C#N)n1C 918571786 MFQRRNKXXPFLTK-UYRXBGFRSA-N 467.555 0.775 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 920398921 HSZJAVDAERCAAD-LJQANCHMSA-N 490.538 0.434 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1 920826299 KQGOHPSERJVFEG-UHFFFAOYSA-N 476.477 0.876 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NN/C=C2\C(=O)NC(=S)N(CC(C)C)C2=O)c1 920976599 YRSFVVRDFODAMK-LFIBNONCSA-N 481.600 0.735 50 20 JCGD CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)s1 1251619719 LBGIJYAONQIPHW-UHFFFAOYSA-N 452.562 0.443 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)CC2)o1 1317874853 WWWCWNMAUTYUIO-OAHLLOKOSA-N 491.588 0.349 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1778072056 MKRBVZTXHVCUEU-UZSYQUHHSA-N 487.586 0.770 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778113834 DUGDNMYKZCVNQV-KDOFPFPSSA-N 480.425 0.519 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc4cc(F)c(F)cc4[nH]3)C2)C1 1778402094 SXTUIHQGKDJZOE-HSZRJFAPSA-N 469.253 0.883 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1778438341 KBJCVZCSRLIMHD-XMMPIXPASA-N 475.509 0.694 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779335019 DGESCJMPOGEFDW-YZZKKUAISA-N 459.547 0.386 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ncnn1C)CCO2 1780095596 QRGNZAWIDQBXRF-FQEVSTJZSA-N 458.431 0.406 50 20 JCGD Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(-n2nccn2)c1 1780240757 SQPZMPHEPFTZMG-DEOSSOPVSA-N 475.314 0.013 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780939330 PJJBOJRRYZAQPJ-QHCPKHFHSA-N 482.733 0.582 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1781395658 OTTBHWAXBFUWOK-DVECYGJZSA-N 488.589 0.963 50 20 JCGD COc1c(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)ccc(F)c1F 1781847655 SZPSPDJSKRVHNB-JOCHJYFZSA-N 475.452 0.729 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(S(C)(=O)=O)c3)[C@H]2C1 1783749191 WJQWIRHSZRNRNZ-DKIMLUQUSA-N 458.964 0.937 50 20 JCGD CC[C@@H](C)[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1784555436 VOJNNBLYXFEPHO-NSMXDQILSA-N 489.617 0.719 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786404840 WJJFMFPPLLKGNE-XUXIUFHCSA-N 454.387 0.079 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3sc(N)nc3C)[C@H]2C1 1786916990 DEJJPOLQGNOEJA-MIFGEAQISA-N 473.559 0.761 50 20 JCGD COc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)ccc1[N+](=O)[O-] 1786982010 XDRCONHKFLEWPE-JLMWRMLUSA-N 497.313 0.119 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)ccc2c1OCCO2 1786982770 ASTSXTPPMFVEJX-XJABCFGWSA-N 480.326 0.353 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cnccc4n3)[C@H]2C1 1787888686 OTVDULJQUJLHNV-XERREHJYSA-N 475.509 0.535 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4[nH]ccc4n3)C[C@@H]21 1788611075 KAPHWVIVWKWHJU-RISOHXOYSA-N 463.498 0.469 50 20 JCGD CC(=O)C[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726864 YLONANHRYPPJAD-MNAPGUCWSA-N 487.601 0.928 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(-c4ccccc4)n3)C[C@@H]21 1791290813 OEOVQVLNROMHSQ-CUWPLCDZSA-N 468.558 0.839 50 20 JCGD CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1F 1794513011 WBUFKTBMMWMAHA-GPVAFHQSSA-N 459.482 0.448 50 20 JCGD CC(C)(C)OC(=O)CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732800 MOOGRSVZSKQCCV-UPHUGPLXSA-N 460.336 0.082 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCCC3)c(F)c1)C2)c1ccc(B(O)O)cc1 1795735058 LFAHINDNTKAYJQ-BBIADKPPSA-N 481.333 0.623 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn(-c3cccnc3)c1)C2 1796441272 RDVCPNXLTSVVCI-MXXHGQMLSA-N 490.524 0.605 50 20 JCGD Cc1cccc(C)c1SCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1797947535 RUHDDQJAMXHFPB-HATOLVCRSA-N 468.384 0.979 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cccc(OC2CCOCC2)n1 1798373084 BJXPHJBMHZJKQL-CSHUHZATSA-N 453.923 0.442 50 20 JCGD CC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1800069529 FJSGMWRJZWTKKD-CRWXNKLISA-N 450.927 0.089 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cc1ccncc1 1800191081 RLLDGTJMWFILLT-UYOHPNQJSA-N 466.542 0.984 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC 1800983180 QGEOBNHFJCUTPI-YIDVYQOGSA-N 491.969 0.286 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=CCN(C(=O)OC(C)(C)C)CC1)C2 1801014099 FVUDQZHINJHRTE-RMFSNUHRSA-N 493.605 0.516 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc[nH]n1)NC(=O)NCc1ccccc1 1801365096 UPSJOBNAHIZQGF-ACDBMABISA-N 453.547 0.937 50 20 JCGD CC(C)(C)C(=O)Nc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1801918451 BZJQWRUQWGBKBT-HATOLVCRSA-N 493.369 0.868 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)CC1 1804118914 CRUKJZLJDXHTEF-ACDBMABISA-N 457.336 0.487 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1COc2ccccc2O1 1804198974 YSPBVDJZHCGVEJ-WUMKDDEVSA-N 487.321 0.921 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1 1804811644 YLAVHOYEZVTBHN-FOIQADDNSA-N 488.508 0.207 50 20 JCGD COc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c(F)c1 1807361765 HUEGDDBNFXBZJT-HTAPYJJXSA-N 478.289 0.938 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)c3cnc(OCF)cn3)C2)CC1 1807644965 GYULYPOWRFXADZ-UHFFFAOYSA-N 456.283 0.621 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc2n(n1)CCCC2 1809865230 PFPLCTYEQXLPEP-CVDCTZTESA-N 473.342 0.928 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cn1 1809967074 QNPYKAKSJFITKY-UHFFFAOYSA-N 499.398 0.465 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1 1813070341 IVJXODQKZOYTJD-DYESRHJHSA-N 460.535 0.303 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1 1813075013 YSMIDNMEIGOZEQ-YWZLYKJASA-N 469.502 0.262 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1813412993 LPDBRXAJFFIJCI-MMOPVJDHSA-N 476.541 0.933 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1 1814877877 NBGAIMFGTSURIV-OWCLPIDISA-N 451.915 0.472 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337058 KHCVDUZOQDMKGX-OAHLLOKOSA-N 458.349 0.211 50 20 JCGD O=C(CC(F)(F)C(=O)O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1817092161 YBZOGVQVZWYZDX-LLVKDONJSA-N 453.232 0.159 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817281574 HIULPLJSGKJPIB-QATMBAMGSA-N 471.543 0.880 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCn1cncn1)CC2 1817282511 HSWPHXREYSKICP-PKCARXMOSA-N 469.531 0.871 50 20 JCGD Cc1cnc2c(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3cccc(B(O)O)c3)CC4)cnn2c1 1819088222 KDKQAZFUUFALCI-HNNXBMFYSA-N 476.327 0.714 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)C1(O)CCC1 1819791632 QRZCEUFNZPMNSQ-VXGBXAGGSA-N 458.544 0.919 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819799974 HYUJXWVJIFEALO-LBPRGKRZSA-N 468.543 0.950 50 20 JCGD COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)nn1 1820039376 ODNLZDOOPNIKDS-QGZVFWFLSA-N 450.264 0.508 50 20 JCGD CS(=O)(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1822970620 YIUKLEZPFNLJBT-HNNXBMFYSA-N 463.520 0.149 50 20 JCGD CN1CCCn2nc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)CC3)cc2C1 1827053748 ZTLDOMWPTLBTGI-XMMPIXPASA-N 493.417 0.946 50 20 JCGD O=C(O)C#CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551535 QOJVRXWKVWRMGL-VGOFRKELSA-N 477.901 0.126 50 20 JCGD N=C(N)NCC(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc1ccccc1 1829359921 MHQVRLDYLXYZFW-FQEVSTJZSA-N 485.372 0.725 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830358581 DQWYRPVYCMVHJY-OPAMFIHVSA-N 491.029 0.950 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2c1 1830731903 RQPMDJSFOFOPQX-WIYYLYMNSA-N 451.907 0.846 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)s1 1830733403 LFXXSLXJFJBKFZ-IFXJQAMLSA-N 460.936 0.133 50 20 JCGD O=C1C[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CN1Cc1ccccc1 1831109894 ZZBBLITVBUBKLN-SELNLUPBSA-N 479.961 0.091 50 20 JCGD Cn1nncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549712 YZMHVYFCAMFVTG-VBKZILBWSA-N 486.957 0.017 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc(N2CCOCC2)cn1 1834002453 DWYGKIBARLXNIH-OAQYLSRUSA-N 480.009 0.703 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4[nH]ccc4n3)CC2)CC1)c1cccc(B(O)O)c1 1834800067 OXYANGUXPLZPRU-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccn1 1834800451 HMSRSJLDLYPSCT-GOSISDBHSA-N 464.375 0.750 50 20 JCGD Cc1noc(C)c1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801126 QOHBGDGYNXXOPE-UHFFFAOYSA-N 454.336 0.470 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc4cncn4c3)CC2)CC1 1835618806 UVTCGPSPYBWACG-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835836903 ALBUTMAGXNEEMC-UHFFFAOYSA-N 476.654 0.722 50 20 JCGD Cc1cc(C)c(OCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(C)c1 1835934109 OGYZNGNCWLNFRU-AREMUKBSSA-N 496.369 0.441 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccs3)CCO2)C1 1835968441 JRXPZDSOIZGDPE-XYASWCNUSA-N 450.561 0.591 50 20 JCGD CC(C)(C)n1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1 1836176234 GZPTVLRWNVNUMA-UHFFFAOYSA-N 497.604 0.531 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)N1CCN(C)CC1 1836375886 ISDHEEYSARXJIS-CRAIPNDOSA-N 476.435 0.884 50 20 JCGD CN(C)c1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)o1 1837387069 FNKGXJQTSCXUBM-UHFFFAOYSA-N 470.335 0.346 50 20 JCGD O=C(c1cncc(F)c1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837522450 MAXDCIVFQOFARN-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc4nn[nH]c4c3)CC2)CC1 1837920283 WDTIKPKVBNVXCJ-UHFFFAOYSA-N 477.330 0.564 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)n1ccccc1=O 1838428472 BXVWOZVWECLHNO-SFHVURJKSA-N 475.590 0.781 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cc3)CCO2)C1 1838959481 XMKWTWXCRHLYNS-QFIPXVFZSA-N 473.917 0.722 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1839148680 GFLROBRBMXNGPY-VLMPBXDWSA-N 489.997 0.831 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1 1839198409 ZLIQKCKXVFFEIH-RHSMWYFYSA-N 494.339 0.246 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccccc1F 1839233883 PNJSWYYDZQXWLP-STZQEDGTSA-N 485.940 0.233 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1O 1839308338 XCRLAMRVDZAJAM-QHCPKHFHSA-N 469.498 0.083 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1OC 1839399524 CCRYXDGDGWRWDO-XMMPIXPASA-N 492.573 0.455 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1840033763 PPRIYTPPDOBBGZ-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CN(C(=O)OC(C)(C)C)C3)C2)C1 1840156510 QDHGQLCBVDMPGG-VGOFRKELSA-N 489.997 0.954 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cccc(O)c3)C2)C1 1840184731 CMJGRUVGMPTLRY-AVAOGFIGSA-N 460.531 0.235 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1844702062 BNAKFMSITRMGON-UHFFFAOYSA-N 467.486 0.790 50 20 JCGD Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2)c1 9931174 QRNANGKMZJAAME-OAHLLOKOSA-N 451.526 0.992 50 20 JCGD O=C(O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 13345693 AEWCYAQPPBSYPR-UHFFFAOYSA-N 469.497 0.029 50 20 JCGD COCCOC(=O)c1c(C)[nH]c(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1C 107611677 HPOPDOPANHGZSE-UHFFFAOYSA-N 480.543 0.825 50 20 JCGD CN1CC(=O)N(CC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)C1=O 725908307 KSNYDKSDNOWDLJ-UHFFFAOYSA-N 451.486 0.204 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)NC1CCCCC1 725989387 NCHDWZWWVPLFHH-INIZCTEOSA-N 460.578 0.431 50 20 JCGD CC(=O)Nc1nc(C)c(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)s1 727350940 YBOOYTDJFLESLA-UHFFFAOYSA-N 475.574 0.349 50 20 JCGD CN(C)N(C(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1)[C@@H]1CCS(=O)(=O)C1 728178576 YTMCOGGXPQAJJP-OAHLLOKOSA-N 465.544 0.858 50 20 JCGD CC(=O)N1C[C@@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)Oc2ccccc21 728213817 QTWXWZPIZMCZIN-NRFANRHFSA-N 473.555 0.880 50 20 JCGD Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 729282547 BGJJXRMCHIUZMG-UHFFFAOYSA-N 460.516 0.545 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)CN1CCN(Cc2ccc(Br)cc2F)CC1 729531981 XSVGZIFWZXMYSE-UHFFFAOYSA-N 496.337 0.876 50 20 JCGD N#Cc1ccc(C(=O)NNC(=O)NCc2ccccc2CS(=O)(=O)N2CCOCC2)cc1 747103264 BWIBABSWSFDKFS-UHFFFAOYSA-N 457.512 0.864 50 20 JCGD NS(=O)(=O)c1cnn(CCC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)c1 749942258 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0.817 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)nn1C 1834114301 NWEXFIDFFFNGTJ-HTAPYJJXSA-N 499.996 0.931 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccc(F)cn3)CC2)CC1)c1ccc(B(O)O)cc1 1834798020 VYZVYFHLNQKIIZ-UHFFFAOYSA-N 468.338 0.328 50 20 JCGD COc1ccnc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1OC 1834823770 JTKPQTZVSJTBTI-LJQANCHMSA-N 472.336 0.954 50 20 JCGD Cc1ccc2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)sc2c1 1835929167 DJEDKXVLMIZNMY-DEOSSOPVSA-N 495.366 0.668 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc4nn[nH]c4c3)CC2)CC1 1836500775 XCCRIALFXNHXSA-UHFFFAOYSA-N 470.578 0.516 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1ccnc1 1836778363 PYDSSDOKJJRPKS-MRXNPFEDSA-N 469.546 0.755 50 20 JCGD CC(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)on1 1837459360 DINYPFZWHNXWHP-QFIPXVFZSA-N 472.502 0.180 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920307 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COC(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1840277531 AYWAJZNWJHHELA-LAUBAEHRSA-N 454.907 0.072 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)CCO2)C1 1840771534 CJNCKWGMVXXUJR-WZONZLPQSA-N 491.928 0.440 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840869393 WKMHSBHSCLIUON-UTKZUKDTSA-N 450.923 0.552 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cccn(C)c2=O)C1)NC(=O)NCc1ccccc1 1841721322 YBUPRDHZJUZXAO-UHFFFAOYSA-N 466.542 0.549 50 20 JCGD Cc1nc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)c(=O)[nH]c1C 1842183181 AODNFTSHJXVOBK-UHFFFAOYSA-N 481.557 0.550 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014920 PUAMZMFDCLHCCF-UHFFFAOYSA-N 477.326 0.452 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cnn3c1CCC3)C2)NC(=O)NCc1ccccc1 1845039220 SHBDAOASIQKZKG-UHFFFAOYSA-N 465.558 0.993 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1(CNC(=O)OC(C)(C)C)CCOCC1)C2 1846383904 HIVSRFWMTTYMSQ-UHFFFAOYSA-N 495.621 0.884 50 20 JCGD CCCC[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 14044447 DIPPBGZDTDRLJB-KRWDZBQOSA-N 496.549 0.992 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)Cn1c(Br)nc2c(=O)n(C)c(=O)n(C)c21 23058050 SBWQKUSLFUFSRQ-UHFFFAOYSA-N 499.709 0.319 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)o3)cc2)CC1 728214805 SNFVGJFSIHZWQW-UHFFFAOYSA-N 497.599 0.757 50 20 JCGD CC[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(S(N)(=O)=O)c1 729221042 HBXSXJXXUSMVCO-AWEZNQCLSA-N 468.561 0.722 50 20 JCGD CCn1nc(C(=O)NNC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)c2ccccc2c1=O 786262831 NCCCCQSJDBZWRN-MRXNPFEDSA-N 484.900 0.505 50 20 JCGD COc1cc(N2C[C@H](C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cc(OC)c1OC 914437961 TXSMUQAAKKSHAJ-ZIAGYGMSSA-N 455.533 0.558 50 20 JCGD COc1cccc(/C=C(\C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n2nnnc2C)c1 915164996 VPRYLFMTTUKQJV-WOJGMQOQSA-N 456.484 0.853 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2)cc1 1261255415 XVUXGVSVZLDZTH-UHFFFAOYSA-N 460.541 0.847 50 20 JCGD COC(=O)C12CCC(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)(CC1)CC2 1779032399 QFYLMHOOEAFYSQ-STEQJIOHSA-N 499.568 0.642 50 20 JCGD O=C1COc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)cc2N1 1779046087 FSCIFMGKEGVDHB-QLVMHMETSA-N 451.907 0.745 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1779948274 HBOYNTVCFNXEOR-KRWDZBQOSA-N 455.334 0.985 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780936176 ZOASMMUFYVLXGQ-FQEVSTJZSA-N 454.980 0.986 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccnc1C(N)=O)C2 1781997705 GHYFWZQXEGQCJO-SEDUGSJDSA-N 454.325 0.486 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1 1782014946 SNKPFWIHLZBGAS-MRAZWZEMSA-N 490.524 0.845 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)CC1 1782213200 BQBROCMUAWYPGE-IIBYNOLFSA-N 452.552 0.217 50 20 JCGD CCOC(=O)N1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)CC1 1783130207 UUUYBVBJZJWMKJ-CBGDNZLLSA-N 459.971 0.969 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1783461808 RFEKKFCMFPANPF-AYCKEJKLSA-N 499.373 0.067 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)C1 1784016211 ZVASLYNNGLTPDZ-UXHICEINSA-N 490.395 0.973 50 20 JCGD COCCOCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785076436 GRYGKAJJVAEVLC-QAETUUGQSA-N 477.986 0.761 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1786847804 FISFGUOBGZWEPW-SBJFKYEJSA-N 495.390 0.899 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)n[nH]3)[C@H]2C1)NC(=O)NCc1ccccc1 1786940804 OXZHUEXUUPATSS-LNLFQRSKSA-N 485.545 0.055 50 20 JCGD CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)n(C)n1 1787508805 UZGRXECTNDMWDW-AYOAJRLASA-N 469.546 0.710 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COC(=O)C(F)(F)F)[C@H]2C1 1788529749 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O=C(NC[C@@H]1CCN(C(=O)c2cnc(Cl)nc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807366905 VUQPDCCZRSNWCR-QFBILLFUSA-N 465.706 0.838 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1807376714 VZISCPFMHXNDEA-XMSQKQJNSA-N 488.309 0.576 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnn2ncccc12 1808174215 QKBKKIGZRGTRDV-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1 1808416831 RUNSPHSUCGANST-PGLHNWFYSA-N 491.508 0.146 50 20 JCGD O=C(NCC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)c1cccs1 1809968866 GYOYYXBZMRGBFX-UHFFFAOYSA-N 469.372 0.703 50 20 JCGD O=C1NCc2cc(C(=O)N3CCC4(CCCN(C(=O)c5cccc(B(O)O)c5)C4)CC3)ccc21 1809978672 JXUIXLSCLZOIDP-UHFFFAOYSA-N 461.327 0.768 50 20 JCGD Cc1ccn(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810294513 LNBQAUYUEBTODU-UWJYYQICSA-N 462.514 0.605 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810295657 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C[C@H](NC(=O)c1cnccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2 1820021693 VQIOIQWMEAMRAY-CWSCBRNRSA-N 452.924 0.263 50 20 JCGD CCCNC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1824403665 SVNSUDOUALNOIE-OAQYLSRUSA-N 457.380 0.906 50 20 JCGD COC(=O)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1826499699 LJMIFNZIVPVHMQ-DLDHGHKKSA-N 461.504 0.545 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050716 VLKFUPWMTCZEAK-OAQYLSRUSA-N 457.380 0.762 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055916 NYXLCLYOGFITSM-YUQDSPFASA-N 453.348 0.458 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924504 VMENSTVPOCNLBO-DNVCBOLYSA-N 456.547 0.609 50 20 JCGD Cc1cn(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)c(=O)nc1O 1828925573 LUWJORZICCCSOB-IBGZPJMESA-N 497.556 0.189 50 20 JCGD CN1CCN(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1 1828925672 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O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1 1834821809 ZLZRTYZLBNWRCK-GOSISDBHSA-N 452.309 0.813 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1834823366 QGJYBNQMSRPJNB-SFHVURJKSA-N 452.309 0.584 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1834824234 YTUIVLCADVZBJV-IBGZPJMESA-N 466.336 0.513 50 20 JCGD Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1835258138 PWGJBZTWGPVLHT-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnncc3C(=O)O)CC2)CC1 1835921288 GWVPWVUPVIJYIS-QGZVFWFLSA-N 453.927 0.614 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1 1835932120 OTQOWSCNCAFJGH-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939995 RRLSOSZMSZTHBW-UZUQRXQVSA-N 485.371 0.012 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1836255410 AXASAZCSLAUYEQ-AUUYWEPGSA-N 474.967 0.316 50 20 JCGD 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0.721 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185743 WNCKWODPDJKIJN-HSZRJFAPSA-N 491.545 0.308 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1840890055 UUJWWRAGCGUTGU-UUOWRZLLSA-N 452.316 0.240 50 20 JCGD Cc1c(Br)c(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)nn1C 1843011818 XKTNPJTYLWVYGO-UHFFFAOYSA-N 461.125 0.302 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@@H]2CN(Cc3ccccc3)CCO2)C1 1843924149 REIZJQBXWVNLBQ-QFIPXVFZSA-N 463.343 0.084 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(OCCCO)cc1)C2 1844264683 WQQPXNNERQTAAT-UHFFFAOYSA-N 453.499 0.577 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1 1844265317 QGGAIFUTMOKFRV-UHFFFAOYSA-N 451.483 0.531 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)N1CCCC13CN(C(=O)c1ccc(B(O)O)cc1)C3)C2 1847094325 QIYITYBUMUWNHX-ZCNNSNEGSA-N 483.374 0.971 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)[C@H](F)C1 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O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCCN1Cc1ccccc1)C2)c1cccc(B(O)O)c1 1795739774 LPZRLYZFZNAOOU-VRUIKYSZSA-N 491.397 0.624 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796189470 QSKRKRAKLZGNTO-MGQVEPIASA-N 451.288 0.388 50 20 JCGD Cc1c(Br)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)nn1C 1796191998 YYKDCUHGSXLHEB-MUJYYYPQSA-N 475.152 0.736 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccccc13)C2 1796441980 LPTBAAAGBPGVCC-DHMDNZFNSA-N 463.498 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nn(C)cc3c1)C2 1796443751 GKIQPIKEVDZPCK-ZRNHTGQWSA-N 477.525 0.911 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O 1796874789 KJENRRGJZRWTCQ-WMTNFOANSA-N 473.559 0.561 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cc(Cl)ccn1 1797907647 RYUVDJAJMRCGKS-VTEUUUEMSA-N 453.927 0.076 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798442015 RKGUNLSUAJPHTO-MUJYYYPQSA-N 490.561 0.478 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC(=O)NC1)C2 1798521406 GPVROTYLZYACOX-GXNBUGAJSA-N 474.470 0.250 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c1CCc1ncccc1-2)c1ccc(B(O)O)cc1 1799167029 KCWRIMXIKKVTBI-BCDXTJNWSA-N 471.326 0.816 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2 1799683488 FOIZBCYTODDZSM-FYMKNAMNSA-N 454.351 0.655 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1799878189 JJKNGAYLLIDZBK-DZJQYVJYSA-N 451.867 0.928 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)CCC(N)=O)C2 1800332436 LBTJBZNHBVGLAO-WWKBNMOASA-N 461.469 0.054 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(Cl)cc2)CC1 1800398018 IYHUUOLTSBJSBP-UPHUGPLXSA-N 468.746 0.955 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)c1 1800845851 OGNBYPKREUTUQK-BJWYYQGGSA-N 474.319 0.475 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2 1800978489 SFWGXKKGRSFHRT-NXEZDXNNSA-N 450.923 0.183 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccccc1F 1801526361 QVRHEHSNNUQSBJ-VPTLXERWSA-N 455.490 0.660 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2c(c1)CCCO2 1801673001 QRVZBKKVWOOSFH-HATOLVCRSA-N 450.300 0.208 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccccc1[N+](=O)[O-] 1802110005 NKWJKFZEKXKAMH-AOXIVVNTSA-N 459.503 0.571 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCc2cn[nH]c2)[C@@H]1c1cccnc1 1804502860 ZNHCTQCQIIZRMY-UTKZUKDTSA-N 462.514 0.756 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C(=O)C1 1804524503 IHMTVSWEUMOVDK-QKPAOTATSA-N 472.970 0.304 50 20 JCGD COc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1807376782 XXBVMADGDKMQNF-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnn2ncccc12 1808174503 SDTNBETXKXRGKR-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD CCNC(=S)NCC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808416604 OVFQXDXNRRURQK-QXIYLWIPSA-N 498.613 0.705 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1nc(O)n2c1CCCC2 1810589699 JIUPNQTZSPLCEB-XMSQKQJNSA-N 489.341 0.633 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1 1813072369 BCUBGUNTLUODRC-FDDCHVKYSA-N 458.563 0.473 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)COc2cccnn2)[C@H]1c1cccnc1 1813388192 XETUOOKFUDGFIH-IIBYNOLFSA-N 476.497 0.269 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)CN)[nH]n1 1815704193 GAFJHCXDGLHVMY-FPMFFAJLSA-N 457.963 0.820 50 20 JCGD CCCNC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470056 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COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)C1 1830708761 KXNPVPFTTJBZSP-QMTMVMCOSA-N 461.353 0.817 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726957 YBELDZUDKLGCLI-HNAYVOBHSA-N 450.841 0.703 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)C(=O)c3ccccc3)CCO2)C1 1831150824 SLYZEJFDEVVONK-IIBYNOLFSA-N 482.375 0.998 50 20 JCGD CC[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)N(CC)CC 1831668363 RVLJVBYVIHPUSE-NUSMQRMGSA-N 490.605 0.697 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1)n1cncn1 1832203779 MIHIGMJVHUHNJY-KXBFYZLASA-N 454.535 0.771 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832945796 AIRQZILMZNINOG-KDOFPFPSSA-N 465.856 0.699 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1 1833027778 SKKDWSOCVMYEAH-AUUYWEPGSA-N 488.404 0.965 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1 1833313481 IOUWXOGWWIZVTP-HXUWFJFHSA-N 464.994 0.896 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1834553813 NOVXQJNSVCUXMQ-JOCHJYFZSA-N 473.722 0.107 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccc3F)CCO2)C1 1835004996 JPNQIYLUVOVZKJ-QHCPKHFHSA-N 471.489 0.137 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738335 XGSJKMBCBXCQHW-UHFFFAOYSA-N 486.573 0.380 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(F)c1 1835931196 IEAGEIGQNFGNLF-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD N#Cc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1Cl 1835931714 YMHZZAYCPANBJS-HSZRJFAPSA-N 483.717 0.275 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)nn3-c3cccc(=O)n3C)CCO2)C1 1836259834 LYSBXLXTVSIBJK-UZUQRXQVSA-N 491.976 0.967 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1n[nH]c2cccc(F)c12 1836496556 LZPSAAXGABWJEF-UHFFFAOYSA-N 493.348 0.881 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3cccc(Cl)c3)CC1)CCO2 1836577813 LYECBMFBYLRUHN-XMMPIXPASA-N 498.772 0.822 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3scnc3c1)CCO2 1837063096 HAZMKYKGPCEELS-QHCPKHFHSA-N 481.339 0.360 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4ncccc34)C2)C1 1837460120 VWEJVLFPQZWSHB-DEOSSOPVSA-N 491.508 0.012 50 20 JCGD O=C(c1ccc(=O)oc1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837586906 QQEPNCDCFBHFAY-UHFFFAOYSA-N 454.288 0.246 50 20 JCGD Nc1nc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cs1 1837891515 AWUKALZPMYLDFJ-UHFFFAOYSA-N 458.349 0.331 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cnccc3F)CC2)CC1 1837919484 XJVTZGKEMADMND-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)nn3C(F)F)CCO2)C1 1838716028 PSTKZEXUQYSLOM-UGSOOPFHSA-N 450.870 0.910 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)nn3C)C2)C1 1839962819 RKZQHGNGYOORDN-SCLBCKFNSA-N 459.341 0.672 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)C(=O)c3ccccc3)C2)C1 1840150335 IYLZJMXSSNSGLL-AVRDEDQJSA-N 467.950 0.469 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C(C)(C)C)C2)C1 1840184231 XJVLVTPKTZEDMF-DEOSSOPVSA-N 475.590 0.822 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cc[nH]c4cc3F)C2)C1 1840184813 BASFQEXJHXOPNW-HSZRJFAPSA-N 475.521 0.750 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1840371558 QDKWLONRKWYHEM-AHRSYUTCSA-N 490.388 0.150 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3cccc3)CCO2)C1 1840461297 LOQRCGXHAWSTTD-QHCPKHFHSA-N 470.530 0.037 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1 1840905532 GHWQETQCPZXJHB-YLJYHZDGSA-N 486.338 0.872 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@H](O)c1ccco1)C2)NC(=O)NCc1ccccc1 1845038187 BTRGRVFEMJVANF-HXUWFJFHSA-N 455.515 0.863 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@@H](C)N2CCN(C)CC2)C1 1845099360 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50 20 JCGD CC(C)Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)n(C)n1 1788610477 UUJAOHHPXBXEGY-ZRCAFCQKSA-N 483.573 0.524 50 20 JCGD C[C@H]1Oc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)cc2NC1=O 1789260609 MULJQVSICHWHFH-NOOLBSRQSA-N 451.907 0.599 50 20 JCGD COc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)ccc1[N+](=O)[O-] 1789850976 RZYBEHPJHANQOW-ZWOKBUDYSA-N 491.545 0.499 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)[S@@](=O)c1ccccc1 1790596634 SDDCRVVWZLOTIO-LTUPOAQJSA-N 499.593 0.475 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cccc(O)c3)[C@H]2C1 1790917359 DGLKYWAZRFSEOL-GKTHTKQVSA-N 465.510 0.697 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1793241403 QSZYGUFDNCDOGZ-YRPNKDGESA-N 487.362 0.254 50 20 JCGD O=C(Cc1ccc(C(F)(F)F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1795263973 VWNVYAXAEAXRFI-UPHUGPLXSA-N 476.260 0.831 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncc1C(F)(F)F)C2)c1cccc(B(O)O)c1 1795739203 ZVLKUPBWVRAIPA-ZSBFGKGUSA-N 463.221 0.297 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccccc1C(=O)OCCO 1796188579 WZFANPMKNAXOCH-REPLKXPHSA-N 466.299 0.081 50 20 JCGD Cc1ccccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797753978 MZTCLOWPWVIKHL-OPMZPASUSA-N 451.527 0.830 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1797953049 ZKBDFSZFFCOTNO-FLTUCWPJSA-N 464.595 0.434 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797953931 UVUNYZIHXWMMEW-UEUMHJPSSA-N 477.634 0.607 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1 1798440801 SWNFGNMFTLLSLD-QDMKHBRRSA-N 472.527 0.049 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C2 1801011249 DNFNAFJMQVSWLR-PDOICOKGSA-N 481.594 0.206 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803142071 XAQLUSWSKFYCBS-WBTNSWJXSA-N 456.927 0.530 50 20 JCGD Cn1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1=O 1803832108 BZZCXMKFFJUPMK-OXJNMPFZSA-N 475.509 0.412 50 20 JCGD CC(=O)N(C)CCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1804070324 STKFOBNTOQFAMS-DYESRHJHSA-N 467.530 0.268 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1804075630 YLIAFJIPDFWNFO-FCGDIQPGSA-N 459.352 0.922 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)cco2)[C@H]1c1cccnc1 1806130829 HDPRKFLPELXXSQ-MGPUTAFESA-N 462.466 0.667 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1806346959 QHHUEOZTTWOZDO-LPHOPBHVSA-N 457.369 0.159 50 20 JCGD CCn1nc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1C 1807362226 UZQHOPZZPZSJIP-UGKGYDQZSA-N 461.331 0.920 50 20 JCGD CCn1nc(C)cc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365221 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CCn1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)n1 1834405182 ZJQYUSBSMGSGLI-OLCUMFGGSA-N 471.518 0.107 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1 1834824785 MMNDIYJILZKLCI-NQIIRXRSSA-N 479.375 0.994 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1 1835079473 YTTGVUNMRATIKX-HZPDHXFCSA-N 464.966 0.978 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)CC2)CC1 1835113823 KHFIQZAXVJNDKO-RCBQFDQVSA-N 474.027 0.614 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835440974 MHXWXXBEMKQWSB-LPHOPBHVSA-N 462.385 0.196 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2 1835732785 BWOLEDRKXQLMCJ-UNMCSNQZSA-N 481.981 0.169 50 20 JCGD CCc1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)co1 1835738067 RXYSHEOSTKVASK-UHFFFAOYSA-N 469.546 0.735 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(F)(F)F)c[nH]3)C2)C1 1835928449 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1840034843 YYHDUVNXQGEWNM-SGTLLEGYSA-N 456.293 0.664 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C2)C1 1840154344 TVDWFYVOBGXGMH-UZUQRXQVSA-N 489.960 0.894 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185110 FYVBKBWRFTWHCV-QHCPKHFHSA-N 478.594 0.469 50 20 JCGD CC(C)(C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccn1 1840328218 CBBJUXPDEYQFKW-DEOSSOPVSA-N 482.541 0.128 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1841670601 ZGDCZMYJLQZKLI-QLFBSQMISA-N 456.996 0.777 50 20 JCGD CCc1c(Br)c(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)nn1C 1843143849 CFXQRHLHUBKKRF-UHFFFAOYSA-N 475.152 0.556 50 20 JCGD O=C(COC(=O)CCN1C(=O)c2ccccc2C1=O)NNC(=O)[C@H]1COc2ccccc2O1 8647532 ZVPXYLWYKZONGM-QGZVFWFLSA-N 453.407 0.203 50 20 JCGD CC(C)(C)OC(=O)[C@@H]1CC(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)=NN1c1ccccc1 728803670 AHYAEIOIIZEGHC-CJNGLKHVSA-N 450.517 0.545 50 20 JCGD O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 728976088 YKEKWEDHQFLQCB-PWSUYJOCSA-N 451.473 0.162 50 20 JCGD Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 729282560 CBJDIUMPCQWKSG-UHFFFAOYSA-N 474.543 0.523 50 20 JCGD O=C(COC(=O)c1sccc1S(=O)(=O)C(F)F)NNC(=O)[C@@H]1COc2ccccc2O1 731092565 DISAJBGYEDMKBC-NSHDSACASA-N 476.435 0.889 50 20 JCGD CC[C@@H](C)NC(=S)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 749759396 TZAVZOPRUJQQFM-CQSZACIVSA-N 457.560 0.722 50 20 JCGD N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1 751204178 FIIVVCXGNGAVJD-UHFFFAOYSA-N 459.484 0.129 50 20 JCGD O=C(NNC(=O)c1cn(CCO)nc1C1CCOCC1)c1cccc(S(=O)(=O)N2CCCC2)c1 856581246 BMNFVHZFYDETRO-UHFFFAOYSA-N 491.570 0.629 50 20 JCGD CC(C)c1noc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 915063258 UZLYCUGHODFBCC-UHFFFAOYSA-N 451.505 0.608 50 20 JCGD Cn1nc(C(=O)NNC(=O)CN2C(=O)COc3cc(Br)ccc32)c2ccccc2c1=O 915286209 FQCDOZOTTRITBP-UHFFFAOYSA-N 486.282 0.883 50 20 JCGD O=C(Cc1c[nH]c2ccccc12)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916516254 HPRJXMCIBAGSSO-UHFFFAOYSA-N 485.570 0.588 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@]2(N3CCOCC3)CCSC2)c1 916637234 VWFHCWNBGREEGU-LJQANCHMSA-N 471.605 0.089 50 20 JCGD CCCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 917541851 SDQUQACCMVIWNF-LJQANCHMSA-N 480.587 0.579 50 20 JCGD CN1Cc2ccccc2C[C@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028591 NBPYRKIMWSYZHX-SQJMNOBHSA-N 478.553 0.185 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cc2NC1=O 1779032686 RQYTYXJKAOULAR-LFPIHBKWSA-N 494.508 0.162 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2cnccc2[nH]1 1779126631 ISFJBDZFULRZTC-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc(Cl)s3)C2)C1 1779726869 UCEBFMCWKNDSJU-SFHVURJKSA-N 450.908 0.552 50 20 JCGD Cc1nc(F)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779902338 CXGNOAMWGZRBIZ-AUSIDOKSSA-N 455.295 0.650 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)C3(Br)CC3)C2)C1 1781344323 ZWTFLDPEKSVWGJ-MNOULKQQSA-N 466.336 0.878 50 20 JCGD Cc1ncc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)s1 1782508556 WIJVQHDOVUEIFP-DENIHFKCSA-N 457.361 0.502 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1784414745 YATWSKSOKUYXGM-KSFYIVLOSA-N 455.345 0.386 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)o1 1787508822 VWHJZTQHRMBBOR-RBFTXDQOSA-N 484.513 0.965 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3onc4ccccc34)C[C@@H]21 1788609907 RZJJLOFDUWVFOB-IXDGSTSKSA-N 464.482 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnoc3C3CC3)C[C@@H]21 1788610873 YQYIXDLPPJBACH-KKXDTOCCSA-N 454.487 0.458 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(-c2ccncc2)[nH]n1 1788925242 XSJASXYDXOVJSM-JLMWRMLUSA-N 475.314 0.059 50 20 JCGD 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NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(O)nn2)[nH]n1 1819401920 GAOFFHWULHQYOZ-HNNXBMFYSA-N 451.447 0.524 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)CC3)cc21 1827059149 GOCNOMAJAWLLLG-NRFANRHFSA-N 493.373 0.244 50 20 JCGD CN1CCCn2nc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)CC3)cc2C1 1827060467 KKKBWLDBVOGVTF-DEOSSOPVSA-N 493.417 0.946 50 20 JCGD O=C(COCCO)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829055765 BJZVNEPHZVUVKN-GHTZIAJQSA-N 471.913 0.982 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830533512 PINGEORQGLYQSE-DNVCBOLYSA-N 462.385 0.780 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1830535041 HFGGFKYONMXCAA-UGSOOPFHSA-N 458.309 0.187 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)no1 1830540546 QOVKYFBIZWLKRT-YJYMSZOUSA-N 487.351 0.200 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)N3CCN(C)CC3)C2)C1 1830543291 PESGKAXPRGYEGW-HLIPFELVSA-N 475.428 0.110 50 20 JCGD Cn1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1C(F)(F)F 1830724996 KTVDTNDFQBROLP-BLLLJJGKSA-N 454.833 0.109 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830731244 IPDSYQUFANOOKG-MGPUTAFESA-N 460.886 0.513 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccc1C 1830733303 HZVFHUHNPPBHKE-NQIIRXRSSA-N 453.923 0.623 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)C1 1831645619 CPSKFJDPWMVWLL-XFQAVAEZSA-N 477.986 0.736 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1831659170 NVPAMWLEWPZNFL-ACJLOTCBSA-N 464.009 0.711 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@](C)(O)CC(=O)O)CC1 1831875498 WIZAIMQLTWKKMI-VGSWGCGISA-N 454.568 0.595 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1 1832420004 XZYJLJCWJFMCGN-OXQOHEQNSA-N 474.396 0.876 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833310975 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C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1836398532 MOEJNXSXCUCFSB-KRWDZBQOSA-N 473.338 0.519 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1 1837153067 KZHUUAGNQSRGCA-LAUBAEHRSA-N 451.907 0.254 50 20 JCGD C=CC[C@@H](C(=C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837308864 CINPCXUUQGATQP-GAJHUEQPSA-N 457.531 0.524 50 20 JCGD C[C@@H](Cc1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837461618 ZZHMDUGJLDTFCG-QMHKHESXSA-N 471.514 0.227 50 20 JCGD CNC(=S)NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1837467224 ZLWMCSPATLXVOF-IRXDYDNUSA-N 455.408 0.163 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1837627212 WEXCUNZOKNPRGB-GOSISDBHSA-N 455.309 0.262 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837920358 OZTAHGRHPVCDCO-UHFFFAOYSA-N 469.303 0.099 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(C(N)=O)cc3)CC2)CC1 1838395328 CZSYKFNNOYWISD-UHFFFAOYSA-N 494.552 0.710 50 20 JCGD COc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)ccc1[N+](=O)[O-] 1839136253 PHSZNNOJRKKLML-UZLBHIALSA-N 471.894 0.202 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)Nc3c(C)cccc3C)CCO2)C1 1839158015 MSARZOLOMJUWGG-JTSKRJEESA-N 467.950 0.952 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cnc2c1 1839200618 LIOAAGIJSFHYEX-JXFKEZNVSA-N 497.321 0.763 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839649614 ZIGMKUMGIPLYJC-KUHUBIRLSA-N 471.352 0.602 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1 1840156047 MPNPXAHDTBGJMK-DODAUVCRSA-N 477.945 0.607 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3scnc3C(F)(F)F)C2)C1 1840183580 NARQIXLMNOSCFJ-GOSISDBHSA-N 493.508 0.605 50 20 JCGD COc1cc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840641797 ZBPRKGCXIUMDQE-JOCHJYFZSA-N 466.510 0.277 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)C(C)(C)O 1840916500 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DLCJWUIKVLRZQH-LBPRGKRZSA-N 468.395 0.805 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1 728519561 LLINOJRKCKUIAQ-DHIUTWEWSA-N 477.565 0.888 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)ccc1C 729275117 LLJNOSIZWNTDEW-ZDUSSCGKSA-N 484.556 0.503 50 20 JCGD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 731214692 WCCBWAMWOCFMRN-FUHWJXTLSA-N 460.535 0.668 50 20 JCGD O=C(NCc1ccccc1OCCN1CCOCC1)NNC(=O)c1csc(N2CCOCC2)n1 744291674 FNVBXXXDBYZNPU-UHFFFAOYSA-N 490.586 0.835 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)c(C)c1 751207349 WHOYSVIACSXWDK-UHFFFAOYSA-N 462.528 0.875 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)C[C@@H](C)O1 912918784 DQCXRVYFGBGDCC-VXGBXAGGSA-N 467.375 0.918 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(F)c(S(N)(=O)=O)c2)cc1OC 915463329 ZMVNOFIKHXWDMB-UHFFFAOYSA-N 455.420 0.108 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)c2ccccc2c1=O 916377480 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CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)C(=O)OC(C)(C)C 1788610587 IEDRFMXDMPZCRG-WBAXXEDZSA-N 490.561 0.145 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)s1 1788611336 UMRQZQNZQOTKFH-KFLKEAKISA-N 470.555 0.757 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(C)n1C 1789121872 DBWKTVOFMUJWBN-YSSFQJQWSA-N 454.531 0.548 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)cn3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724606 BBPGBPZAUNEPQS-ZJOUEHCJSA-N 483.573 0.360 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C[C@@H]21 1791063473 KCQMFQPMXGJQGG-BWJWTDLKSA-N 467.364 0.963 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4ccccc4O3)[C@H]2C1 1791230756 MOZPKUYTRMJWJW-PWZKMPOXSA-N 479.537 0.672 50 20 JCGD COC1(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)CN(C(=O)OC(C)(C)C)C1 1792981221 GPTYENDCVVOXEQ-JYYAWHABSA-N 475.970 0.202 50 20 JCGD 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O=C(CCN1CCOCC1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1817178830 SZNGACBGQLWHGK-LJQANCHMSA-N 455.324 0.118 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1C(=O)C=CC1=O)CC2 1817275987 KKAIRBHVPUHMKA-NSCUCBQXSA-N 497.537 0.504 50 20 JCGD COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nn1 1817476788 QJUBRSHGHQCCPW-KRWDZBQOSA-N 450.264 0.508 50 20 JCGD Cc1ccn(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819792840 BWVQKCQDZVZADP-LBPRGKRZSA-N 454.516 0.573 50 20 JCGD C[C@](Cl)(CCl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1 1820868466 JAYYLIYDUSQMKC-KDOFPFPSSA-N 450.367 0.925 50 20 JCGD Cc1cnn([C@H](C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1 1826746362 YNJKLWVMZZAVHM-CZUORRHYSA-N 453.333 0.815 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)N1CCN(C)CC1 1830237850 IKSIKUDLJPVZDZ-CVDCTZTESA-N 470.423 0.236 50 20 JCGD O=C(c1cn2ccc(Cl)cc2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731658 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RTSBLUZBPRQLHA-NRFANRHFSA-N 470.929 0.922 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CNCP(=O)(O)O)C1 1842874615 WNWBMESOUUNILR-UHFFFAOYSA-N 470.375 0.062 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc([N+](=O)[O-])c1OC 1843012110 FAUFHXAHJOPTDD-UHFFFAOYSA-N 469.259 0.423 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1 1846386389 HGJLZWPIZOPBFR-HNNXBMFYSA-N 471.624 0.819 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1847961779 ZNHHNNXLMHMUPS-OALUTQOASA-N 459.352 0.877 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=NN(C)C(=O)CC1 1848044485 YSMXTSVUOHIZMP-IRXDYDNUSA-N 457.443 0.944 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](NS(=O)(=O)c2ccc(C)c(C)c2)[C@H](C)O)cc1 9084217 DMXPDTMQHZDKLY-OXJNMPFZSA-N 477.539 0.644 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1OC 26690307 VKWGWYVLMHQZTK-UHFFFAOYSA-N 451.457 0.562 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCCn3cncn3)c2)cc1 726708814 HQLPVFHGEJKIOW-UHFFFAOYSA-N 459.488 0.732 50 20 JCGD COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(N3CCCS3(=O)=O)cc2)c1 726764976 QBUSKIYZTOQIHB-UHFFFAOYSA-N 455.514 0.867 50 20 JCGD CC1CCC(NC(=O)CN2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)CC1 728302311 MTHQNMBIJSGJGV-UHFFFAOYSA-N 469.550 0.329 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNC(=O)Cc3cccnc3)CC2=O)cc1 728851899 CORGVNQQOHKORS-KRWDZBQOSA-N 473.555 0.855 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)n1 730623149 YIBYBSGBSQMQRX-CQSZACIVSA-N 474.495 0.509 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccnc1C)c(=O)n2Cc1ccccc1 731000551 KYDYJSJNJXIBJP-UHFFFAOYSA-N 461.482 0.593 50 20 JCGD C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)C1 807136232 YBWPDPINHICJJW-CALCHBBNSA-N 469.550 0.139 50 20 JCGD COc1ccnc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3cc(C)ccc3C)CC2)n1 914763135 QNDFTSGEHQDIDK-UHFFFAOYSA-N 476.559 0.858 50 20 JCGD C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 914830019 QFEGFDWQYOSSSE-WBAXXEDZSA-N 459.524 0.790 50 20 JCGD O=C(NCc1nnc2n1CCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 916647730 CBQVRSKDDVPRQB-UHFFFAOYSA-N 461.548 0.933 50 20 JCGD CSCC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919885574 MEKOZSOBZRKVHX-BXUZGUMPSA-N 462.981 0.709 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc2[nH]ncc12 1777871934 XYGKTDZDIMVIPT-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1nccc2[nH]ccc12 1777901917 CEPWLIBSGKGJBS-HYBUGGRVSA-N 462.315 0.684 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2[nH]ccc2n1 1778997195 DZRPXWWCLWIDAW-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1 1779028094 DDBBVIILRUZFEG-OAQYLSRUSA-N 458.906 0.420 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](N)c1cccc(Cl)c1)CCO2 1779030649 GCVWHDCGLHTHFJ-XMSQKQJNSA-N 472.933 0.482 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CS(=O)(=O)N1CCCC1)C2 1779543818 RCWCSVAXLHRFDN-YLJYHZDGSA-N 475.684 0.777 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnnc1O)CCO2 1780097854 OZEIATQQKXZEKU-NRFANRHFSA-N 471.426 0.773 50 20 JCGD CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1780702666 ZOUWGXADWLLYLA-ZXYWRSMDSA-N 458.968 0.983 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1780739441 JWZCQLYGVCHWIZ-AUSIDOKSSA-N 458.320 0.003 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CCc3cncnc3)CCO2)C1)NC(=O)NCc1ccccc1 1780970090 ROZSSRQSNUKYAN-RUZDIDTESA-N 495.584 0.585 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@]3(NC(=O)OC(C)(C)C)CCOC3)C2)C1 1781312882 ZRRZNWXLRWURBZ-IWMITWMQSA-N 475.970 0.754 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2ccnc2C)C1 1781554215 LJZDCNVMNQKMDI-PZOAEKQQSA-N 469.546 0.839 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@](C)(O)CC(=O)O)C2)C1 1783929612 IGAYSFHLNXSZLS-FCHUYYIVSA-N 493.469 0.579 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C1)C2 1784094127 LHRGHWKFMVQLQA-RCMKLKEOSA-N 482.965 0.202 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784096582 INWIIPFMZCSQRT-SIRPWMCASA-N 457.955 0.482 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)C(=O)c3ccccc3)[C@H]2C1 1784346167 RCLZMFNYCKBJRD-VJANTYMQSA-N 451.951 0.992 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3C(N)=O)[C@H]2C1 1785519561 QUUMYGYCPFYSJK-MHEUCROKSA-N 453.337 0.947 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSC(=N)N)[C@H]2C1 1786778547 FMOGOUHYMFBATM-NUTKFTJISA-N 479.515 0.740 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCc3ccncc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980118 KWJHTYGGYUKKOD-BVSLBCMMSA-N 451.332 0.378 50 20 JCGD CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c2ccccc21 1786984596 USBRFXLXZVNXRG-XJABCFGWSA-N 476.342 0.643 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)C1=NO[C@H](c2ccccc2)C1 1788142628 KUXQQKIBNFHGIH-HMNCIZAVSA-N 477.326 0.477 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccn34)C[C@@H]21 1788610523 XOXYTEDJSYHQNI-FNHZYXHNSA-N 463.498 0.240 50 20 JCGD Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cs1 1788611713 UFFHMNVICCTAOA-KKXDTOCCSA-N 458.544 0.286 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCNC4=O)C[C@@H]21 1789865836 GHIIFDXMKSZBLX-CIMWUQIDSA-N 458.346 0.456 50 20 JCGD CN1CCN(C2(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]4C3)CC2)CC1 1789923338 GORPJIBXDUIZDC-VGWMRTNUSA-N 461.376 0.437 50 20 JCGD COC[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793442629 NGESOIMDJVTEOK-RDPOXOKHSA-N 461.563 0.205 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnnc1)NC(=O)NCc1ccccc1 1794672259 ZOMTVWHOJGNIKV-CEQLMSFQSA-N 467.530 0.026 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ccccc3)nc1)C2)c1ccc(B(O)O)cc1 1795735088 LSMMBTIJFKXFOU-RUMRUAAYSA-N 471.322 0.945 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccccc13)C2 1796441872 BVMWXCBUNTZDOS-IHBLFXCCSA-N 463.498 0.672 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c(=O)cn1 1798636086 AUADXLWAOCNDFI-SDGGPSBXSA-N 455.421 0.858 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799346209 JJIYQEYHQMUMHX-XVIXHAIJSA-N 481.363 0.509 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccn(C)n1)C2)NC(=O)NCc1ccccc1 1799871491 KAAVOIMERSEYEA-WKCHPHFGSA-N 467.574 0.947 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NS(=O)(=O)CC)C2 1800639975 DPEBYQDTYOTFDB-PEBLQZBPSA-N 454.387 0.077 50 20 JCGD CSCC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1801029275 VIAYWYPFQSRLLD-JTJHWIPRSA-N 493.630 0.036 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C2 1802329087 HJLCSILRRQNEPN-PJVZLEMVSA-N 495.621 0.616 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H](O)c1ccccc1 1806801044 OPFPPHWXJSILHS-MZYLBHOOSA-N 459.311 0.815 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)CC1 1807092862 VIYZTMWDJWPDFH-INIZCTEOSA-N 488.589 0.597 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)CC1 1807683711 KNTWYIRFPAASMM-UHFFFAOYSA-N 479.603 0.703 50 20 JCGD N[C@@H](CC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)c1cccnc1 1809885414 ZXZPNEWJFXURFE-NRFANRHFSA-N 450.348 0.696 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809975125 UTADNQUSSCHPJP-UHFFFAOYSA-N 461.331 0.656 50 20 JCGD COC(=O)C12CC(C(=O)N3CCC4(CCCN(C(=O)c5cccc(B(O)O)c5)C4)CC3)(C1)C2 1809980220 MURCAEDSMQVWQG-UHFFFAOYSA-N 454.332 0.555 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)C1 1817474183 PDYRQVGWYHMIAU-FCEWJHQRSA-N 468.319 0.985 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)c2ccco2)[nH]n1)c1cccc(B(O)O)c1 1817475589 UUBWLWVYQGNVKZ-QGZVFWFLSA-N 465.275 0.418 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1 1819402047 KNSBNZLLEFWOJK-KRWDZBQOSA-N 456.507 0.046 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)C(=O)C(=O)O 1823009353 NWQYHJHQLVZHOV-QUBYGPBYSA-N 451.274 0.289 50 20 JCGD Cc1cn(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c(=O)nc1O 1823370804 QRVPQMWFQZGFIC-HNNXBMFYSA-N 474.522 0.046 50 20 JCGD O=C(c1cc(=O)nc2cccnn12)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052213 FBPCAUSSOMOEAH-HXUWFJFHSA-N 489.341 0.316 50 20 JCGD O=C(c1cnc(O)[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551515 QFIHWPANZNIWJC-VGSWGCGISA-N 491.932 0.781 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C)CCC1)CCO2)NC(=O)NCc1ccccc1 1829684713 MVNGGTPIKUYKQB-RUZDIDTESA-N 487.601 0.979 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1830539572 ILQPJGFZVNVOFI-JLTOFOAXSA-N 498.378 0.118 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1830545218 IIMXHSPQQUWZRS-SJKOYZFVSA-N 494.433 0.334 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccc(O)nn2)CC1 1831083286 DNOYCYRECUJARV-OAQYLSRUSA-N 466.347 0.728 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1 1832929468 MLPKJNPBGMZIMV-YESZJQIVSA-N 489.013 0.975 50 20 JCGD COc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1O 1833188906 NEFWYUVVJOBXNM-UHFFFAOYSA-N 495.385 0.509 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1 1833272122 GUPKQUCCIOTKJQ-HZPDHXFCSA-N 464.966 0.978 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)o1 1834092776 JZTFFBSHDLWJBX-JOCHJYFZSA-N 457.487 0.279 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c1 1834818968 GSRCYJWABPDPMO-GOSISDBHSA-N 490.376 0.340 50 20 JCGD Cc1ccccc1NCC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1835866643 HPIKFOICRFAGCZ-QHCPKHFHSA-N 461.563 0.236 50 20 JCGD CCOc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835931212 IOEZDHBUVOVBFD-XMMPIXPASA-N 468.315 0.149 50 20 JCGD COc1ccc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1835931868 FGEOAOBJPHAMAF-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)N1C[C@@H]3C[C@H]3C1)CCO2 1837289786 WWKZIUOXBXCEFV-DRCYAFTPSA-N 458.397 0.957 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459528 HULUZIUKGNQJOX-SSOJOUAXSA-N 499.543 0.773 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)N1C[C@H]2C[C@H]2C1 1837921182 JGHSYVQMZDTZKV-YSIASYRMSA-N 469.391 0.319 50 20 JCGD Cn1cc(CCC(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1837930634 BLGNMHWVSNPFTB-UHFFFAOYSA-N 483.573 0.664 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)ncn1)CCO2 1838257434 WKOVBXYMZCZPHP-WMPMWDHYSA-N 489.920 0.334 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)/C=C/c3cnc[nH]3)CC2)CC1 1838395482 WNLUWEWVNZPXKI-OWOJBTEDSA-N 467.530 0.734 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COCCNC(=O)OC(C)(C)C)CCO2)C1 1839139337 APEQEWSUBZKFRJ-IERDGZPVSA-N 493.985 0.238 50 20 JCGD O=C(c1cc2n(n1)CCCO2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201366 VTBNUKLGUABFMO-PBHICJAKSA-N 461.288 0.426 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)CCO2)C1 1839203912 ADNXKKXFPYPDPD-QYWGDWMGSA-N 477.986 0.736 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc2N1 1839607979 DDRSZLQYAAQLRZ-DYESRHJHSA-N 451.907 0.241 50 20 JCGD COC(=O)C12CC(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Br)C4)C3)(C1)C2 1840006112 OOHCSZWDRJCDPB-GGKIJQQKSA-N 463.300 0.477 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3c(c1)CCCO3)CCO2 1840660946 IVCWHUIQCPGAJJ-DEOSSOPVSA-N 474.558 0.455 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)c2cn[nH]c2)C1 1843501051 GFAMJXUBVQTNBQ-IBGZPJMESA-N 497.361 0.043 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cc3cccnn3n2)C1)NC(=O)NCc1ccccc1 1844630547 ZXONRVHVOYWBMQ-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1 1847977650 QMBPSVLKYOJSFU-IRXDYDNUSA-N 481.594 0.323 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(C)no1)c(=O)n2Cc1ccccc1 10161471 IFDKSAAGHKMUSJ-UHFFFAOYSA-N 451.443 0.186 50 20 JCGD CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)CNC(=O)c3cccs3)cc(C(C)C)nc21 725740503 FJORSBYWUZGVDY-UHFFFAOYSA-N 458.500 0.893 50 20 JCGD O=C(NCCCN1CCCS1(=O)=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 726277160 XKJBKVSEVCCBRC-UHFFFAOYSA-N 498.565 0.814 50 20 JCGD COCCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 728341854 YFTIKYJFKUKKMX-GOSISDBHSA-N 478.479 0.251 50 20 JCGD CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728948828 GSNHMQCYRFSVCY-CQSZACIVSA-N 461.548 0.693 50 20 JCGD CN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(=O)OC(C)(C)C 729611852 VGGWYXHIZYFUCA-UHFFFAOYSA-N 485.563 0.518 50 20 JCGD O=C(CN1CCN(CC(=O)N2CCCc3ccccc32)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 731356065 RGGZVUWITATCJC-UHFFFAOYSA-N 480.525 0.953 50 20 JCGD N#Cc1ccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3cccc4nsnc34)CC2)cc1 747102160 CBWKBVYVCGSBFD-UHFFFAOYSA-N 471.524 0.924 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C 748245985 BQHZSWHWAPNCNH-HOCLYGCPSA-N 466.560 0.936 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1 762946700 UPVFUZJDJHSPBZ-UHFFFAOYSA-N 476.467 0.997 50 20 JCGD CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cn2cnc3ccccc32)cc1OCC 798149202 VJTKLDWQBVNJHR-UHFFFAOYSA-N 475.527 0.960 50 20 JCGD Cc1ccc2c(c1)C(=O)N([C@H](C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C2=O 892686787 OAISZTLHJUSSRA-SNVBAGLBSA-N 464.887 0.742 50 20 JCGD O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 912643271 NOYNYZIMRJLAAH-SLUIBLPYSA-N 486.550 0.429 50 20 JCGD COCCN1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CC1=O 914457623 GPQXNNNCDHJVCQ-SFHVURJKSA-N 474.539 0.421 50 20 JCGD CC(C)(CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCOCC1 915894691 PPKRIBAFOYLFHZ-UHFFFAOYSA-N 467.592 0.916 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(S(=O)(=O)N(C)C)cc1 918103716 DZIRDRVBEMJSJA-CYBMUJFWSA-N 458.504 0.618 50 20 JCGD O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCS(=O)(=O)C1 919887026 YIWIRNKYIVEWME-ZDUSSCGKSA-N 462.525 0.131 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cccnc1O)N(S(C)(=O)=O)CC2 920596343 NAODXZJQGHJXOH-OAHLLOKOSA-N 464.500 0.515 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2cncn2-c2ccccc2)CC1 1317906180 CQWLOHSXVCCIPE-UHFFFAOYSA-N 471.518 0.896 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(C(F)(F)F)CC2)C1 1778875332 DDAZBMPDKXWPAT-VQIMIIECSA-N 454.254 0.836 50 20 JCGD O=C1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)=NN1 1778942905 NGWUGYXECUEGNJ-FOIQADDNSA-N 463.332 0.698 50 20 JCGD COc1cc(C)ccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779033711 BQISEEBSTKEWPZ-QHCPKHFHSA-N 453.499 0.759 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374672 BNLJNJMRHBJTEH-RZQQEMMASA-N 453.927 0.066 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc(-n2cncn2)c1 1781124626 MFNONIGLGXYVLC-RCZVLFRGSA-N 489.341 0.388 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccc(O)nn3)C2)C1 1782632720 GTPKCUAZDQEZEA-VCOZGABYSA-N 469.502 0.079 50 20 JCGD C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccn1 1782637756 SIKOKVHBHVLDJE-NYQDVAGCSA-N 451.332 0.693 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN3CCN(C(C)=O)CC3)CCO2)C1 1783349775 SSFOXFIXTBGOEE-LPHOPBHVSA-N 459.385 0.154 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)CCO2)C1 1783871177 NPFKSGKZUDVXAV-XFQAVAEZSA-N 475.970 0.706 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc(OC)c1C 1783937392 IRCCWAHHRQBXGY-QHCPKHFHSA-N 462.547 0.829 50 20 JCGD Cc1cn(CC(=O)N2CC[C@@]3(C2)CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)CCO3)c(=O)nc1O 1785353778 MLPVATPCXMLULP-JPNNDLKFSA-N 499.474 0.973 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4[C@H]3O)C[C@@H]21)c1ccc(B(O)O)cc1 1786978695 LPJSILCILOGSNC-PIAWWSJMSA-N 478.354 0.256 50 20 JCGD CCSc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786978715 MXZCZDPTSIQEKE-VDGAXYAQSA-N 469.372 0.781 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C(F)(F)F)cn3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979954 SXYJKEQDVSHFRF-QRTARXTBSA-N 478.236 0.082 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21 1787394805 AYBHULXVXASRMI-CYDGBPFRSA-N 454.351 0.655 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCC(CO)CC3)C[C@@H]21 1787507125 YNDMNGLXUOUWAP-KNASKMEVSA-N 473.574 0.899 50 20 JCGD Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(C(F)(F)F)c1 1787710955 ANDCESFYVQPSKV-QOKNQOGYSA-N 479.264 0.631 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])cc4c3OCC4)[C@H]2C1 1789220829 BUTINZYGCPWWAR-SNRMKQJTSA-N 489.529 0.496 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)NCC(C)C)C[C@@H]21 1789222200 FVROMKCIFSRFLZ-QSFXBCCZSA-N 490.513 0.886 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789945641 PULAJXBVHFGQRL-ALGWMNEGSA-N 467.526 0.746 50 20 JCGD N#Cc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1790226293 XFDACOUEQZWQPF-DCPHZVHLSA-N 466.473 0.603 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C[C@@H]21 1791257096 OODHHCOESDRHIC-PCBIJLKTSA-N 468.963 0.973 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)C1 1791296406 IFXPRDKIYVGTHT-LXFSFDBISA-N 480.389 0.998 50 20 JCGD Cc1cc(Br)c(N)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1795498195 GIVLLOBSYDDLQX-VTEUUUEMSA-N 496.406 0.916 50 20 JCGD N=C(N)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1795537944 GPIKLUSPDCKPJI-IVSAIRAKSA-N 452.353 0.065 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797751818 TUDOORIUUWPTOT-VPTLXERWSA-N 475.509 0.454 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799348591 LLYIWRFAWRJQKW-FBUUZDRASA-N 454.293 0.110 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(O)c(I)c1 1799842825 PBIMFOXICYKXEW-JLUCKKNBSA-N 494.713 0.800 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O)C2 1800974472 VJEGLGGNDRHPRR-MULDDASSSA-N 489.997 0.448 50 20 JCGD CC(C)[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)NC(=O)OC(C)(C)C 1801012250 QBGIIHQQCHOMLH-WYADAEROSA-N 497.637 0.888 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2 1802087055 GZSHERNROAWSIR-YIDVYQOGSA-N 491.969 0.286 50 20 JCGD CC(C)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1802900442 YXICRPZBGGHYPZ-CJNGLKHVSA-N 458.910 0.792 50 20 JCGD Cn1cccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1=O 1803831536 VSULRISBERWLGA-WIYYLYMNSA-N 460.299 0.094 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1806340245 AQBDSXXIBNTHOJ-MLGOLLRUSA-N 475.307 0.312 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363894 RBLJZMOECQIDBL-UTKZUKDTSA-N 479.277 0.491 50 20 JCGD Cn1nc2c(c1C(=O)N1CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC1)CCC2 1809974640 YEDITBMYEWNIFT-UHFFFAOYSA-N 450.348 0.747 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc3c(c2)CNC3=O)[C@H]1c1cccnc1 1810037273 BKORPBVDSJUQIB-VGOFRKELSA-N 499.531 0.957 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnn2c1OCCC2 1812117837 QOUMIEZPHJZZIN-RXVVDRJESA-N 475.314 0.374 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnn2c1CCC2 1812141045 UCZDWPDMWWGQBK-AVRDEDQJSA-N 459.315 0.538 50 20 JCGD CCOC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1812464497 AIUYPCLBPRPVCP-AZUAARDMSA-N 465.315 0.424 50 20 JCGD COc1ncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1F 1815337373 SGWCEDHBRZVPSA-AWEZNQCLSA-N 470.291 0.905 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)CC2)c1ccc(B(O)O)cc1 1815343709 KJTFKJPNNKJIRX-LBPRGKRZSA-N 455.261 0.599 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(-n3cncn3)c1)CC2)c1ccc(B(O)O)cc1 1815348448 OOPLXPYTMNAJEY-QGZVFWFLSA-N 488.338 0.943 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)C1 1815349964 AYOJLICQVTWKCF-IIAWOOMASA-N 471.344 0.638 50 20 JCGD COc1ccnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1OC 1815360370 GZRBXMCBDVMXTD-AWEZNQCLSA-N 482.327 0.775 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)C(F)(F)C(=O)O)n[nH]1 1815565249 HWKGESHSNQXFIL-ZDUSSCGKSA-N 486.187 0.751 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800942 DVMNOZFDLSKMRF-LRDDRELGSA-N 473.559 0.672 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccc(O)cn1)CC2 1819800955 FAXPTUJQCNLMOZ-LBPRGKRZSA-N 467.511 0.711 50 20 JCGD Cn1ncc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1Cl 1821005594 LTBBGRHYRHCTBN-LBPRGKRZSA-N 459.724 0.749 50 20 JCGD NC(=O)c1ccccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1823443839 ZNQDZLLAWBOODB-CQSZACIVSA-N 464.312 0.461 50 20 JCGD Cc1nccn1CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1824706429 SDINKSYIKKZKMH-LBPRGKRZSA-N 454.516 0.573 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](O)Cc3ccccc3)sc2C1 1825435488 YEIREAMZPBTXDN-KSSFIOAISA-N 480.550 0.971 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CNC(N)=O)CCN2C(=O)OCc2ccccc2)C1 1829476894 ZRVSAUZUIDUXSM-JTSKRJEESA-N 495.964 0.361 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(Cl)cncc1Cl)CCO2 1829605927 QRQCXLHBAABEOU-FQEVSTJZSA-N 488.372 0.831 50 20 JCGD Cc1ccc(F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1830075150 VXGANAOSSJPYEM-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733038 CVQVTRKTVDCACL-VGSWGCGISA-N 478.933 0.725 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2 1831701656 OADTVGPAJQVSEV-XVAXZDLZSA-N 482.264 0.169 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832043656 BJLLUEBPJWNWTC-SXGZJXTBSA-N 461.943 0.052 50 20 JCGD Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(C)s1 1833871228 SZHCXRDWOXYDPO-UHFFFAOYSA-N 484.431 0.868 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799164 PPBTYOIOTVRHSN-UHFFFAOYSA-N 488.394 0.076 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc4cn[nH]c4cn3)CC2)CC1 1835738203 YSQGYGXJJYCEGS-UHFFFAOYSA-N 491.556 0.455 50 20 JCGD O=C(CC1Cc2ccccc2C1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933839 HCYUUVWETOVDJL-SANMLTNESA-N 478.354 0.242 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc(C)c1O 1835934219 PWKJOANACGMROH-XMMPIXPASA-N 468.315 0.073 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836678290 QUEQATBDKUXGNO-XMSQKQJNSA-N 452.935 0.610 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1837715800 KEKVBMAMHTWTHC-HXUWFJFHSA-N 452.584 0.423 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1839148121 NESYGEBJQJLXCQ-GCKMJXCFSA-N 452.939 0.674 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc(F)c1F 1840187255 PNPJBJFPRCLECH-JOCHJYFZSA-N 468.501 0.716 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1)C(C)(C)O 1840190195 JLRGPDWYMHIQFW-XCLFUZPHSA-N 498.404 0.911 50 20 JCGD CCOC(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)OCC 1840282706 MRJPNDZMOPFZHP-RDJZCZTQSA-N 455.321 0.923 50 20 JCGD COc1cc(Cl)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840741843 LCZZNGOYTDVYSM-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2 1840859222 OQVTZLUMMJNFFH-XMMPIXPASA-N 497.527 0.626 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1847130891 KHARAENTRFECTI-UHFFFAOYSA-N 461.299 0.142 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1847783881 CGVKTFQSPFMENP-DQYPLSBCSA-N 482.515 0.663 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)n(C)c1=O 15878343 UFRHAFHWWKRQRY-UHFFFAOYSA-N 480.456 0.613 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCNC(=O)c3ccc([N+](=O)[O-])cc3)cc2)CC1 728212751 CDFLDCHUIZCWDX-UHFFFAOYSA-N 490.542 0.794 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2N2CCOCC2)c1 744886960 DCFRQJHZVGLLCW-UHFFFAOYSA-N 461.544 0.918 50 20 JCGD O=C(NNS(=O)(=O)c1c[nH]c(C(=O)O)c1)c1cccc(S(=O)(=O)N2CCCCC2)c1 751260501 MVQVWPSHBQWGSF-UHFFFAOYSA-N 456.502 0.511 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(C2CC2)C1)c1cccc(S(=O)(=O)NCc2ccccc2)c1 829959825 NRTOWSWPZWWLHG-KRWDZBQOSA-N 456.524 0.937 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc3c(c2)oc(=O)n3C)cc1 903910160 PYRZPHKWEZATNN-UHFFFAOYSA-N 468.513 0.070 50 20 JCGD O=C(NNC(=O)[C@H]1CC[C@@H](C(F)(F)F)NC1=O)c1cccc(S(=O)(=O)N2CCCC2)c1 914830369 QRGIGEWCQRNYOH-KBPBESRZSA-N 462.450 0.689 50 20 JCGD CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1Br 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NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCCCn3cccc3)CCO2)C1 1779032293 MVDGRTHFSJPYTH-HSZRJFAPSA-N 454.531 0.801 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc2nccn12 1781315791 WGCBWPMZTZZIGI-HYBUGGRVSA-N 462.315 0.455 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c(OC)c1F 1781950869 FDNLZCAJOVSGQV-QFIPXVFZSA-N 484.500 0.799 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc4occc4c3O)C2)C1 1782395073 ZRLSENWQJDSVEX-HSZRJFAPSA-N 450.256 0.576 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(-c3ccncc3)[nH]n1)CCO2 1783934253 BHADUIUCKOPFEG-QFIPXVFZSA-N 455.519 0.288 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(O)c1OC 1783935028 ORYZQKNZIQUTFQ-QFIPXVFZSA-N 464.519 0.226 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784096667 JMLLALSZCWAQGL-JNNCMOEMSA-N 459.971 0.869 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1 1784488846 KXPWGOHWARYTAV-LVPNSNHYSA-N 468.514 0.813 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1785342495 LRHOWLDUCVRUIO-SBUREZEXSA-N 490.561 0.432 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)N(C)C(=O)OC(C)(C)C 1789758264 DWZXEHBMCCBYFD-LQJIQPLVSA-N 489.378 0.215 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1 1791056026 MBJKQLKJXMZBHC-OLFNHAQQSA-N 463.325 0.244 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1791434864 ZWZMDZIDRUGDKZ-QXKUPLGCSA-N 473.954 0.492 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@H](O)c1ccccc1Cl 1791470855 VXVPQWRHMVDCKO-CEDBRAGKSA-N 472.734 0.347 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C[C@@H](F)C1 1792980829 AEMHQJBHUPOCKW-HAEOWDPNSA-N 477.961 0.771 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccccc1 1795425966 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COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)Cn2cc(C)c(O)nc2=O)[C@@H]1c1cccnc1 1814037032 HJQVYOYUOJYCRP-BQFCYCMXSA-N 463.922 0.612 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CNC(=O)OC(C)(C)C)n[nH]1 1814799736 VLFMUFLWBOIPQZ-JKSUJKDBSA-N 495.581 0.660 50 20 JCGD O=C1COc2ccc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)cc2N1 1815344311 SNLWFRAIYOXFAY-OAHLLOKOSA-N 492.322 0.693 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCCC1=O)CC2 1817280332 ROKPHDTXDCQZBL-UQJRAWQTSA-N 471.543 0.812 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cc(=O)n2[nH]nnc2n1 1817816244 AAMKKMWVQAUFCI-BXKDBHETSA-N 468.247 0.532 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1818070793 IOAXBHDYCPSRBL-AZUAARDMSA-N 462.319 0.360 50 20 JCGD CN1N=C(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CCC1=O 1824924752 XDPSGQKMUXLWNZ-FQEVSTJZSA-N 454.336 0.208 50 20 JCGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CCC([C@@H]2CCCCN2C(=O)CCBr)CC1 1826357754 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CS(=O)(=O)c1ccc(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1 1833309442 VGNJDVKUKLSAKV-FQEVSTJZSA-N 486.034 0.804 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c[nH]c(C(C)(C)C)c1)CCO2 1833382727 NULANNTWOUUWHN-HSZRJFAPSA-N 463.579 0.755 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833597195 VZALEWJCSLYNJN-HXUWFJFHSA-N 473.979 0.820 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncccn3)CCO2)C1 1834290587 BWLRQUBLLWBJJJ-BTYIYWSLSA-N 483.953 0.679 50 20 JCGD O=C(Cc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834504733 QRTOKBTVVKDSRU-UHFFFAOYSA-N 467.350 0.933 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4ncccc4[nH]3)CC2)CC1)c1ccc(B(O)O)cc1 1834799130 OQRHMRHMICQXMG-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD Cn1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c2c1CCC2 1834799964 IWCQKFDXFZQEGE-UHFFFAOYSA-N 479.390 0.088 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800044 NMWMUNGEYZKXCG-UHFFFAOYSA-N 493.369 0.850 50 20 JCGD CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)no1 1834800946 BXJCXJYGOABSPV-UHFFFAOYSA-N 454.336 0.416 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](N)c1ccccn1)CCO2 1835695565 MRSBBEJZARKCLE-OGWOLHLISA-N 455.353 0.569 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C[C@@H]3C3CC3)CC2)CC1 1835734635 NPRCARZXOYTTMR-WOJBJXKFSA-N 454.575 0.916 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836718057 QWUFYGFUDGYPIV-IRXDYDNUSA-N 477.986 0.470 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CC(=O)NC3=O)CC2)CC1 1837077582 HBTGAKPPUFMWEE-OAHLLOKOSA-N 473.368 0.710 50 20 JCGD Cc1ccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)s1 1837461174 PYEANVFKUOGCRG-OIUIXCLQSA-N 485.566 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@]3(F)CCCC=C3F)C2)C1 1837461779 AZZHKEUKGFJRKJ-VXKWHMMOSA-N 479.484 0.501 50 20 JCGD CCn1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1837538419 RGQWDZFUNKGURF-UHFFFAOYSA-N 454.336 0.509 50 20 JCGD C=CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054049 DAOLSIRTDWILHY-QHCPKHFHSA-N 459.547 0.365 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054266 QGUQKSUALPJVJB-AUSIDOKSSA-N 496.008 0.806 50 20 JCGD Cc1cnc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cnn2c1 1839200024 ACJAIEGUOMFPCT-KSSFIOAISA-N 470.299 0.798 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(F)c1 1839259249 JTQOYSDODHEPSN-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD CCOC(=O)C1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)CC1 1839759226 HSVKBOKBKNENEL-KBXCAEBGSA-N 461.353 0.817 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1F)CCO2 1839770675 MGHSGAIXKDLMOV-WJPUGNRLSA-N 465.434 0.948 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)nc4n[nH]cc34)C2)C1 1840151558 FWEOJBNKMQMXTO-IFXJQAMLSA-N 472.329 0.935 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1840153501 PYMZIIUFYKZEJV-BTYIYWSLSA-N 465.890 0.145 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1840379128 YVVJQNIMYGKDSQ-BLLLJJGKSA-N 462.370 0.384 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1845019915 DMCFAFMSCWVBOE-GOSISDBHSA-N 497.518 0.728 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cnn3cccnc13)C2)NC(=O)NCc1ccccc1 1845038946 LDUJETXMAPAQKD-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C 1847945223 HYKZXCSOHJNWLQ-YESZJQIVSA-N 467.567 0.197 50 20 JCGD C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)cc1 27228627 VMBOSXNRWLRNTQ-UHFFFAOYSA-N 492.579 0.703 50 20 JCGD Cc1cc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OCCCC(=O)O 726155603 LYRFVOHRBYBESZ-UHFFFAOYSA-N 460.472 0.838 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1 751209272 NRYFAOHORZUNNN-HNNXBMFYSA-N 495.539 0.777 50 20 JCGD C[C@H](NC(=O)c1cccs1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 812553079 LHAYYNTYQCZDBL-ZDUSSCGKSA-N 466.541 0.349 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NN=Cc1c(Cl)nc(N)nc1N1CCOCC1 874080062 HFXDHAVRUURZLI-UHFFFAOYSA-N 466.955 0.914 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 913455014 ACINVCUNQDLUJY-UHFFFAOYSA-N 460.468 0.224 50 20 JCGD Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CNS(=O)(=O)c3cnn(C)c3)cc2)n1 915056395 CWAYVGQMDLURNL-UHFFFAOYSA-N 489.583 0.859 50 20 JCGD O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 915921661 CCFDMRODGXPSNS-UHFFFAOYSA-N 493.498 0.525 50 20 JCGD Cc1ncc2c(n1)CC[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cn1)C2 916316713 JJAQEXDMJKUYNF-MRXNPFEDSA-N 460.564 0.300 50 20 JCGD CN(C)C(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 916483641 KNJHVRZCFRIWFY-UHFFFAOYSA-N 489.554 0.554 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC[C@H]1C[C@@H]1C)N(S(C)(=O)=O)CC2 916640829 TTYHCAJCGPMCIY-BJJXKVORSA-N 454.549 0.939 50 20 JCGD Cc1ccc(C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c(O)c1 918337348 IUUDAXBUZVOHGU-INIZCTEOSA-N 469.541 0.243 50 20 JCGD O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cc(F)ccc1F)N[C@@H]1CCS(=O)(=O)C1 920746247 VDGIGTXNVAZBEO-GFCCVEGCSA-N 488.494 0.897 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)cc1OC 921019270 ISTPFDFUTJYKHQ-UHFFFAOYSA-N 454.530 0.844 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1778382902 VNQBAEJRBNKNEQ-ORAYPTAESA-N 468.352 0.634 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)C2)C1 1778857118 GSNZDZOVBOTNMH-UIGNSBFESA-N 456.547 0.291 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779310103 HYCBYLLVXFKSHY-CKJXQJPGSA-N 490.985 0.100 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnn3c2)C1 1781328840 FEQBHRWSFGSLBS-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1781362748 SHAFVRMPECMCRF-GXZWQRSESA-N 472.970 0.569 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1782668131 PPQXKIWXPVYYFA-LKVNYZJUSA-N 495.540 0.164 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)[S@@](=O)c1ccccc1 1782682514 UJHNLMIPEGWACR-BFLKYVHRSA-N 485.566 0.325 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(N)=O)C1 1783286962 VYFIYPXDKMMVER-DYESRHJHSA-N 477.474 0.316 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)CCO2 1783875316 LPMQNSQWGJEINF-STXHMFSFSA-N 463.959 0.610 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1 1785229135 QORNZUJUJAITQJ-AUUYWEPGSA-N 462.927 0.927 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc(O)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786986662 WLSPVMZLLNMOHU-NYVOZVTQSA-N 452.316 0.298 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1n[nH]c2c1CS(=O)(=O)C2 1787151961 AQFXQYQKFASOHN-AUTRQRHGSA-N 451.332 0.235 50 20 JCGD COC(=O)[C@H]1CCC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)C1 1788609716 CNYMKICDSSTPSO-MWTROVGWSA-N 487.557 0.258 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)[C@@H](Cl)COC)C[C@@H]31)C2 1790687148 DEDSZMJHNGOVKI-QSUVVDIXSA-N 496.992 0.856 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1 1790960376 DGQODTUYUJGMAJ-DKBOKBLXSA-N 450.330 0.204 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791445611 KFRWCGPUMPXQRQ-NWZJSZKRSA-N 450.344 0.839 50 20 JCGD COc1cc(F)ccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791886584 VIHLQQXTSKIRNS-GMVOTWDCSA-N 471.489 0.740 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1793088797 RCKYPHSEPMSOSU-FSDCSDTHSA-N 481.949 0.668 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734135 FJDCCSIFHNAJKE-HATOLVCRSA-N 456.424 0.621 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@H]1CNc3ccccc3C1)C2)c1ccc(B(O)O)cc1 1795734839 XYPRJFRWORAGAI-CCIIEHSASA-N 477.370 0.634 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)ccc2c1OCCO2 1796248316 YGCHPHLSPXERFN-YVWYUNDQSA-N 481.509 0.282 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2)[C@H](F)Cl 1796360944 GFRSZUGDWWGKIM-FTUNRGFVSA-N 451.882 0.726 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn3nc(N4CCOCC4)ccc13)C2)[C@@H](F)Cl 1796363343 OWNLFVXEDCQYEP-ZDFLXESQSA-N 466.901 0.304 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2 1796395114 VGKFYCDEAMPCBK-DGADGQDISA-N 463.959 0.370 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)cc2C1 1797319041 OKWPZRIBSYOTTJ-LTCOOKNTSA-N 497.980 0.437 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1NC(=O)C2=O 1797539842 BWAUZRBTVXFKGG-NJBDSQKTSA-N 450.289 0.808 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1csc(C(F)(F)F)n1 1798258001 WYUUMSXPFWRNIT-JJLQDPRZSA-N 469.250 0.359 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCS1)C2)NC(=O)NCc1ccccc1 1799098216 BXRNJUDGSFQAFM-RCLSDMTESA-N 475.615 0.818 50 20 JCGD Nc1n[nH]c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)Cc2ccccc2)n1 1800434853 FWCHHIAKNXMGOV-YYAJDYIMSA-N 491.390 0.915 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2 1800836688 VFAVEGQFKLHQHS-XLMAVXFVSA-N 465.385 0.677 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(Cn3ccnc3)cc1)C2 1801010520 AOMIJVUHLFDRGQ-KFKAJRDESA-N 494.596 0.907 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801017350 PHBNJCYZMUHMJY-OPDFLTKYSA-N 454.351 0.655 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cn2cccc([N+](=O)[O-])c2=O)[C@@H]1c1cccnc1)[C@@H](O)CCl 1803148557 TUGBWFKJJYISBY-QILLFSRXSA-N 463.878 0.457 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1804580486 JRFXSPKFZGSZPB-AUSIDOKSSA-N 455.563 0.974 50 20 JCGD COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1F 1804959688 ITHHBWCNUXEPKW-LAUBAEHRSA-N 478.289 0.938 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807376453 ZSDXIAYAKLUWMM-KPDCDPCYSA-N 474.326 0.944 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1n[nH]c2c1CS(=O)(=O)C2 1807737711 MRJWCHLMDAURSO-NUTKFTJISA-N 467.935 0.152 50 20 JCGD COC(=O)NCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808416252 IYFKAZPSKYOEFJ-RUVVGEKZSA-N 469.502 0.577 50 20 JCGD COC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810299422 PNBXOEAGNPDURW-QRWLVFNGSA-N 454.487 0.353 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1 1810305035 IQBLGQNCHPNAOD-HRAATJIYSA-N 485.508 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1 1813073141 HSSJXDIDSBCZQE-UZUQRXQVSA-N 454.531 0.804 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2 1817277595 YUOZBOJCTLOXQK-ZVYABZQBSA-N 499.513 0.994 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)no1 1817476156 HTPDQGBHWJRLJO-SFHVURJKSA-N 480.290 0.122 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4nncn4c3)sc2C1 1819177706 BOJBEIWXGFZWDV-LBPRGKRZSA-N 477.510 0.724 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819801210 GXISQSBCSDBVQR-LLVKDONJSA-N 474.543 0.957 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)nc4cccnn34)sc2C1 1821268677 WNRAEOAPEVZTDL-GFCCVEGCSA-N 484.542 0.145 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1826722920 KPZXJPQUDDGCIP-QFIPXVFZSA-N 485.633 0.556 50 20 JCGD O=C(c1cnn2ncccc12)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053200 XNUDMLWKAAVZQF-NRFANRHFSA-N 461.331 0.956 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1830538371 DQNANPPHVMYXBT-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD CCOc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)nn1 1830543661 XRCAJDSWHWUQTE-AUUYWEPGSA-N 471.352 0.976 50 20 JCGD COC(=O)C1(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1831458946 NWRSWUSSKSJIHL-GOSISDBHSA-N 457.531 0.872 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)CC2)CC1)[C@H](O)CCl 1833308641 ZHJLABVWWVGAIC-SCLBCKFNSA-N 481.981 0.164 50 20 JCGD CN1N=C(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CCC1=O 1833689320 CTIQTUGDTRKTJP-MRXNPFEDSA-N 460.348 0.857 50 20 JCGD Cc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1833864153 MHJHNWZLIDNDNR-UHFFFAOYSA-N 464.375 0.498 50 20 JCGD O=C(CNc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834680610 CHHOOEICNBKUAY-UHFFFAOYSA-N 482.365 0.803 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccn4c(O)nnc34)CC2)CC1 1835044155 XFUZOMKVPFPMPF-QGZVFWFLSA-N 464.954 0.874 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C(F)(F)F)o1 1835928124 FFJFOKHXEUFEMZ-HXUWFJFHSA-N 497.235 0.065 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccccc34)C2)C1 1835928601 SEHOBZCZZPQSQL-AREMUKBSSA-N 474.322 0.903 50 20 JCGD Cc1cc(Cl)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835934446 SQVRJZMDQPZCOC-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3cnccc13)CCO2 1837033794 SGFCUEMFUIIPPF-VWLOTQADSA-N 490.520 0.617 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4=O)CCO2)C1 1837139736 GWKWODIIMFVJOQ-BTYIYWSLSA-N 465.890 0.145 50 20 JCGD Cc1nocc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837516239 NSZVJNXJOZZBTQ-UHFFFAOYSA-N 456.503 0.908 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccc(OC)c3OC)CCO2)C1 1838841884 UTJQGRYCNPMSSL-VBKZILBWSA-N 457.911 0.423 50 20 JCGD CN(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1838963075 HRRGNTQALCNRLP-DEOSSOPVSA-N 482.541 0.135 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cnnn3)C2)C1 1839743278 HNCXLGAGWWRRCT-GSWGVQEBSA-N 473.440 0.015 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839789528 HKHIHIWZIJISSH-OXQOHEQNSA-N 461.342 0.947 50 20 JCGD Cc1nn2cc(CC(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)nc2s1 1840187147 YHYKMCHULRTDGF-KRWDZBQOSA-N 462.359 0.902 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2 1840956847 UPWQDOXAYTUXIV-QRWLVFNGSA-N 475.970 0.754 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841354371 VTEDXRTYGSMJFW-KGLIPLIRSA-N 481.999 0.118 50 20 JCGD C[C@@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1ccnc1 1841466958 FSCMSUNSIHJMSK-SFHVURJKSA-N 453.547 0.994 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2 1844264447 UAQJUGOVVCJQIH-OAQYLSRUSA-N 478.553 0.403 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C)C1 1846331386 SQDLCNLVQBGHIA-CABCVRRESA-N 496.026 0.772 50 20 JCGD O=C(COC(=O)CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccccc1 9444095 WZQBFLJRNWGAOW-UHFFFAOYSA-N 477.495 0.521 50 20 JCGD O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1 9931442 OOJXORVPSHVOAC-AWEZNQCLSA-N 469.516 0.751 50 20 JCGD CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 14890502 LKELLOXVIMVTHW-UHFFFAOYSA-N 469.545 0.545 50 20 JCGD NC(=O)c1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)s1 116447751 JZWYUOAUJHKJBR-UHFFFAOYSA-N 466.541 0.262 50 20 JCGD CNS(=O)(=O)c1ccccc1N1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1 727832720 YUIPPSOYLPFXMQ-UHFFFAOYSA-N 476.515 0.086 50 20 JCGD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 728213943 HRJXXTPVVBUNPA-HNNXBMFYSA-N 485.570 0.761 50 20 JCGD CN(CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)S(C)(=O)=O 916580370 SBBICBAVCAJBSW-UHFFFAOYSA-N 475.593 0.087 50 20 JCGD O=C(Cn1cc(Br)cn1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916726294 HVPZQXZUQUHVAU-UHFFFAOYSA-N 456.322 0.891 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C(=O)O)c(C)cc2C)cc1 917720204 DYLMNOBUZYOMTF-UHFFFAOYSA-N 469.541 0.940 50 20 JCGD O=C(NNC(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1)N[C@@H]1CCS(=O)(=O)C1 919889462 MMKNZHQTUPGODP-VQCBNXJZSA-N 457.472 0.449 50 20 JCGD CC[C@H](C)C(=O)NNS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H](C)CC)c(OC)cc1F 921295631 RJEYZQGOSWABHK-QWRGUYRKSA-N 482.556 0.546 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cc21 1778383103 FNOHNHGVSBLMOD-GUYCJALGSA-N 458.288 0.151 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncncc4c3)C2)C1 1778602465 UVPYWXYCKOYYSC-HSZRJFAPSA-N 461.482 0.386 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(C(F)(F)F)c[nH]3)CCO2)C1 1779030672 SZVGFTPKSHURLZ-IBGZPJMESA-N 466.420 0.789 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779036059 WGZBMEDURZJNME-JOCHJYFZSA-N 476.534 0.043 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)C1 1779300784 ZANCFLYGOPAQLI-JLHGSKIFSA-N 485.654 0.896 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C3CC3)on1)C2 1779371523 XKLAXHNSBOTUDW-AUSIDOKSSA-N 468.514 0.992 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)n1cncn1)CCO2 1780099075 RGNUJLLIJTUEND-QKKBWIMNSA-N 472.458 0.816 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)ccn1 1780319267 CCKPDGOSJPQTPB-UJBXUPAJSA-N 496.524 0.836 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780774559 DGVGUYZLMJQZHW-JTOWHCCKSA-N 481.315 0.686 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781234566 VQNPOCKXGJQQEN-ATZDWAIDSA-N 460.362 0.523 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)c(O)c1OC 1781825526 KQFHVZQIISUDJF-ZDXRRBIGSA-N 499.524 0.987 50 20 JCGD COc1ccccc1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781886954 APJUCVDSELPUEO-RCZVLFRGSA-N 466.343 0.745 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1 1781998141 UPLYNCQGWDDJAT-ALYFQZSWSA-N 450.330 0.348 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)nc3cccnn13)C2 1782173912 SYOPRDPFYSWUMP-IUSZMWJPSA-N 463.922 0.471 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1783228459 ICDNDGRQMHEQNS-OPAMFIHVSA-N 454.568 0.463 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(-n3cccn3)nc1)CCO2 1783935976 ZELQKCPMFUYGKX-QFIPXVFZSA-N 455.519 0.084 50 20 JCGD C[C@@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)n1cncn1 1784472860 ZGZGDVWREUTWFA-AUSJPIAWSA-N 470.958 0.801 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccccc3OC(F)F)C2)C1 1785143873 FHPSDQZJNDPHLL-JOCHJYFZSA-N 460.242 0.725 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)Nc1ccc(C2(NC(=O)CCC(=O)NN(C)C)CCC2)cc1 1786340020 RAORBPXXSDKFRQ-HNNXBMFYSA-N 467.592 0.821 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787507619 KDORQNHQKVRULN-AKGDVTCISA-N 460.535 0.901 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)ccc1O 1788609870 ABNQJZHFZAVWFS-VHFSOBRXSA-N 469.498 0.306 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(Br)CC3)C[C@@H]21 1788610160 NCFCQECOQVROMF-CQDKDKBSSA-N 466.336 0.206 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccccc1C(=O)OCCO 1789249984 MBRPVCBEEPNCHT-MGHWNKPDSA-N 454.907 0.029 50 20 JCGD CN1CCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878327 SDYYKNCGNSEPIL-QEOTZNIISA-N 458.987 0.802 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCNC1=N 1795582311 WDXPMGJLNCLZTI-AHHPBITISA-N 458.469 0.301 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c[nH]nc12 1796176089 VAHVSHHVJWUREO-GRTWCBPGSA-N 463.498 0.900 50 20 JCGD COCCn1nccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796892435 BBMZJPUFBVZCEM-OSSGZSMMSA-N 455.519 0.915 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c(F)cccc13)C2 1797751910 YQIJIFONYMYHCI-DPIQGUFMSA-N 467.461 0.218 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]12C[C@@H](CO1)N(C(=O)OC(C)(C)C)C2 1799156474 SVKHRHGWZHBJOC-UNPPPGBBSA-N 487.981 0.608 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799865532 AIXJLBSNXQLAGL-PLACYPQZSA-N 472.590 0.886 50 20 JCGD NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800437305 UVDYJJSLWCTIAV-RCJHGTSTSA-N 452.349 0.848 50 20 JCGD COc1c(Cl)cccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1801808351 PRVWVEJTMLISBF-HBCWATKFSA-N 452.939 0.925 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1803147033 SIFMNBOBBSBLAN-GGPKGHCWSA-N 457.955 0.757 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1 1804884599 LBQASZZRLHZZHT-JCGIZDLHSA-N 466.947 0.799 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n(C)n1 1804928660 LBLAAOGEZKDEIM-HRAATJIYSA-N 457.535 0.516 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)[C@@H](N)CCC(N)=O)[C@@H]1c1cccnc1 1807041802 FQCDTMBTMYLZKM-DYWXZXKOSA-N 454.369 0.711 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C2=NN(C)C(=O)CC2)[C@H]1c1cccnc1 1808408036 GLHKFSOLRFWILJ-HBSVRTSBSA-N 492.540 0.830 50 20 JCGD Cc1noc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810303012 OFZDCXOPJSYKOR-YWZLYKJASA-N 464.486 0.334 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1 1810306340 XGFVSLSBPXIPOM-IERDGZPVSA-N 474.525 0.856 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1812777165 QTOHPNCIOYBASY-XEZPLFJOSA-N 489.334 0.701 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=C/C(=O)NCc2ccco2)[C@@H]1c1cccnc1 1813072548 FISDBLZILRXNNX-IPMDKULASA-N 496.568 0.926 50 20 JCGD NC[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccccc1 1815160521 YAZUMEVMBDQUIB-QZTJIDSGSA-N 464.356 0.791 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)C1 1815335644 ITLKWSQCYNANRZ-SQWLQELKSA-N 471.344 0.638 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3nn[nH]c3c2)[nH]n1)c1cccc(B(O)O)c1 1817476870 FHCJNGRLNYHKGS-LJQANCHMSA-N 459.275 0.981 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2n[nH]c3c2CS(=O)(=O)C3)n[nH]1 1817684625 OVPOPWQQGSNNFT-OAHLLOKOSA-N 492.562 0.240 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(CCO)CCO)n[nH]1 1822023497 RDEJYPFNQNWOGO-ZFWWWQNUSA-N 460.373 0.719 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)OC(C)(C)C)sc2C1 1825509259 BUOZRMWREAOIAG-LBPRGKRZSA-N 468.580 0.953 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825966087 PLPNEGWROUYNTL-IXDOHACOSA-N 483.355 0.804 50 20 JCGD Cc1cc2nnc(C(=O)N[C@H]3CCc4nc(NC(=O)CCC(=O)NN(C)C)sc4C3)c(C)n2n1 1826086024 KVYTWIUIQBSHTQ-ZDUSSCGKSA-N 485.574 0.796 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)n1 1826087448 CIGANKNUDDRALW-CQSZACIVSA-N 489.602 0.729 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(C)=O)CCN2C(=O)OCc2ccccc2)C1 1829303157 IBTHOAFIFLYOTI-AUSIDOKSSA-N 494.976 0.828 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)CC2=O)c1 1829635813 ABFGIQDAJORIQN-ZDWFVDTJSA-N 495.960 0.104 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CC(O)C1)CCO2 1830585501 INCOPMZMNJQKJC-SGHZUCRHSA-N 477.470 0.361 50 20 JCGD Cc1nn2cc(CC(=O)N3CCO[C@]4(COCCN(C(=O)CCBr)C4)C3)nc2s1 1832106213 UUZBSPJGQRCPEY-SFHVURJKSA-N 486.392 0.883 50 20 JCGD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832426896 CXOHZXGUJVHBHN-LPHOPBHVSA-N 459.858 0.333 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc[n+]([O-])c3)C2)C1 1832549492 RZKARGIMPQQYDF-HTAPYJJXSA-N 498.964 0.522 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832723708 BBNLKOFQHMCPRA-NRFANRHFSA-N 452.939 0.533 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ncccc3C)CCO2)C1 1832776974 BEASBUAINBOTGG-GQUZIAHASA-N 496.568 0.913 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cncc(F)c1 1834253851 HOFMBGMGYUJVNP-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc[nH]c4nccc3-4)CC2)CC1)c1ccc(B(O)O)cc1 1834797929 NBLADLHBOYONFX-UHFFFAOYSA-N 475.358 0.693 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cncnc3)CC2)CC1 1835118317 NYBVHADYICKSNM-LQKURTRISA-N 466.546 0.796 50 20 JCGD CN(C)C(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1835436282 SRTSPGXUMRWUMA-KYIYGJGQSA-N 462.453 0.416 50 20 JCGD CC(C)(C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835734930 YUIQADUFGCVTCT-LJQANCHMSA-N 460.579 0.277 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)N3CCOCC3)CC2)CC1 1835759168 IGNGKIWYMUJQTP-YWZLYKJASA-N 475.428 0.240 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1 1837200421 FSCPVILVNADNBI-XIKOKIGWSA-N 452.309 0.811 50 20 JCGD CC[S@](=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1837233975 BFZNJCHRDLVGRO-CHLCXMBXSA-N 453.399 0.633 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1837715276 GTONQAUXYWZXFW-OAQYLSRUSA-N 475.578 0.011 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3ncon3)CC2)CC1 1838102941 HGVNZWKVLXXGAS-ZVHZXABRSA-N 457.491 0.816 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1 1838513465 TWVDARMALYGCGK-FZKQIMNGSA-N 455.924 0.410 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1 1838767954 YIMFQBMBBMEHAQ-MEBBXXQBSA-N 455.821 0.147 50 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CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1 1836378651 SRCNNJUSCUMUGD-OAQYLSRUSA-N 488.006 0.961 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC(OC2CCN(C(=O)C(O)O)CC2)CC1 1836628870 JYFGCDBTHSFLNA-HNNXBMFYSA-N 463.959 0.428 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)CCO2 1836638264 FUNFVERMHGZZIB-YVHKJVDXSA-N 489.997 0.954 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2 1836716091 MGLDUBCSMJVLME-YMSFFTPVSA-N 485.463 0.919 50 20 JCGD O=C(c1cnn2cccnc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836848508 QMIFDGMCCAPQJX-SUMWQHHRSA-N 456.272 0.490 50 20 JCGD C#CCO[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836859379 XQYDNTWJKYZJTQ-MRXNPFEDSA-N 457.531 0.336 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1 1836873946 GWSXJOCLUITIPF-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccn3ccnc13)CCO2 1836998467 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Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@H](C)O)cc1 772932105 KUHZBTFXHUSEPD-UGSOOPFHSA-N 483.930 0.681 50 20 JCGD O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)c1ccc(-n2cnnn2)cc1 807000708 WZSUNWWADJWKRZ-IBGZPJMESA-N 454.466 0.819 50 20 JCGD O=C(COC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3)NNC(=O)c1cccc([N+](=O)[O-])c1 849184568 RWAWYKOCJSLAOB-UHFFFAOYSA-N 451.395 0.869 50 20 JCGD COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1 913419218 GGQAYQQDZGTWRZ-UHFFFAOYSA-N 476.540 0.838 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3c[nH]c4ccccc34)cc2)CCN1 914460042 KMAYRVUYTAOMSK-UHFFFAOYSA-N 455.496 0.292 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(CC(F)(F)F)C2)c1 914748450 FGQVILBBLZLLTA-ZDUSSCGKSA-N 464.466 0.889 50 20 JCGD CCN(CC)C(=O)N1CCC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1 915056491 KAJULYXWGOOIMX-UHFFFAOYSA-N 453.565 0.872 50 20 JCGD CCOC(=O)CCc1c(C)c(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)c2ccccn12 915958408 CPMZXYNADMLCHK-UHFFFAOYSA-N 486.554 0.778 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3CCN(C(C)=O)CC3)C2)C1 1778359731 XDRILMXRNNDHHG-VQIMIIECSA-N 459.385 0.154 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031903 HCDPCQPFKGFLHE-XMMPIXPASA-N 480.525 0.158 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCc3cccc(O)c3)CCO2)C1 1779034051 KNAVKSAACVQVDH-HSZRJFAPSA-N 453.499 0.467 50 20 JCGD Cc1cccc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)n[nH]c12 1781389367 ZBTGNRMWOKDGBS-CJFMBICVSA-N 476.342 0.992 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(OCCCO)cc1)C2 1782212110 IFEQNLNNYOKZMV-PXDATVDWSA-N 490.601 0.948 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1783890880 GPNZZMDJYICIGA-RNVRALISSA-N 479.961 0.347 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](N)c1cccc(Cl)c1)CCO2 1783934061 VVGGEIILIMUYLY-CTNGQTDRSA-N 451.955 0.543 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1=CCN(C(=O)OC(C)(C)C)CC1)CCO2 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KJLIKHLEFBVPIN-INIZCTEOSA-N 452.479 0.396 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COCCO)CC2)NC(=O)NCc1ccccc1 1822518526 PXDBNBGJKFUEMD-INIZCTEOSA-N 490.586 0.410 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(=O)N(C)C)CC2)NC(=O)NCc1ccccc1 1822518916 XOXKOTFPGYHVFA-HNNXBMFYSA-N 487.586 0.490 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1cc(O)cc([N+](=O)[O-])c1 1823643495 HVQWLAXBMBWDRX-CQSZACIVSA-N 482.283 0.976 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc2ccccc2)C1 1828551645 SNBGMTJWXLVNLN-ICPLQIHGSA-N 494.976 0.563 50 20 JCGD CC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1830513343 CIPOOUWIAZZUEF-AVYPCKFXSA-N 463.959 0.346 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1830535661 RVMSBOHJXMUDKW-BFUOFWGJSA-N 469.336 0.282 50 20 JCGD O=C(CCCN1C(=O)c2ccccc2C1=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832540814 IXWNFLRXLGXFRD-WZONZLPQSA-N 493.944 0.119 50 20 JCGD Cn1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)c1 1832549082 DKDMUPVGGFGJOF-YCRPNKLZSA-N 485.969 0.622 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H](O)C3)C2)C1 1832549209 HHYKVFMSFBLBFG-YJXLLHPSSA-N 475.970 0.346 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Cn1cccn1)CCO2 1833197325 YMAWCMNBMJBFDH-KHPKBUAZSA-N 485.545 0.110 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cnc1C 1833298969 WOTXSVBCARTJJD-QHCPKHFHSA-N 468.514 0.081 50 20 JCGD CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1 1834011326 WGOBJDJPPAETLH-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CCN3CCCCC3)CC2)CC1 1834530066 FVXWZHDADRUNQO-UHFFFAOYSA-N 485.633 0.746 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccc(C)n3)CC2)CC1 1835118264 LVCCNBAIXXQDLF-OVVQPSECSA-N 482.589 0.897 50 20 JCGD CC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835935722 NWINGYJZSBEDLE-WIOPSUGQSA-N 466.343 0.630 50 20 JCGD Cc1nc(C)c(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)o1 1835941646 REQUFHLJODZHPJ-UHFFFAOYSA-N 469.546 0.789 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3ccccc3=O)CCO2)C1 1835999373 JIADVTRNZPPXLW-HNAYVOBHSA-N 456.337 0.478 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1837116876 AHIHKBCEYJACJN-BXUZGUMPSA-N 459.341 0.367 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccc1 1837463034 YOIKKPRSEPDTAT-MZNJEOGPSA-N 467.526 0.559 50 20 JCGD O=C(C/N=C/c1ccco1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921162 HMGLTLKDANTWOG-WGOQTCKBSA-N 467.331 0.691 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)C3CC3)C2)C1 1838526744 BGIOUGRUSAQLJN-JOCHJYFZSA-N 475.454 0.569 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1NC(C)=O 1838606960 FUBMOGCJTUKQBC-UWJYYQICSA-N 469.922 0.323 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1839142247 KWDMXKZTUPAHIE-VWVPQACVSA-N 468.938 0.467 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839184121 UWKUDQJLPVVSTE-WCAVRKLYSA-N 497.976 0.605 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1c(O)cc(O)cc1O)CCO2 1839371165 FRAUHTNXLJUINQ-SFHVURJKSA-N 459.293 0.658 50 20 JCGD Cc1ccn2c(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cnc2c1 1839601774 UCXXDBDQRPMAPZ-XMMPIXPASA-N 493.524 0.025 50 20 JCGD CCCCC[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839903992 OTSCRMRGBCOBIJ-SBUREZEXSA-N 461.563 0.972 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncoc4c3)C2)C1 1840184514 RQIXYCXMSTXTKV-QFIPXVFZSA-N 459.503 0.271 50 20 JCGD COc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1F 1840186780 FKTPMMJXDSUSRY-JOCHJYFZSA-N 466.510 0.277 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CCOC3)CCO2)C1 1840533676 KBGWXVGKDZTFIL-VWKPWSFCSA-N 475.970 0.611 50 20 JCGD O=C(c1ccc(N2C(=O)C=CC2=O)cc1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1840771920 XFINPAGZBKGDRV-OAQYLSRUSA-N 482.320 0.990 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)C1(F)CC1)C2 1843428818 RWYMBHQUJYDIAS-SFHVURJKSA-N 489.353 0.508 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C2)C1 1843904194 YPIAGGMERDTNOA-MRXNPFEDSA-N 451.568 0.820 50 20 JCGD COc1cc(CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)ccc1[N+](=O)[O-] 1845147897 RHDVXADLESIZTQ-UHFFFAOYSA-N 453.260 0.343 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2CN(C(=O)OCc3ccccc3)C2)C1 1845948401 VHZBYYJKZHQFTI-UHFFFAOYSA-N 492.536 0.771 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CC(=O)OC)NC(=O)OC(C)(C)C)C1 1846213626 QJKPLBKARQNQAH-KGLIPLIRSA-N 461.943 0.900 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CN2C(=O)C=CC2=O)C1 1846459476 DFAUDZVNJCGACU-ZDUSSCGKSA-N 454.911 0.247 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(N3C(=O)C=CC3=O)cc2)C1 1846890671 DQRITEUIUWTGBE-UHFFFAOYSA-N 474.477 0.245 50 20 JCGD CC(C)[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1)N1Cc2ccccc2C1=O 1847790940 MVXITRRCJOATHK-VABKMULXSA-N 475.354 0.862 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 15628314 VHCHXVPKXOYLRK-UHFFFAOYSA-N 464.456 0.699 50 20 JCGD COc1ccc(CC(=O)NNC(=O)COc2cccc(C)c2)cc1S(=O)(=O)N1CCOCC1 16005503 MTDCCVGCADRIPD-UHFFFAOYSA-N 477.539 0.793 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccccc2OCC(=O)N(C)C)cc1 28662789 HIFRJYDZDQITHP-UHFFFAOYSA-N 462.528 0.544 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)c1 46900631 XVRGNSPOQLJZAG-UHFFFAOYSA-N 499.549 0.750 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@H](O)CN1C(=O)c1ccc2c(c1)CCC2)NNC(=O)c1ccccc1 726000768 NIPOHFAMQIOMRW-PMACEKPBSA-N 451.479 0.755 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)c1ccc2c(c1)OCCO2 726765316 ZBOKWTIXMPLHEN-UHFFFAOYSA-N 453.498 0.621 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCNC(=O)c3n[nH]c4ccccc34)cc2)CC1 728214185 KHMUMMVXMRFTSA-UHFFFAOYSA-N 485.570 0.762 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)NNC(=O)[C@@H]1COc2ccccc2O1 728323901 MNHFMMNZNZYOSQ-INIZCTEOSA-N 479.467 0.208 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1 744446682 IZKUHNRGHFVMMS-UHFFFAOYSA-N 481.394 0.583 50 20 JCGD C[C@H]1Oc2ccccc2N(CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1=O 761465530 XPFHJDQNWASSGJ-LLVKDONJSA-N 466.903 0.953 50 20 JCGD COc1nc(N)nc(N2CCCC2)c1C=NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 863966774 OAPXROQBYZXTFY-UHFFFAOYSA-N 453.912 0.732 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)ccc1Cl 914750100 VVYSVMBIWNTXFI-UHFFFAOYSA-N 476.920 0.440 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(S(=O)(=O)N2CCCC2)cc1 916126679 ANEIWWROWFNASQ-UHFFFAOYSA-N 458.544 0.939 50 20 JCGD O=C(COc1ccccc1F)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916517253 ZHRDDEMQRGDUSL-UHFFFAOYSA-N 480.522 0.082 50 20 JCGD O=C(NNC(=O)c1cccc(NS(=O)(=O)c2ccc(F)c(F)c2)c1)N[C@@H]1CCS(=O)(=O)C1 919883266 BSMQZIZXKJYDIF-CYBMUJFWSA-N 488.494 0.897 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1780907050 SIQYGXFCTKUFFG-QMHKHESXSA-N 477.537 0.147 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1)[C@@H]1SC(=N)NC1=O 1781331753 VNCXBZZXHKCTRK-WSHGPQCASA-N 451.318 0.309 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782158482 CIFYJCSVBOKVJO-QTDDQOEGSA-N 484.358 0.249 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3ncccc3n1)C2 1782214143 FPLUMKQZDRYWBN-VGOFRKELSA-N 457.535 0.230 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782763532 WOWKKLMYOBOXJP-YZUZCNPQSA-N 457.380 0.367 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@H](F)CN1C(=O)OC(C)(C)C)CCO2 1783934494 HGPYGIKMVBMQBK-SAHWJRBASA-N 499.584 0.537 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784206714 QOFFZWJWFAMOJT-NYVOZVTQSA-N 453.348 0.537 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1 1784374012 MHVVSSTWLQLHEN-WBHUJUFNSA-N 456.341 0.070 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CNC(=O)O3)[C@H]2C1 1784577134 WXJCNFBAFIJRRW-FRJURHEUSA-N 476.442 0.222 50 20 JCGD O=C(Cc1cccc(Cl)n1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785426629 ABTWYXQURCVAFR-SNRMKQJTSA-N 457.723 0.251 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)[S@](=O)c1ccccc1 1786983738 RKGBIBOGCQWZGP-ABTNWWTDSA-N 484.383 0.156 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn4c(O)nnc34)[C@H]2C1 1787387844 QNORRMRSYAVUNV-XWUBHJNHSA-N 452.309 0.812 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(O)nc2ccccc12 1787902493 WIWGNFQTDKLDHT-BUKVSMQUSA-N 475.310 0.527 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCO4)[C@H]2C1 1788350981 LPGBGXKMSMUDSZ-GDJYOZILSA-N 483.529 0.393 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)nc3)C[C@@H]21 1788611463 CQJZRQFLPNSTOP-SNRMKQJTSA-N 470.505 0.445 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)[C@H]2C1 1790322806 UEMJMRYIGCZZKK-YEWWUXTCSA-N 487.517 0.437 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)cc3)C[C@@H]21 1791293912 NYPLMPIYKCHGMM-JBACZVJFSA-N 468.558 0.839 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)C1 1793082962 LUUMLBOHNYJOPM-AIEDFZFUSA-N 494.358 0.902 50 20 JCGD Cn1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1 1793880635 CLQUTFRMGNICGM-KPEUIFRASA-N 469.970 0.684 50 20 JCGD O=C(/C=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)NCc1ccccc1 1796187891 JMZDHOHVWGFCGZ-BMIFERRUSA-N 461.327 0.491 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)C2 1799270271 MTBMHFJWMGDMKF-IAFLNBNSSA-N 459.971 0.964 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSc1nc[nH]n1)C2)NC(=O)NCc1ccccc1 1799869149 IOQMJPUMKBPLKN-BCDXTJNWSA-N 486.602 0.881 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(N3CCN(C)CC3)CC1)C2 1800642672 WCYABWBDWIVZPZ-YVSFHVDLSA-N 457.413 0.530 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(Cl)c1 1801793938 HMDYYRJVHUDPER-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)nc3cccnn23)[C@@H]1c1cccnc1)[C@H](O)CCl 1803141341 MZFATPPGWCZKNR-ZSZQSSIHSA-N 456.890 0.404 50 20 JCGD CCn1nc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1C 1807362218 UZQHOPZZPZSJIP-KNQAVFIVSA-N 461.331 0.920 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364122 RXOKQSIJYMJWBA-YJBOKZPZSA-N 461.230 0.191 50 20 JCGD Cc1nnsc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808648058 RVNQKVDZQSJNJT-WMLDXEAASA-N 466.527 0.873 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)C1 1809970034 ZOWPXTOCTPITLZ-CTNGQTDRSA-N 467.375 0.612 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CCC4(CCCN(C(=O)c5ccc(B(O)O)cc5)C4)CC3)cnc2s1 1809972329 MPRFWUXQXUVGDE-UHFFFAOYSA-N 494.382 0.903 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2csnn2)[C@@H]1c1cccnc1 1810293266 BNZWOUUXJDEVAE-CXAGYDPISA-N 452.500 0.565 50 20 JCGD Cc1c(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cnn1C 1810300439 YJNYDSXNPVIEGQ-OXJNMPFZSA-N 462.514 0.755 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1C 1810302033 DXKJCQASLAHWPG-QRWLVFNGSA-N 478.513 0.456 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1 1813070319 IJPBQVRLWBRLNA-FXAWDEMLSA-N 456.551 0.947 50 20 JCGD N[C@@H](CC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1cccnc1 1815339812 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N#CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCN2C(=O)OCc1ccccc1 1829000895 NIFCVEAUWSMEAO-RUZDIDTESA-N 490.325 0.346 50 20 JCGD NC[C@H](N)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829055919 DYPMYGUMYYWHQU-TWOQFEAHSA-N 455.918 0.259 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1830538991 XZHBTLUVWQOONR-KPZWWZAWSA-N 458.309 0.594 50 20 JCGD O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830730738 DDLVXZRAAPKQJH-VGSWGCGISA-N 475.933 0.240 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)N(C)C(=O)OC(C)(C)C 1830732803 ATBAUBMFTKBIFS-QEEYODRMSA-N 463.959 0.298 50 20 JCGD CNC(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1831279423 IYBGHSAXVRSQND-DYESRHJHSA-N 482.375 0.585 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)nc3cccnn23)CC1 1831873333 HYKXJEODAXETLI-SFHVURJKSA-N 483.573 0.696 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1831994093 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CS(=O)(=O)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1 1835350421 IROWMZJGLZSVHG-MJGOQNOKSA-N 462.927 0.623 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1 1835350422 IROWMZJGLZSVHG-PKOBYXMFSA-N 462.927 0.623 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C3=COCCC3)CC2)CC1 1835738179 KVCGIENFFHMZFQ-UHFFFAOYSA-N 456.547 0.565 50 20 JCGD O=C(CCCCn1cccc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930577 NMWAJRIBQKMKMQ-XMMPIXPASA-N 469.347 0.108 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1 1835931284 KZQZFJKOSRBJJK-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD O=C(CCc1ccsc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935715 NNSDAXGHKAVKSO-JOCHJYFZSA-N 458.345 0.131 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nn1C 1836032690 WWNQDLIBKHUEFC-UHFFFAOYSA-N 467.379 0.161 50 20 JCGD CN1CCC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)C1 1836351605 FZEAIBRUZKVIDW-QGZVFWFLSA-N 471.606 0.212 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1 1836457777 XNUUYFGLQZANMP-XIKOKIGWSA-N 452.309 0.811 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459668 VVKANYIACGRCKM-QFIPXVFZSA-N 499.553 0.087 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920992 PTCLVIIPNOIZGL-UHFFFAOYSA-N 482.390 0.572 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(C(F)(F)F)n1)CCO2 1837929674 KPEKYZMJKDPMFF-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc3c1OCO3)CCO2 1838477274 OGGGXWMFUDRLPK-XQQQEEOESA-N 498.496 0.014 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cc[nH]c3cc1F)CCO2 1838571967 GLPWKRUUCWQTNJ-XMMPIXPASA-N 481.289 0.371 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1F 1838914737 VUBVDRIOUQSMFO-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(CN(C(=O)COCCO)CCO2)C1 1839195298 MVUBUOJIKADTJD-CQTHNFAISA-N 465.453 0.337 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839246658 VXQVTYRLUYSYMK-HSZRJFAPSA-N 491.545 0.308 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(=O)Nc3cc(C)on3)C2)C1 1839964058 DQMLXINBYFYWJI-IFXJQAMLSA-N 487.351 0.942 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1840031076 FIQIHNVVIYIYDX-PIGZYNQJSA-N 457.281 0.028 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CCN4C)C2)C1 1840184629 YKIILMQKNUSTON-DEOSSOPVSA-N 473.574 0.122 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CCOC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)CCOC1 1840189293 KFBQAAVJFQHOGD-PMACEKPBSA-N 496.388 0.930 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)c1ccccn1)CCO2 1840501518 KFOSCDGFHZPLJW-WDLYKWLISA-N 482.541 0.776 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1cccnc1 1843010488 VLKQNJLWSIEGIE-FQEVSTJZSA-N 494.357 0.844 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1845002734 LEUGOUHBAGXXIB-HNNXBMFYSA-N 453.279 0.141 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)csc2n(C)c1=O 1845014310 SZBPIISTSXESGO-ZDUSSCGKSA-N 487.351 0.735 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)cc1 11401592 GFGQRGOCFVSDRY-UHFFFAOYSA-N 475.523 0.942 50 20 JCGD C[C@@H]1Cc2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc2N1S(C)(=O)=O 17161358 CGBDOYMILXFVDH-GFCCVEGCSA-N 476.467 0.923 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@H](CCSC)NS(=O)(=O)CC)c2ccccc2c1=O 105565556 VJWVQDMNBTXPAT-HNNXBMFYSA-N 469.589 0.629 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)N3CCN(C)CC3)CC2)c1C 206902398 YMYUVLXORNQCAM-OMNSNBSWSA-N 492.646 0.856 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)[C@H]1CCS(=O)(=O)C1 728377883 RDQCANFNJUPNFI-VIFPVBQESA-N 491.897 0.609 50 20 JCGD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728889461 KBEVTOLZLJYBNQ-UHFFFAOYSA-N 476.559 0.387 50 20 JCGD Cn1c(CCC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)nc2ccccc2c1=O 729988896 WJKIXLRFJKMSDT-UHFFFAOYSA-N 453.411 0.779 50 20 JCGD COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(C#N)cc2)cc1 747173002 GDYVIELAOVVYKN-UHFFFAOYSA-N 460.512 0.917 50 20 JCGD O=C(COC(=O)CN1C(=O)CCOc2ccccc21)NNC(=O)[C@@H]1COc2ccccc2O1 749689754 VGPOPQBJGOSRFZ-SFHVURJKSA-N 455.423 0.333 50 20 JCGD C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 811271825 QPMMJVVZKNVLBH-UHFFFAOYSA-N 490.563 0.457 50 20 JCGD CCOc1ccc(-n2ncc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2C)nn1 818374365 JXZJEELDBOWHDO-QGZVFWFLSA-N 482.453 0.514 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(-n2cncn2)cc1 915923714 WQLZNOQNIFWBIW-INIZCTEOSA-N 499.553 0.993 50 20 JCGD Cc1ccc([C@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)N2CCOCC2)o1 916229487 QJEZYKFKTVOWHG-KRWDZBQOSA-N 454.487 0.852 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCCN2C[C@H](C)O[C@@H](C)C2)cc1 916250276 YQWRYQSVVITQRP-IRXDYDNUSA-N 455.581 0.445 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCCNS(C)(=O)=O)c2)c(C)c1 916294560 PYTHLCLHYUKZEB-UHFFFAOYSA-N 483.572 0.597 50 20 JCGD Cn1ncc2c1CCC[C@@H]2NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916604180 CERLIGPCJLTFPG-KRWDZBQOSA-N 462.532 0.463 50 20 JCGD CCn1nc(C(=O)NNC(=O)NC[C@]2(N3CCOCC3)CCSC2)c2ccccc2c1=O 916636438 CJHMZKICPWWIOX-OAQYLSRUSA-N 460.560 0.568 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(F)c(F)c2)cc1OC 919615117 IQYJLECNQRZTEP-UHFFFAOYSA-N 451.382 0.716 50 20 JCGD COc1ccccc1-n1c(C)nnc1SCC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919886092 UBZVCNNYXMRWNX-GFCCVEGCSA-N 454.534 0.194 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)c2ccccc2c1=O 921300884 GKNAJAKDTILYBK-UHFFFAOYSA-N 493.592 0.807 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1778324678 OSZIMJIIDADGOD-VOBQZIQPSA-N 463.934 0.765 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1 1778909483 OKYMUYAGKFLEDL-LQFJEPQRSA-N 455.515 0.225 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1 1778930266 KDIWADUITURPNY-FYSMJZIKSA-N 480.525 0.392 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1c(F)ccc(O)c1F)CCO2 1779037332 WFUMRDOGJSVXFH-NRFANRHFSA-N 461.425 0.426 50 20 JCGD CN(C)c1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)o1 1779370994 CYGRUWVSABKDRM-VGOFRKELSA-N 471.518 0.180 50 20 JCGD NC(=O)c1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1779941702 PKSBHOFYSRSBCW-ANTHHZPCSA-N 458.288 0.394 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1780401774 TVMFBKSDLZSJSR-QHCPKHFHSA-N 454.336 0.464 50 20 JCGD COc1ccc(OC)c(CCCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1781324352 TVJRCGRDUXUVBW-AREMUKBSSA-N 496.369 0.850 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)C1 1782164210 FLSOZDTUXQGBMS-ZVVFGRKBSA-N 480.606 0.853 50 20 JCGD COC(=O)[C@H]1CCC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1782170131 XZDROLIZZPHEJC-MZFHRINRSA-N 486.374 0.473 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)(C1)C2 1783434384 IPTNUYHFMJGWBE-STEQJIOHSA-N 499.373 0.257 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@H]1C[C@@H]1c1ccc(F)cc1 1783884942 OWVYEIKWATUMTN-YPWFZXRJSA-N 466.318 0.903 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)C1 1783932923 KQEZYMSAIZRSFE-IXFSTUDKSA-N 466.579 0.559 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1783936335 GHESILLEBWNOIC-QHCPKHFHSA-N 494.614 0.226 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)N1CSCSC1 1783936573 XLPNVRUTZWPDFQ-BEFAXECRSA-N 459.638 0.232 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCOC3=O)[C@H]2C1 1784277966 LGSXTUPWCKAESS-VGWMRTNUSA-N 488.969 0.550 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccccn3)[C@H]2C1 1785432800 NKUPKWWYPOAYPT-YSSFQJQWSA-N 452.515 0.306 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc4c(F)cccc43)C[C@@H]21)c1ccc(B(O)O)cc1 1786978641 GUTCBHHWPMRWLU-NYDSKATKSA-N 479.317 0.754 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc(C)c1C(=O)O 1786981739 JKPGYMVENSQBLE-YYWHXJBOSA-N 480.326 0.589 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)nc1 1787758373 BAZRBOHSONLMGC-MDUUWBQSSA-N 468.514 0.818 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788145154 PQIMFXSMUFLROD-HNNXBMFYSA-N 458.345 0.795 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(S(C)(=O)=O)ccc3F)[C@H]2C1 1790310759 BQUVLQGHNXHJMJ-FNHZYXHNSA-N 498.577 0.196 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Oc3cccnc3)[C@H]2C1 1791651230 HGURXYWAKHTYSJ-VHCRWPNBSA-N 482.541 0.963 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CNC(=O)OC(C)(C)C 1792884721 WOJDZRLVTFVJRN-AHDPXTMNSA-N 478.384 0.493 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792982487 FHKWQTIJKMXFBO-BPKGMFCQSA-N 459.971 0.869 50 20 JCGD O=C(/C=C\c1c[nH]c2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793962005 GPCWFKUILZCHNC-ZZBOYYBBSA-N 459.311 0.764 50 20 JCGD CC(C)(C)OC(=O)N[C@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1794154239 VVFBVTBTDBLDDO-XWCCPHMRSA-N 496.992 0.707 50 20 JCGD COCCOCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795116617 XULUOSBQLLVSNP-HGKCTWBKSA-N 481.384 0.057 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cc(Cl)n1)C2)c1ccc(B(O)O)cc1 1795735245 RTRBOVWRIZHHTJ-IVWMJMPLSA-N 464.114 0.585 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)C2)c1ccc(B(O)O)cc1 1795736247 RHOYAYDCZQTHID-HATOLVCRSA-N 460.299 0.274 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737837 ZBAUNLXHUAARRP-PIKOESSRSA-N 487.362 0.039 50 20 JCGD COC(=O)N[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccccc1 1796189715 QWANBNITNZBQFP-PLACYPQZSA-N 465.315 0.716 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](COC)NC(=O)OC(C)(C)C 1796393013 VGKFYCDEAMPCBK-NPJQDHAYSA-N 463.959 0.370 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1-n1nccn1)C2 1796443861 OSOXQWHPLHAOKK-KFYWAZSKSA-N 490.524 0.605 50 20 JCGD COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c(C#N)c1 1796443889 PLHPNTMXDIWOIH-UQCYYEOYSA-N 492.536 0.833 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796443950 ROTWXWBPQUXKBN-ZPHZMXASSA-N 459.503 0.219 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cncc(C(F)(F)F)c1 1798250301 IHVXLFJQZUEZLQ-JLVBRIDZSA-N 463.221 0.297 50 20 JCGD COc1ccc2[nH]cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)c2n1 1798483313 UYTBGDNLDGMGFL-DBWKPXFBSA-N 479.497 0.087 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1cccc(Br)c1 1799100294 RVMCSUCCKQFOQD-HRYATBACSA-N 497.390 0.445 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(Br)cc1O 1799476078 YFGIRSYDWYDQSM-HBCWATKFSA-N 489.131 0.352 50 20 JCGD COc1ccnc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1OC 1799504768 XMQYFYMLXLBZHG-BTTYYORXSA-N 454.487 0.663 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1800625255 CAXMUHIFUCOMKG-MFCZKXCZSA-N 453.499 0.356 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br 1800756739 DGVQSCVFALTNMI-USVNMRCTSA-N 454.325 0.493 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCC3=O)C2 1801011186 LWMOPBLHBQNMSK-FEJSZKPUSA-N 456.543 0.782 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C2CC(O)C2)[C@H]1c1cccnc1 1803044573 YWHRDSUBXIVCEY-VGAYCEGGSA-N 452.515 0.992 50 20 JCGD CCCNC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803442309 RQSJWCKBUNICLJ-HTAPYJJXSA-N 481.557 0.706 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@@H](CNC(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1 1804007462 UXBRZHSLVYCGDX-GOEBONIOSA-N 453.201 0.981 50 20 JCGD O=C(COc1cccnc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804332296 FCXGXWNLVAFQRN-AUSIDOKSSA-N 460.299 0.555 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1 1805028147 DHYCSDSOFLAHGP-MGPUTAFESA-N 494.487 0.809 50 20 JCGD CC(C)(C)NCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1807098782 TUANUDKELCXGPS-UZLBHIALSA-N 453.547 0.788 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(-n3cncn3)c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373008 LYZVRRTXHJRQRS-URXFXBBRSA-N 496.336 0.976 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CNC(=O)c2ccco2)[C@@H]1c1cccnc1 1807591215 OBEBYEDFSBKCII-KKSFZXQISA-N 491.508 0.423 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808451133 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CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCCS2(=O)=O)n[nH]1 1821835674 JHQVJFDXKQGKTJ-CABCVRRESA-N 454.553 0.352 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1n[nH]c3c1CS(=O)(=O)C3)CC2 1825997989 DUXSYCWPOFFTQA-WPRPVWTQSA-N 473.964 0.774 50 20 JCGD C[C@](O)(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)C(F)(F)F 1827049965 ARMNWJICGSFLTM-PXNSSMCTSA-N 456.270 0.913 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057537 HTQKBIYGWJRXFB-UTKZUKDTSA-N 453.352 0.528 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCOC2=O)CC1 1828386652 SHPYYXDULYXPAJ-GOSISDBHSA-N 451.568 0.821 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)C(O)O)CCN2C(=O)OCc1ccccc1 1828522569 LWNSIYXKKSKMHP-QFIPXVFZSA-N 479.606 0.601 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1830538374 DQNANPPHVMYXBT-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1830538390 DYOKTTZEQWMVSY-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD O=C(c1cnn(Cc2ccccc2)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732969 ZHSCUJKFACIBKN-DENIHFKCSA-N 462.934 0.601 50 20 JCGD C=C1C[C@@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)N(C(=O)OC(C)(C)C)C1 1830737888 JRCRVKLFPDATFY-JKSBSHDWSA-N 487.981 0.608 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CCN1C(=O)OC(C)(C)C 1830738970 WQARMSBSVKZKOC-ACTFIFLWSA-N 489.997 0.688 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1 1830911603 AVWOZMHTEJOQCV-WKSODWKVSA-N 457.867 0.911 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1 1831449218 JFBRRTMWQJQHQH-LRDDRELGSA-N 453.355 0.132 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1C 1832397446 JYXBBUZCQIFFSD-VWLOTQADSA-N 466.343 0.296 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CCC(CO)CC1)CCO2 1832519366 ZCXPCBWIUHAHMI-LLUZSAEXSA-N 489.573 0.376 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1833497579 NUJFXBCSEDPDJO-MSOLQXFVSA-N 461.302 0.481 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)C1 1834800527 KDOUNFVRWMMDEW-RTBURBONSA-N 485.390 0.141 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834824873 OGMPGFXQCABQNM-GUYCJALGSA-N 451.314 0.789 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)n3cncn3)CC2)CC1 1835118047 LLQSINLDSAPGTG-SSGLAOATSA-N 483.577 0.545 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3scnc3C(F)(F)F)C2)C1 1835929396 NUIQJBNVCGOQBC-LJQANCHMSA-N 499.276 0.226 50 20 JCGD Cc1ncncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835972221 ZWZVEVXARLFKOM-UHFFFAOYSA-N 466.546 0.283 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)no1 1837545271 KQPZWIAAONLVRL-FQEVSTJZSA-N 456.927 0.434 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838789274 NMLNUKOYPGXNEE-GOSISDBHSA-N 462.595 0.891 50 20 JCGD CNC(=S)NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839153846 TUSZSYIYEFHUGM-DLBZAZTESA-N 455.408 0.163 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)CCOC1 1839191221 AGDHVSQQJTWHRU-VHKYSDTDSA-N 479.933 0.661 50 20 JCGD CN(C)[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccccc1Cl 1839731750 POEXMAMTWGXBAI-LQWHRVPQSA-N 474.385 0.999 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1839802165 NLWGPPHUVVXSKR-TVTNDZMWSA-N 496.402 0.961 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(OC)n3)C2)C1 1840151113 VPSPTVVAZPBWDB-UTKZUKDTSA-N 455.939 0.733 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840241533 KAWBUZGPIYKZKL-HSZRJFAPSA-N 464.538 0.506 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2 1844263489 KJGFVGGYSODEES-HNNXBMFYSA-N 454.531 0.293 50 20 JCGD CCCOc1ccc(C(=O)NNC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)cc1OC 16201436 DEAAUVAMUXUXQY-UHFFFAOYSA-N 458.475 0.082 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1)NNC(=O)[C@H]1COc2ccccc2O1 116786923 PTAKTTGWUZYTOC-CRAIPNDOSA-N 460.487 0.445 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc([C@@]2(C)NC(=O)NC2=O)cc1 726283169 XQIGEZVXOMSIFC-OAQYLSRUSA-N 487.542 0.487 50 20 JCGD N#CCOc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 727942271 ATMISDHBQIVQMB-UHFFFAOYSA-N 473.511 0.754 50 20 JCGD CN(C)N(C(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1)[C@H]1CCS(=O)(=O)C1 728178932 MPEORCLAFLNGRO-AWEZNQCLSA-N 465.544 0.858 50 20 JCGD CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 728377206 DVPFMAUUGYSTTM-GXTWGEPZSA-N 458.518 0.028 50 20 JCGD O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cccc(OC(F)F)c1 728596807 IRPDYKAXWQIELH-UHFFFAOYSA-N 498.512 0.779 50 20 JCGD COc1ccc(OC)c(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccc(C#N)cc3)CC2)c1 747102349 RHXJREBCFSKWID-UHFFFAOYSA-N 473.511 0.936 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)c3ccc(Br)cc3C2=O)n1 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NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)cc1)C2 1779374612 SDURYFZVTFGBPQ-AUSIDOKSSA-N 453.499 0.832 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)C[C@@](C)(O)CC(=O)O)CCO2)C1 1780098336 JYHYFAIIRWBIKE-YADHBBJMSA-N 493.469 0.579 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2C[C@]2(F)Cl)C1 1782287565 PYUKQRKQUQRMQO-PBGAUENZSA-N 453.902 0.737 50 20 JCGD Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nc2ccc(Cl)cn12 1782495593 WXRHYNJFMMXWRN-QHCPKHFHSA-N 482.733 0.733 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)n1cnnn1 1782866567 CVBYTFJVCCBZLK-IGICKNSGSA-N 457.441 0.949 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@@]4(CN(C(=O)/C(C)=N/NC(=O)c5ccc[nH]5)CCO4)C3)(C1)C2 1783442736 NWVKERVQDROIEZ-HUYJLYARSA-N 471.514 0.294 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1783535646 BBXLYDFQWOELFV-SGTLLEGYSA-N 450.293 0.316 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1)CCO2 1783871242 OEOJWZNCGZPASM-KKSFZXQISA-N 489.997 0.832 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(OCC(F)(F)F)n1)CCO2 1783935751 CVWSSYZDDUEVQO-FQEVSTJZSA-N 487.479 0.839 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784091308 ZUZMIEGZXKESEA-QMHWVQJVSA-N 463.959 0.106 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(=O)Nc4ccccc4)CC3)[C@H]2C1 1784556287 RODHILUOLZIOSJ-NYVOZVTQSA-N 491.353 0.379 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4[C@H]3O)C[C@@H]21)c1cccc(B(O)O)c1 1786982856 IVBZWRGIDOPDMS-PIAWWSJMSA-N 478.354 0.256 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4c(Cl)cccn34)[C@H]2C1 1787243301 SZMILOILOQASSH-MPGHIAIKSA-N 476.965 0.954 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1csc2c1CCCO2 1787256353 JVIROGYOARJAEN-QSFXBCCZSA-N 470.356 0.660 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C)CN(C(=O)OC(C)(C)C)C3)[C@H]2C1 1788223254 CSYJNVIRYYBNMY-BZSNNMDCSA-N 495.621 0.596 50 20 JCGD NC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)c1ccccc1 1788610529 DFOUJCZRKGSKSV-OFCAXSSNSA-N 466.542 0.021 50 20 JCGD CC(C)c1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)co1 1788611515 HYPPEQIEKNXTFS-OWQGQXMQSA-N 456.503 0.704 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[S@](=O)c1ccccc1 1790598097 ZFWVBHVQIMVVPH-XFFJPXBMSA-N 484.383 0.156 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1792186346 SVPHFTQIQRHDLR-KYTRPZQZSA-N 474.562 0.405 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792975215 MCUDXNWJDMDBCC-WTNVTLLGSA-N 497.980 0.364 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1792993979 SJOQUJLDBMWQQB-OAFZBRQQSA-N 469.583 0.110 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1794113812 GRRUENPEGKAIRC-YFUQURRKSA-N 497.980 0.364 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](N)c1ccccn1)NC(=O)NCc1ccccc1 1795613329 PMQTYILGHDREMY-YDLSIGKMSA-N 495.584 0.017 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@@H]3CCC[C@H]1c1ccccc1N3)C2)c1ccc(B(O)O)cc1 1795734766 OZYGSQJKVUGSML-IBWAHOODSA-N 489.381 0.948 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn3c1CNS(=O)(=O)c1ccccc1-3)C2)[C@@H](F)Cl 1796366502 YIWCGQGNQGTGTG-XBCDXLOZSA-N 497.936 0.402 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1cccnc1)C2 1796440455 MIMUQMOCWKJIAT-RAJLIZLZSA-N 467.530 0.606 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccncc1C(F)(F)F 1796625289 ODCHYKFOEBCTPX-ZSBFGKGUSA-N 463.221 0.297 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)no1 1798200593 DEUNMFDNMXBSBE-OXIQGZBJSA-N 458.899 0.716 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3sccn13)C2 1798440051 WQHLBKDSQSAOTJ-CLLJXQQHSA-N 467.511 0.320 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(CO)on1)C2 1798524394 ABVCHIYXMXALNV-DBWKPXFBSA-N 474.426 0.517 50 20 JCGD Cc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1[N+](=O)[O-] 1799328323 BLHPPDJSVZMGGD-OPMZPASUSA-N 467.287 0.029 50 20 JCGD CCOC(=O)c1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)ccn1 1799412246 DJIVRWMNQPLZMN-MUJYYYPQSA-N 466.498 0.822 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc1 1800278616 ZBEFOCQYAOWWRK-VWFIUDSGSA-N 467.950 0.281 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCN(C)CC3)cc1)C2 1800973955 NRBWHYWVHKUIAL-YHELAOLJSA-N 464.994 0.895 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)C=CC1=O 1801120718 VNXSUEJIMUWSQB-COLAVZROSA-N 470.432 0.386 50 20 JCGD COc1cc(C)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801705765 HOASPFGGIUDZOU-YVWYUNDQSA-N 453.499 0.519 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1805024135 GOAANANGCBWHFC-ZYSHUDEJSA-N 480.974 0.941 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC2(CCN(C(=O)CN3C(=O)CNC3=O)CC2)C1 1806758162 JFJLLFJRCXSWQW-HNNXBMFYSA-N 499.996 0.902 50 20 JCGD O=C(Cc1ccc(F)cn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807480201 YPYPEWUBIBWWRR-MBSDFSHPSA-N 462.290 0.858 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@@H](CNC(=O)[C@@H](N)CN)[C@@H]1c1cccnc1 1808257942 FDMSOQFPRZAEIY-QAETUUGQSA-N 468.986 0.506 50 20 JCGD Cc1cnc2c(C(=O)NC[C@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)cnn2c1 1809835557 MOQDQFIUYQNGMA-KNQAVFIVSA-N 484.325 0.746 50 20 JCGD CC(C)(C)[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810293233 AZHCXTIDEAWLBR-ZYSHUDEJSA-N 454.531 0.807 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1ccnn1 1810305190 IZTSWISICZONCZ-SIXWZSSISA-N 463.502 0.252 50 20 JCGD Cn1cccc1C(=O)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813476031 MUBCOPSWMCPXGK-GHTZIAJQSA-N 460.299 0.302 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3cccnc13)CC2)c1cccc(B(O)O)c1 1815356387 GYZSWRYHRYYFNH-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD COC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2 1820192884 USUQETUWYYPGBA-PEXQALLHSA-N 451.318 0.897 50 20 JCGD CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1)NC(=O)NCc1ccccc1 1820711351 NQGNMJUESVUYNF-GOSISDBHSA-N 495.544 0.624 50 20 JCGD CN1CCN(C2(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4cnccc4C(=O)NN)[nH]n3)CC2)CC1 1820796725 QGBKGTLQGNOKCY-LJQANCHMSA-N 495.588 0.494 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3ccnc4c3OCO4)sc2C1)c1ccc(B(O)O)cc1 1821231401 FMYUMEHLZVUWFY-ZDUSSCGKSA-N 466.284 0.486 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828938961 HNXZVLUHXNSUBV-DYESRHJHSA-N 465.363 0.890 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC(F)(F)C1)CCO2 1829654773 UWPRUBFZMOMOAK-JLTOFOAXSA-N 467.473 0.191 50 20 JCGD O=C(c1cncc(C(F)(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732585 SZBFYFSTLIBOEF-WMLDXEAASA-N 451.829 0.770 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1831110869 MXBDZHVKXNZCRA-MBSDFSHPSA-N 492.385 0.813 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C(=O)C3CC3)CC2)CC1 1833279613 WQUOZXPGFKLXQL-CVKSISIWSA-N 456.547 0.671 50 20 JCGD CCc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1834091802 MGGZFRZKCLMEMY-UHFFFAOYSA-N 464.375 0.823 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1834797325 CRSMNGWDZGDQRW-UHFFFAOYSA-N 471.388 0.936 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798840 DPOVXIJSCWMIOD-GOSISDBHSA-N 480.374 0.414 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3CCCC4)C2)C1 1835941902 TWYPWMWEZCCOFA-AREMUKBSSA-N 478.354 0.629 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc(Cl)cn3)CCO2)C1 1835972614 JFSOEUJAVRAQRS-XAOCGEIJSA-N 491.936 0.127 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)C1=O 1837139312 ZYHLRMZTCSSFJW-BEFAXECRSA-N 484.278 0.582 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(=O)n3O)CC2)CC1 1837283510 FQZHKDMPXDYUCK-WGOQTCKBSA-N 498.540 0.832 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1 1837459537 ITSLAXWINFSMHT-DEOSSOPVSA-N 479.493 0.815 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)cn1)CCO2 1837895332 UBGGUHJGDDFYFP-WGLQLPMYSA-N 488.932 0.939 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)Cc3cccnc3)CC2)CC1 1838093088 XWKCDPBIPKKGTL-NRFANRHFSA-N 474.606 0.323 50 20 JCGD Cc1cc(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1838947567 KZRXQUWOIZCLPH-DEOSSOPVSA-N 467.526 0.686 50 20 JCGD CCCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839012948 SSVWKTQTOHYMBL-RUZDIDTESA-N 482.342 0.539 50 20 JCGD Cc1cc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)ccc2[nH]1 1839615356 JNNOPRDKTKGROH-VWLOTQADSA-N 477.326 0.540 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C1)C2 1839738683 CZUJWBPGPRIFBX-OXTHUFEASA-N 486.928 0.613 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1840017988 PBKSAHOIWLYCQD-RZRCNZQPSA-N 477.945 0.607 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1840029530 ITAWAZPFBJYTFD-RHSMWYFYSA-N 450.399 0.275 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2 1840137624 LUCRDTPCBFOQNF-BWKNWUBXSA-N 495.536 0.149 50 20 JCGD CN1CC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)C1 1840569083 FZEPLSSDGONSHJ-KKSFZXQISA-N 474.986 0.137 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)[C@@H](O)C1 1841351041 FMXWMKZWORXXMR-AVYPCKFXSA-N 459.971 0.798 50 20 JCGD CC(=O)NCCCC[C@@H](NC(=O)c1ccccc1)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841353818 RHWHEBAMIKAPRL-UXHICEINSA-N 493.004 0.895 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013012 YVMNKXJWKSPZKF-IBGZPJMESA-N 483.374 0.973 50 20 JCGD COc1cc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc(OC)c1OC 1843014907 OIYCXOKEWALMJR-CMDGGOBGSA-N 480.326 0.923 50 20 JCGD Cc1c(Br)c(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)nn1C 1844809804 PFMSRCCNIPGTTO-UHFFFAOYSA-N 461.125 0.302 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1)C2 1846365550 AZFARZLTSGBSNS-INIZCTEOSA-N 458.987 0.996 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc2n(n1)CCCNC2=O 1848099921 CLIBJLDYOXNEOZ-JYJNAYRXSA-N 494.980 0.964 50 20 JCGD C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 28196585 ZYBIUSULEINOKT-UHFFFAOYSA-N 490.563 0.457 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1 107910924 UXTPBKPNDUPPHR-LPHOPBHVSA-N 491.522 0.704 50 20 JCGD CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728948826 GSNHMQCYRFSVCY-AWEZNQCLSA-N 461.548 0.693 50 20 JCGD CCS(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 730515479 VGYSAOVSSOJUOD-LBPRGKRZSA-N 465.623 0.110 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)NCCCN2C(=O)CNC2=O)c2ccccc2c1=O 731117839 KJJKCHUFQCIAIR-UHFFFAOYSA-N 457.491 0.473 50 20 JCGD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)c2cccs2)c1 793996822 NOYYWDRDSQATJS-UHFFFAOYSA-N 475.932 0.944 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1 849119421 VTGIFZWVTOVMMB-UHFFFAOYSA-N 476.511 0.626 50 20 JCGD C[C@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 856531897 KCWSSEHSOXFBHI-MISYRCLQSA-N 455.559 0.910 50 20 JCGD O=C(c1cc(Br)cc(S(=O)(=O)N2CCOCC2)c1F)N1CC[C@@H](B(O)O)C1 864231010 IMPFJSZUQZMWAX-SNVBAGLBSA-N 465.106 0.298 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNS(=O)(=O)c3cn[nH]c3)c2)cc1 919954391 JXSAUXORUDCMQW-UHFFFAOYSA-N 451.486 0.842 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1nnc(-c2ccccc2)o1 919961432 HJVYUBMYLHIBSM-UHFFFAOYSA-N 493.523 0.381 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)C1 1778236462 VVLJQWIOYNFRIQ-HXOBKFHXSA-N 481.594 0.446 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)CBr)C2 1779198912 YXPZGBAKSCDKCD-ACXGAUJLSA-N 464.357 0.596 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1779203880 RXVJGAVSDCKHCE-QHCPKHFHSA-N 497.464 0.997 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779222228 WWUCAEABGJCMOU-NTKDMRAZSA-N 498.588 0.090 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)C1 1779371060 AOKMNBSKOWTHNW-LYZSKQBMSA-N 487.557 0.402 50 20 JCGD N#Cc1ccccc1OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779375481 ORGANWAWQDQWTQ-PXDATVDWSA-N 492.536 0.763 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1783533854 KZZUQMOBCJHQLB-KPZWWZAWSA-N 454.325 0.244 50 20 JCGD COC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1784259828 NXYPIENACBYIJT-HXUWFJFHSA-N 464.431 0.320 50 20 JCGD Cc1ccn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)n1 1785372755 MQNDGPJMMDAUSI-FKBYEOEOSA-N 497.600 0.517 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)C1 1785477736 MEFPHGOSFVNHAG-DEOSSOPVSA-N 487.362 0.067 50 20 JCGD Cc1noc(N)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786837920 UKKIUJNOGUDFOA-FHWLQOOXSA-N 499.572 0.505 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)n(-c2ccccc2)n1 1786983525 WTAGKZSRZMLLKC-APTRMMRNSA-N 488.353 0.768 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786984845 PQWIXOIYTYPIHN-NYVOZVTQSA-N 452.316 0.672 50 20 JCGD COC(=O)CCCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609755 GESPGBQZRKINTJ-SNRMKQJTSA-N 475.546 0.402 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3F)C[C@@H]21)NC(=O)NCc1ccccc1 1789724689 KMUALKZEGSBZQU-WPVAHCMFSA-N 461.538 0.670 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)cnn1C 1789725001 WQHSSGCEUMDOFT-BVSLBCMMSA-N 497.600 0.668 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC#N)C[C@@H]21)NC(=O)NCc1ccccc1 1789726712 OYVDVTTXNCUAJW-UFYCRDLUSA-N 456.547 0.616 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21 1790961896 SFBYUAVSQBDPDA-VGWMRTNUSA-N 480.425 0.565 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnc(-c4ccccc4)o3)C[C@@H]21 1791291439 VISIPLLWRQQKNX-BZSNNMDCSA-N 470.530 0.703 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c(O)c1OC 1791293945 QCZVUVMWNOWMSD-ZVZYQTTQSA-N 478.546 0.376 50 20 JCGD CC#C[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(O)cc1 1791335867 ANPAUBMBBLYQIC-BDBQITIBSA-N 490.365 0.863 50 20 JCGD COc1c(Cl)cccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1792022265 PJJGGJWBFNOCTH-QSFXBCCZSA-N 472.734 0.936 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1793087792 OGZOLDUTFLYDRJ-ITGHMWBKSA-N 482.347 0.542 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1C(=O)Cc2ccccc2C1=O)c1cccc(B(O)O)c1 1793201149 IRADOWBRHMGGAM-WKCHPHFGSA-N 489.337 0.233 50 20 JCGD O=C(CN1C(=O)COc2ccc(Cl)cc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1793773088 JXAKSUGFRVEFTK-RHQBZFHZSA-N 472.325 0.255 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccn1)C2 1793878258 KNVHQTSCICIZFS-FQLMCAECSA-N 453.927 0.812 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1CS(C)(=O)=O 1794405519 WFJAJSAHCKRWLG-JFILPPLUSA-N 474.377 0.613 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1 1795737074 ZYYGQBXOBVIHJQ-VPTLXERWSA-N 485.733 0.495 50 20 JCGD CC(C)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795740754 KYIDSGVGBBGTPR-RUMRUAAYSA-N 450.344 0.936 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)n1 1796721020 SWPJWBBIOZUXRZ-XSPYEYLBSA-N 461.244 0.892 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(S(C)(=O)=O)cn1)C2 1796889740 FGFYYFGIRMRGTK-MVRRYPJTSA-N 486.554 0.871 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(F)cc1F)C2 1801010651 OFOANQDJLDUGQD-QNEORMAOSA-N 450.486 0.941 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1807360957 DUTARWQDPFOWOV-PGRDOPGGSA-N 488.309 0.576 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nonc3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364248 SXQQUEDHXZZQOU-AVRDEDQJSA-N 471.282 0.931 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1 1807373378 AKZISDNKVOGFQV-NQIIRXRSSA-N 476.346 0.741 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375688 PGLNCHOQYZJMHT-PGRDOPGGSA-N 460.299 0.094 50 20 JCGD O=C(CCc1cncnc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807499414 GJDULIBMUKFICK-OFNKIYASSA-N 459.315 0.504 50 20 JCGD COC(OC)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808407617 DGVQTEYIVAPWBE-SWUPIQEVSA-N 456.503 0.840 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)CC2)C1 1809974888 GIEMNSDELCIHIL-QGZVFWFLSA-N 494.357 0.218 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc(-n2ccnc2)ccn1 1811583438 XXPXJWVYNUTUEO-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1)C(=O)C(=O)O 1812391698 DPSONLBHCJENEO-RFUYNDQBSA-N 459.330 0.867 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1 1813032317 GTDMFQDDUVMKJP-GTAWCEEGSA-N 451.999 0.977 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@H]1c1cccnc1 1813070973 OWCKKYZBAXVBMC-JTSKRJEESA-N 464.530 0.817 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCN2CCCC2)[C@@H]1c1cccnc1 1814266157 LBWMABUPTPSXDK-AVRDEDQJSA-N 465.558 0.886 50 20 JCGD N[C@@H](CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cccnc1 1817405765 PUWBMTNGQQJZCH-AZUAARDMSA-N 462.319 0.881 50 20 JCGD C[C@](O)(C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(F)(F)F 1817474172 OACUUQWKVKVGRK-KDOFPFPSSA-N 454.214 0.709 50 20 JCGD Cn1cccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c1=O 1819401977 ZGTFQAIYTLLMBR-KRWDZBQOSA-N 464.486 0.727 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)C(=O)Nc2cccnc2)n[nH]1 1819529771 VGEHHPCZLNVHSQ-KRWDZBQOSA-N 477.485 0.748 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829074157 YWUCDNOYVFGVDC-DYESRHJHSA-N 457.380 0.905 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829310267 SVBCBSRNNUUWMX-ZDWFVDTJSA-N 494.976 0.563 50 20 JCGD O=C(c1cnc(-c2ccccn2)nc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724078 CUMCCPJCKSDBQG-DYESRHJHSA-N 461.906 0.208 50 20 JCGD CC(C)COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccn1 1830727728 CPSXELGPSWDWOJ-UTKZUKDTSA-N 455.939 0.786 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cnnn3)CC2)CC1 1834874790 UTRQVXQGGWDARY-KRWDZBQOSA-N 499.016 0.377 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1834972096 PTLLOVUJGMPHOQ-GFCCVEGCSA-N 495.382 0.029 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1835759160 IGNGKIWYMUJQTP-FOIQADDNSA-N 475.428 0.240 50 20 JCGD O=C(Cc1c[nH]c2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931622 UBRUGCYHCBYOCN-RUZDIDTESA-N 477.326 0.160 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccsc4[nH]3)C2)C1 1835939734 YXXLGZOZHFSBRV-QFIPXVFZSA-N 469.328 0.293 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCN(C(C)=O)CC3)CCO2)C1 1836764106 HIYZICSLUQYHQF-GHTZIAJQSA-N 458.987 0.014 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ncc(F)cc3F)CC2)CC1 1836985881 WCYWUJHJZLHRKP-UHFFFAOYSA-N 473.285 0.966 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3cnccc13)CCO2 1837031987 DZUADKLISAUOEW-RUZDIDTESA-N 475.310 0.298 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)COc3cccnn3)CC2)CC1 1838395307 BNTICTQWOVPENB-UHFFFAOYSA-N 483.529 0.166 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc[nH]3)C2)C1 1838527397 QYTYSUUVJPXAHA-NRFANRHFSA-N 473.442 0.627 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCOCCOCCOCCOC)CCO2)C1 1839220238 BYBHIKPNHRSKPH-UGKGYDQZSA-N 495.013 0.547 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1839444216 ABGBTUCSCKPLCY-DYESRHJHSA-N 454.907 0.533 50 20 JCGD CCNC(=S)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2 1839966336 BAEUWDVLGSTQLQ-SUMWQHHRSA-N 465.414 0.100 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H](N)c3cccnc3)C2)C1 1840031723 AHDNJVYXCNSLAC-URLQWDBASA-N 455.353 0.711 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185378 PDWSBFGMJHYBLN-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(F)(F)F)CC1)CCO2 1840821642 IFGGNSJYKRTYME-RADWXHQJSA-N 498.307 0.805 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)c2ccno2)C1 1842437776 DYYDEMWZGWCYOD-SFHVURJKSA-N 498.345 0.307 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cn3c(Br)cccc3n2)C1 1844149670 ALOLWXSCNQGQRT-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1cc([N+](=O)[O-])ccc1F)C2 1844263544 OVRCVFZFVWCRPB-UHFFFAOYSA-N 456.434 0.792 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CC(=O)OC)NC(=O)OC(C)(C)C)C2 1846364859 NLQLMEFTDCNVGL-ZIAGYGMSSA-N 461.943 0.900 50 20 JCGD O=C([C@@H]1[C@@H](O)CCN1C(=O)OCc1ccccc1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847564033 PMVRGRPRJONDRE-VMXHOPILSA-N 465.934 0.560 50 20 JCGD O=C(CNC(=O)c1ccc2c(c1)OCO2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 17516241 NCBMUSWQVHAFGY-UHFFFAOYSA-N 474.495 0.391 50 20 JCGD COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)CC2=O)cc1 726522492 MPGITUTVQIYDFB-CQSZACIVSA-N 480.930 0.806 50 20 JCGD O=C(NNC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1)C(=O)NC1CC1 726618619 GWYUFSDHFYLCHC-UHFFFAOYSA-N 474.495 0.688 50 20 JCGD O=C(NCC(F)(F)F)c1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728856424 REMADEKEQLNUMA-UHFFFAOYSA-N 486.476 0.995 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1 746386456 UQJLYSLRLXQAKM-CABCVRRESA-N 483.363 0.545 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccc(C#N)cc1 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CCOC(=O)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)ccn1 1780170358 TWYPPZPGUMYHBZ-CBGDNZLLSA-N 453.923 0.986 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCC3)CCO2)NC(=O)NCc1ccccc1 1780967904 CGUWOBJRMPRITJ-RUZDIDTESA-N 495.584 0.619 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(CO)c(F)c2)C1 1783078214 SGTSTWMIEVRSEG-AUSIDOKSSA-N 464.538 0.819 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccccc2C#N)C1 1783133989 RKHZAHKUMNNHFB-HYBUGGRVSA-N 471.558 0.824 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1 1783546512 YPNYHCJRPWZIQU-DPSWKAHMSA-N 469.542 0.099 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCc3c[nH]c4ncccc34)CCO2)C1 1783940092 QHIDRAPRSQVSRG-QHCPKHFHSA-N 456.547 0.698 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783946770 HAYVYCPJGACNSC-LJQANCHMSA-N 471.378 0.706 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)[C@@H]3SC(=N)NC3=O)C[C@@H]21 1783965750 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488.338 0.795 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1 1807375085 LHEPZPTVXFLDKS-OFNKIYASSA-N 487.325 0.748 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1 1808134591 HYBJSIDMTICSSQ-VFNWGFHPSA-N 485.508 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccn3c(O)nnc23)[C@@H]1c1cccnc1 1808194912 SBHMPCFBELSZOT-JXFKEZNVSA-N 480.529 0.523 50 20 JCGD CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812779268 RDBRMSPYJQKUPA-AOIWGVFYSA-N 471.396 0.548 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCCO3)CC2)c1cccc(B(O)O)c1 1815356773 QXCZTBIVYSIPCO-AWEZNQCLSA-N 467.316 0.342 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@H](N)c1cccnc1)CC2 1819795271 LONHSWLPFNPWEI-CJNGLKHVSA-N 480.554 0.853 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800944 DVMNOZFDLSKMRF-MLGOLLRUSA-N 473.559 0.672 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc2cccnn2n1 1820083836 PFCCTEHGAQYNMW-IBGZPJMESA-N 459.275 0.752 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)C1 1822721647 NFKXULNDRILEFT-RFHZTLPTSA-N 488.994 0.883 50 20 JCGD COCCn1nccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1827812369 KBWBGBXPQFLKGV-NRFANRHFSA-N 468.363 0.756 50 20 JCGD O=C1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](O)CCl)CCN3C(=O)OCc3ccccc3)C2)N1 1828551149 KTYOUPFWWLVHTB-IEGUWTFLSA-N 492.960 0.317 50 20 JCGD NC[C@H](N)C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc2ccccc2)C1 1829359708 DCFCNGYXNBDTMD-YWZLYKJASA-N 472.373 0.528 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1 1830719844 MHRAEMAPCDVMMX-CBGDNZLLSA-N 469.922 0.140 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731684 MECWKRQQPLOQSP-GCJKJVERSA-N 483.949 0.309 50 20 JCGD C[C@@H]1[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CCN1C(=O)OC(C)(C)C 1830738982 WQARMSBSVKZKOC-PEOGOYOCSA-N 489.997 0.688 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3C(=O)c4ccccc4C3=O)CCO2)C1 1832534973 OSNHQTDXRFTBPQ-FDDCHVKYSA-N 493.944 0.383 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1 1833401620 VKTCKSFRJQDDPU-KRWDZBQOSA-N 466.343 0.359 50 20 JCGD CC(=O)N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)(C)C 1833402585 PZYGTNBCYGIDHT-QFIPXVFZSA-N 486.422 0.102 50 20 JCGD Cc1cc[nH]c1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833981779 CXQFFIUYUOLLNR-UHFFFAOYSA-N 453.547 0.821 50 20 JCGD Cc1c(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nc2ccccn12 1835310672 SQJQRZIKUXBWDF-UHFFFAOYSA-N 489.385 0.822 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)n1 1835812864 MZAQAOVPEACITM-GOSISDBHSA-N 467.998 0.458 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc43)C2)C1 1835934559 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Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)cn2[nH]cnc(=O)c12 1839153740 QRHRKKHCKHRICN-VQTJNVASSA-N 486.356 0.637 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1839153907 VSOMLUOPCLUSCZ-UXHICEINSA-N 484.340 0.396 50 20 JCGD COc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1OC 1839202027 RJFZDHAATZWAPI-MAUKXSAKSA-N 476.299 0.859 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839677186 IFGJQMYHELVCJG-DRRFMEDDSA-N 490.605 0.555 50 20 JCGD C[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802511 ZQDBNPCEURVOQU-RIFZZMRRSA-N 455.349 0.830 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1 1839965406 XQQBGNDPGHNZFP-VCBZYWHSSA-N 470.368 0.907 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1839965485 ZQENIWLQALUZNS-BEFAXECRSA-N 466.336 0.973 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1840031138 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O=C(CCCNC(=O)NC1CCCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 24360464 RORLZDOBGLFTHE-UHFFFAOYSA-N 495.602 0.881 50 20 JCGD CC(=NNC(=O)[C@@H](C)NS(C)(=O)=O)c1ccc(S(=O)(=O)NCc2ccccc2)cc1 728437964 YYIUCVTUMUOMTP-OAHLLOKOSA-N 452.558 0.943 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3CCN(Cc4ccccc4)C3=O)nc2)CC1 744877220 AUJVUXNLJAXWNP-IBGZPJMESA-N 487.586 0.445 50 20 JCGD COc1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c(OC)c1 746969110 DTNSCOUPBJGGGG-UHFFFAOYSA-N 478.575 0.904 50 20 JCGD C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)c2nn(CCCCC)c(=O)c3ccccc23)C1=O 748546423 JTUGNCCYNHBGGR-UHFFFAOYSA-N 468.470 0.325 50 20 JCGD CN(c1ccc(OCC(=O)NNC(=O)CN2CCCC2=O)cc1)S(=O)(=O)c1cccs1 789856869 KWIKBXCMJFIDAC-UHFFFAOYSA-N 466.541 0.722 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)cc1OC 811789234 VEGZQTQGPHRQBL-CYBMUJFWSA-N 457.439 0.822 50 20 JCGD O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)NNC(=O)[C@@H]1COc2ccccc2O1 848978617 KIUVOSXGUNBZQD-VLIAUNLRSA-N 497.460 0.341 50 20 JCGD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 913416641 NPCMDRPFDAMMEV-KRWDZBQOSA-N 469.903 0.866 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@H]1CCN(Cc2ccccc2)C1 915903081 WHPUVUBWHBZVGI-FQEVSTJZSA-N 487.582 0.926 50 20 JCGD CCOCCCNC(=S)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 916125046 AYQPWDMVVWIIEG-MRXNPFEDSA-N 488.632 0.875 50 20 JCGD CC(C)N1C(=O)c2ccc(C(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2S1(=O)=O 916740806 BIIDLJZYUZTXDN-UHFFFAOYSA-N 455.452 0.963 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)cc1 916830767 VNHKJUSQFCAHQO-UHFFFAOYSA-N 469.317 0.822 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NC1CCN(CC2CC2)CC1 918083941 PWUOAHZHNDTQDB-UHFFFAOYSA-N 465.576 0.526 50 20 JCGD CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1 919779472 STAXJNDVJFYGRE-LBPRGKRZSA-N 454.530 0.703 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc4cc(F)c(F)cc4[nH]3)C2)C1 1778402184 WAZPDYWKAUFGSN-QHCPKHFHSA-N 469.253 0.883 50 20 JCGD CN1CCC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)C1 1781001373 MWPRJGFHMVZMIE-BWKNWUBXSA-N 486.617 0.504 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccccn3n1)C2 1782211919 GGPCLDKSFYJWDO-OPAMFIHVSA-N 457.535 0.230 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]cc3I)C[C@@H]21)[C@@H](O)CCl 1784090772 APPXTAWBUBFGKK-QSFUFRPTSA-N 482.706 0.207 50 20 JCGD COc1ccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1 1786978808 YBRRIYMWJQCXGF-HSQYWUDLSA-N 468.315 0.047 50 20 JCGD CN(C)[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)c1ccc(Cl)cc1 1786985025 LFTNPIOBODYKNR-QGQQZZQASA-N 499.804 0.916 50 20 JCGD CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c2ccccc21 1788610422 QVIMFAZVGITMRV-ZRCAFCQKSA-N 491.552 0.962 50 20 JCGD Cc1cc(C#N)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1790270496 AXGQYGXIDXGEHM-NDXORKPFSA-N 462.510 0.772 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791291142 MWDPFVJGLOFWSZ-ZWOKBUDYSA-N 460.531 0.637 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](O)CCl)C3)[C@H](O)C1 1792513890 IHKIIOZWQOVQFA-FHULIHMCSA-N 459.971 0.842 50 20 JCGD Cn1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1 1793880723 DVWWTZFQXGXPMP-XRGAULLZSA-N 455.943 0.755 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC(=O)N(Cc2cccs2)C1)c1ccc(B(O)O)cc1 1794242319 RNSJEMBKKOREGW-FFGOWVMKSA-N 481.383 0.728 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1CS(C)(=O)=O 1794405668 XUXJVDBIDQFNMW-YXPYIKCWSA-N 459.952 0.083 50 20 JCGD CC(=O)N[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(F)cc1 1796188425 DWXDNBWBHJIUHH-CIAFKFPVSA-N 467.306 0.635 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)C1 1796189753 VWHGJMPRQJEALW-WKCHPHFGSA-N 491.353 0.399 50 20 JCGD 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LLIYLRHCMBWRDR-QFBILLFUSA-N 469.257 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCc2cncnc2)[C@H]1c1cccnc1 1807508431 LCIJJDNQPLMZNV-WMZHIEFXSA-N 453.547 0.883 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1808681118 PAJCIGJXPLDALH-XLAORIBOSA-N 484.981 0.963 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)C1=O 1809978635 FJGZRVDMQXZXAH-UHFFFAOYSA-N 475.310 0.660 50 20 JCGD CCNC(=S)NCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1812330369 DEKMTVYMUXLECQ-CFBFWRNQSA-N 498.613 0.705 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812868214 USSONZRTZYFPIH-QILLFSRXSA-N 457.369 0.157 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@@H]1c1cccnc1 1813069175 VSNRWHUVOJKRAX-HOYKHHGWSA-N 478.557 0.905 50 20 JCGD Cc1cnn([C@H](C)C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1813380324 STJMOZGXMAKHHP-ZNLUXHQJSA-N 461.331 0.847 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ncc(Cl)cn1)CC2)c1cccc(B(O)O)c1 1815354948 IURKIPXQXVSMPM-CYBMUJFWSA-N 457.708 0.806 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474838 ZVPIORKHDKXOKI-DNVCBOLYSA-N 450.308 0.928 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1ccc(O)nn1)CC2 1819800920 VEWOYHYYQLGBFW-GFCCVEGCSA-N 482.526 0.496 50 20 JCGD CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)nn1 1821754329 OVDGKKKVKAWGNB-CQSZACIVSA-N 467.316 0.551 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)Cn3nccn3)sc2C1)NC(=O)NCc1ccccc1 1823116265 VBZBRSRDKQKVIG-INIZCTEOSA-N 497.585 0.693 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826090201 ZWNHTGTYZIVIJA-NWDGAFQWSA-N 455.537 0.990 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059224 JAOCOQHPLVPROE-LWKXQZBCSA-N 493.373 0.734 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(C(N)=O)cc3)sc2C1 1827506443 KUQCSMJHZDNNSX-CQSZACIVSA-N 458.544 0.841 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)N1C[C@H]2C[C@@H]2C1 1828810609 TYQGESGQBGGRRJ-XMXZMMKCSA-N 453.392 0.940 50 20 JCGD Cn1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)cn1 1828925009 CNNHRUPQHAXBQM-HXUWFJFHSA-N 453.547 0.895 50 20 JCGD Cc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1829721675 MXIHTLDMKJSSPF-ZFTMLNQLSA-N 480.525 0.172 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1830544253 SGSDJDHTQJBHLC-CKEIUWERSA-N 467.382 0.051 50 20 JCGD CC(C)(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830720041 RISCRWPCEFENLF-QVKFZJNVSA-N 477.986 0.736 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1 1831281047 FMAUSTXEOFCPAI-WOJBJXKFSA-N 462.377 0.177 50 20 JCGD Cc1cccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)n1 1832618627 LXTRKBVCKVDUNE-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1833205678 SGFFCUUHTPVLFC-KRWDZBQOSA-N 496.653 0.844 50 20 JCGD Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1835737147 PAIQRWDTRGQUQA-UHFFFAOYSA-N 466.546 0.283 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccccc3N)CCO2)C1 1835776574 CYKBIOOGDFMPQW-NCTXSFPOSA-N 494.552 0.872 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3sc4nccnc4c3N)CCO2)C1 1835880775 HCZNVCHIJLHUKL-HXPMCKFVSA-N 469.951 0.597 50 20 JCGD O=C(CCc1c[nH]c2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935401 DQYURUBNAIJNFT-SANMLTNESA-N 491.353 0.551 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cnc(Cl)s1 1835991552 ZQILSFJJFUQBBD-UHFFFAOYSA-N 476.795 0.975 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836718478 ZAIWMVHIZXAOHO-QZTJIDSGSA-N 492.013 0.860 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1 1836884366 VXPWDNLPMSCQHV-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD CN(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837460200 XMLURWFVJQPFSD-DEOSSOPVSA-N 482.541 0.135 50 20 JCGD COc1nc(C)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1838174578 LYXVTLRAYDBBAB-VNSNFZHPSA-N 498.540 0.603 50 20 JCGD CCc1ncsc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1838837298 NADDORVNKPSKCW-IBUSPFOHSA-N 488.570 0.910 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)cc1)CCO2 1838958475 BRMLUMNFDCIOAN-QFIPXVFZSA-N 458.707 0.404 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1839146210 WQRFPODDWXAYMR-JLTOFOAXSA-N 453.927 0.104 50 20 JCGD O=C(Cn1cc(Cl)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199100 JDGSGUNEEHTAPR-DZGCQCFKSA-N 453.696 0.683 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839519128 WOLREBIIHRGUGQ-BEFAXECRSA-N 471.352 0.909 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1839717946 SUBURMMVIYREQE-FOIQADDNSA-N 470.910 0.620 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1839962611 LQHJBWBSYJNFBX-KUHUBIRLSA-N 469.336 0.424 50 20 JCGD O=C(CCc1cnc2[nH]ccc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840079757 UEGWESKANZNATQ-UWJYYQICSA-N 450.923 0.552 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3CN(C(=O)OC(C)(C)C)C3)C2)C1 1840156508 QDHGQLCBVDMPGG-HTAPYJJXSA-N 489.997 0.954 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1 1840481221 JWXYCUAIXVVMII-IFXJQAMLSA-N 456.337 0.695 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840739477 HOWBCEULUJQLOJ-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1 1841925392 RLHHSZIKMGMSRY-AWEZNQCLSA-N 459.975 0.695 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c[nH]c1C 1844263526 NMIMSZLHDQCVLV-UHFFFAOYSA-N 482.541 0.948 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cnc(OCF)cn1)C2)NC(=O)NCc1ccccc1 1845038561 SRYNBXSRGJUURU-UHFFFAOYSA-N 485.520 0.946 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038756 PXPYCLNZCYJIHQ-KRWDZBQOSA-N 458.563 0.403 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1 9444207 FUPHRHJGRWHRCE-UHFFFAOYSA-N 491.522 0.829 50 20 JCGD COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 12703064 HPYVLEOKZDLLRC-UHFFFAOYSA-N 455.518 0.019 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1 725910023 GCOOJJALVHCKGN-UHFFFAOYSA-N 486.554 0.804 50 20 JCGD COc1ccc(CN2C[C@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2=O)cc1 726522793 WFCYCRHTUUDQEF-OAHLLOKOSA-N 459.528 0.798 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC3CCN(c4ccc(C#N)cn4)CC3)nc2)CC1 727605196 CAFZJPLLHKSUAL-UHFFFAOYSA-N 499.601 0.579 50 20 JCGD COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2cnc3c(c2)c(O)nc(=O)n3C)c1 728508429 QAXMTPZKPXMLJU-UHFFFAOYSA-N 484.288 0.429 50 20 JCGD O=C(Cc1cccnc1)NNC(=O)N1CCCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1 728957327 BFCHKSYZXSKJKJ-UHFFFAOYSA-N 475.527 0.533 50 20 JCGD O=C(NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21)N[C@@H]1CCS(=O)(=O)C1 750936363 QUGKGKZXDKPWDS-SNVBAGLBSA-N 483.304 0.569 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 832870440 KLBCKVCHLUFEJM-GFCCVEGCSA-N 475.365 0.522 50 20 JCGD COc1cc(-n2cnnn2)c(Cl)cc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 916123953 ZMKUCSURYJDWLW-UHFFFAOYSA-N 454.834 0.646 50 20 JCGD Cn1c(CC(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)nc2ccccc21 916392217 QIRBYBXRCKPVDT-UHFFFAOYSA-N 463.498 0.218 50 20 JCGD CCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NC(=O)N[C@H]2CCS(=O)(=O)C2)c1C 916484123 TYEBREZASNEBPR-STKCSNAVSA-N 450.517 0.978 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)cc2)c1 916568154 HOVHRSSZPCWPDG-UHFFFAOYSA-N 454.530 0.485 50 20 JCGD COCCOc1ccccc1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 919658411 NYQRNMWPNIKPCT-UHFFFAOYSA-N 478.575 0.869 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2N2CCOCC2)cc1C 920225192 UHELYRRLOJWZOC-UHFFFAOYSA-N 462.528 0.627 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)nc4ccccc34)C2)C1 1777760228 CFMXSXSZIDYGBF-XMMPIXPASA-N 461.283 0.378 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC(F)(F)C(=O)O)C1 1778010701 FXYAXWXJMCUYRX-AGBLLEEGSA-N 483.472 0.744 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1 1778946654 MSLDVLARKRMIDF-NRFANRHFSA-N 484.904 0.139 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cn4c(Cl)cccc4n3)CCO2)C1 1779030799 XKEXWNPABGPZAG-JOCHJYFZSA-N 483.916 0.744 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779032438 JXMKOUAZKVXKBW-HSZRJFAPSA-N 453.499 0.841 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)N3CSCSC3)C2)C1 1779143877 KNBJCRXIIJTNSB-AHBLATNWSA-N 494.643 0.993 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CC(F)(F)C1)C2 1779371105 DDBJWGQZSPQWLB-OXQOHEQNSA-N 451.474 0.858 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1779682357 PRSPQXMMADULKB-QFIPXVFZSA-N 473.722 0.571 50 20 JCGD Cn1ncc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1Cl 1779923890 SHHCDVBNAMWVSH-DYESRHJHSA-N 460.727 0.195 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc(C(F)(F)F)n1 1780088378 HUDNGNOFHBIBHQ-HXUWFJFHSA-N 487.479 0.926 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CCn3cncn3)CCO2)C1 1780098296 IWJRAALDKMXCTK-OAQYLSRUSA-N 472.458 0.645 50 20 JCGD CN1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)C1 1780574032 OPCCVAZEHXBQLL-ZDWFVDTJSA-N 458.563 0.154 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1[N+](=O)[O-] 1781304056 SBIOXDSOVCBIOE-QHCPKHFHSA-N 467.287 0.269 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)C1 1782469526 WJQZKAPDFRWHBC-XKGFGPFHSA-N 469.970 0.225 50 20 JCGD 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O=C(NNC(=O)N1CCN(C(=O)c2ccccc2O)CC1)c1csc(N2CCOCC2)n1 918775690 AEIJRJMNWFGBTG-UHFFFAOYSA-N 460.516 0.498 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)NC1CC1 1318006357 UZYHLGMVFBJOJZ-ZDUSSCGKSA-N 461.338 0.475 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CCO2)C1 1779036200 XDWSSIDUMGJMAU-AWUSRGSFSA-N 480.481 0.750 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1780156233 NCMPHTIOBHMGKB-BEFAXECRSA-N 473.295 0.970 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nn1 1780969017 SBXFHLZIFZIMAX-XMMPIXPASA-N 497.556 0.275 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3ccnn13)C2 1782213219 FAZVMAMBVMZVGL-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4cccc(F)c34)C2)C1 1782552104 XHKXJBAKARDVDA-JOCHJYFZSA-N 467.461 0.229 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1 1782940236 AWHFUVSDCBMBJR-OINMWHHXSA-N 487.557 0.884 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784091445 ULYKAPZPTYUBFW-VIQHNZTISA-N 459.971 0.823 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979443 JOGYKBVTVIMVCY-NDXORKPFSA-N 456.279 0.178 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccnc4c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979657 IBATXURFTUDKOG-JLMWRMLUSA-N 460.299 0.217 50 20 JCGD Cc1ccn2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)cnc2c1 1786983660 PBMKHMIECFLFIY-CUWPLCDZSA-N 462.315 0.230 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccc(F)cn4n3)C[C@@H]21 1787507871 VYKMMNYBGUFVST-ZEYHFOIASA-N 496.503 0.596 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(C(C)C)n3)C[C@@H]21 1787508595 CBBUMPLLPYEMOR-GZERKGCBSA-N 470.534 0.586 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1O 1788609893 QYZVRYSODLMOLZ-XERREHJYSA-N 496.524 0.256 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)n1 1788731272 KSASQQVTJFATBX-YXWQFLTLSA-N 473.343 0.957 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21 1789927757 CGUJXDAAOXLFLZ-SBJFKYEJSA-N 451.923 0.776 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)Cc3ccccc3)[C@H]2C1 1790780533 FYQKAIQQBYEXHD-VMXHOPILSA-N 495.418 0.565 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1 1791298078 BMUFPZVWJLGTHB-JYJNAYRXSA-N 471.378 0.466 50 20 JCGD CCCOc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797753132 UXDBCWJDJIDKIS-UPHUGPLXSA-N 467.526 0.991 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn(C(F)F)c1=O 1797992243 QGQXHPMXRBLXGK-DBOAAZOQSA-N 490.467 0.581 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncn1)C2 1798522089 CMUQLWJSEMBWFS-HBCWATKFSA-N 455.427 0.827 50 20 JCGD COc1ccc(C2(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)CCC2)cc1 1799262440 ICAFLRDQHKQHSZ-BBIADKPPSA-N 478.354 0.700 50 20 JCGD COC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1 1799429354 BFWGHSPKQFQAQT-CWPLJXCYSA-N 461.519 0.441 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2cccc(F)c12 1800077002 QXFGOAKEUYPJTE-KSPBDQMDSA-N 467.461 0.218 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1 1800143941 RYZVZILTWCCPAE-BMCPXHGSSA-N 481.594 0.681 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1(OC)CN(C(=O)OC(C)(C)C)C1)C2 1800977776 FRSGYTJQWDNXJX-KYHPRHEASA-N 489.997 0.856 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(=O)OCCO)C2 1800979084 SORIYJXANQWSGV-DACLVMHWSA-N 454.907 0.293 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2)CC1 1805662575 WJCDSSBJWCNSFO-GOSISDBHSA-N 497.637 0.866 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1 1805965848 UNNROZIGZMHQNA-XQNSMLJCSA-N 465.576 0.786 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)[C@@H](O)c2ccccc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362724 HWFGPKCYVHSWCC-MZYLBHOOSA-N 459.311 0.815 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1807369484 LONSXWIGHNEOBG-PGRDOPGGSA-N 475.314 0.584 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc2c(n1)OCCO2 1808187233 KEOJFTBPEDGCJO-AVRDEDQJSA-N 488.309 0.561 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1 1809707268 ZWUNTLJAJAVJRO-MGPUTAFESA-N 485.508 0.985 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810121454 KUEDLDMTJPYBCB-GZWABDKCSA-N 457.361 0.240 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C[C@@H](N)c2cccnc2)[C@H]1c1cccnc1 1810303032 OMPLLWNOIIAYDJ-ZEYPLWLESA-N 488.552 0.885 50 20 JCGD Cc1nccnc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 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C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1830540868 UWWHBHJTBAGUBN-IFXJQAMLSA-N 469.336 0.508 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830733024 CVQHUHSJVJFSNT-UZLBHIALSA-N 455.895 0.535 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(F)cc1 1830733485 NFSJKGTXIYEDKH-WFXMLNOXSA-N 471.913 0.059 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1 1831188121 URMNVQDKUZTDHQ-FQEVSTJZSA-N 496.329 0.370 50 20 JCGD COC[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831620775 LKWVEDFVAOZGMC-QYWGDWMGSA-N 477.986 0.857 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nn[nH]c3C(F)(F)F)CC2)CC1)[C@H](O)CCl 1833312334 LGORRBWCYGNFBA-GFCCVEGCSA-N 452.865 0.608 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(Cl)c1)CCO2 1834179678 SLMBKCNMQWUVAK-WGLQLPMYSA-N 488.932 0.939 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1 1834825031 RKRCJIKXIMAKDA-XLIONFOSSA-N 455.349 0.831 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CCO2)C1 1835350844 DMCXOAXRDKIVPC-NQIIRXRSSA-N 488.990 0.343 50 20 JCGD CN1CCN(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)CC1 1835402347 BDVKZBJVDXUELP-WOJBJXKFSA-N 465.422 0.317 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1cccnc1)CCO2 1835686504 DGZLCIJBOOLIHB-UXWGWJTHSA-N 497.556 0.472 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)N1C[C@H]2C[C@H]2C1 1835737963 OTBZLPHNRZGSJJ-OKZBNKHCSA-N 483.617 0.211 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2s1 1835932046 LGHGWRNOJRLQJT-QHCPKHFHSA-N 483.355 0.601 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(C)n1 1835939879 LVRMRJJUHWDOTL-VWLOTQADSA-N 481.358 0.081 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1 1837153777 YDGNQGACPLGFEV-RBZFPXEDSA-N 466.332 0.783 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459535 IRFCGTUXVBYEEC-DEOSSOPVSA-N 499.524 0.086 50 20 JCGD CCn1nc(C)cc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920129 CONMHXDNFOGDIW-UHFFFAOYSA-N 468.363 0.817 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1840033370 BJJPSDUGWGCEPQ-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840116015 RHSBLHAEOXMXSF-HOIFWPIMSA-N 492.013 0.839 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(C)c3C(F)(F)F)C2)C1 1840150824 QZJBRJBEZIZEHP-DYVFJYSZSA-N 468.860 0.763 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1 1840154910 JOYWFJKRUNYHMN-VQIMIIECSA-N 457.867 0.624 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)c4ncccc34)C2)C1 1840184177 BDRJDIOYLXDKDA-HSZRJFAPSA-N 472.546 0.016 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840186944 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COc1ccc(C(=O)NNC(=O)C(=O)NC2CC2)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1 11683824 QDXXKXKELQAFMW-CHWSQXEVSA-N 452.533 0.401 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)c1 14841547 HWQHZMHCSDSNCR-UHFFFAOYSA-N 480.568 0.724 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)Cc1ccc(Cl)cc1 14935666 HJWORXATMALZSJ-KRWDZBQOSA-N 487.987 0.812 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCc2c(C)[nH]c(=O)c(C#N)c2C)cc1OC 17223198 COMOHPUCYRSDRK-UHFFFAOYSA-N 456.455 0.818 50 20 JCGD CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O 729276467 FULNGAUCQQNNHO-ZDUSSCGKSA-N 488.522 0.580 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)cc1C 729614529 IRLMEWCSYDYWFL-UHFFFAOYSA-N 468.562 0.965 50 20 JCGD COC1CCN(C(C)(C)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1 730907511 DKOLEKQBBAWXSJ-UHFFFAOYSA-N 483.639 0.533 50 20 JCGD CCOC(=O)/C(C#N)=C\NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 730964544 VCHIFAHRNAKLQS-HECSCLNYSA-N 466.516 0.544 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC)c(OC)c2)cc1OC 769342985 SCEXVMSAFIVGNM-UHFFFAOYSA-N 467.500 0.851 50 20 JCGD CCc1nnsc1C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 771858519 NRCLACBLIHVZIN-CQSZACIVSA-N 483.572 0.828 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1 841714597 KPRGAUIWDLHZIX-CYBMUJFWSA-N 461.338 0.274 50 20 JCGD CNC(=O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 916389928 DDCVRQTXESCRID-UHFFFAOYSA-N 475.527 0.211 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(CCOC)C2=O 916740687 DGYHVVXSXVSKOG-UHFFFAOYSA-N 477.495 0.716 50 20 JCGD Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccc(-c3ccc(C#N)cc3)cc2)cn1 917908091 KPEOXEWTIPMCTJ-UHFFFAOYSA-N 468.495 0.463 50 20 JCGD CN(C)N(C(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)[C@H]1CCS(=O)(=O)C1 919988683 BDBZSHVSFXSANB-HOCLYGCPSA-N 474.561 0.488 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)NCC3CC3)CC2)c1 920859227 MFDWKCFIIFBJFM-UHFFFAOYSA-N 465.576 0.657 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(C)C(C)C)C2 1778094359 GTTLMGNHBVNJRW-RCBCJABQSA-N 460.579 0.975 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nonc3c2)C1 1778524974 HTECDKWFSYBARR-XMSQKQJNSA-N 458.519 0.723 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(C(F)(F)F)cn3)CCO2)C1 1779030182 IFLYISZFXGCKIY-IBGZPJMESA-N 479.419 0.251 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc(OC)c1C 1779036249 ZZZIMWOXYHIPOA-XMMPIXPASA-N 483.525 0.768 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/N2CCCCC2)C1 1779364198 JBSBPEANGYGQHH-CAMGNALRSA-N 471.562 0.284 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc3c(c1)OCO3)C2 1779371025 HKHWXRUDTLKYLG-PXDATVDWSA-N 495.536 0.784 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779376028 VBIZGTNHDPDPTB-SRDOKRBCSA-N 482.541 0.675 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncc(O)c1)C2 1779376110 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CN[C@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1)C(=O)O 1783023948 RJNDUQDBDDKCRI-LZJOCLMNSA-N 482.375 0.885 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(CO)c(F)c1 1783074792 SYJUZNJXYXSDKN-ZJSXRUAMSA-N 470.306 0.439 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnc3c(O)cccc13)CCO2 1783937524 UBVGCIDOANTUFW-HSZRJFAPSA-N 455.515 0.757 50 20 JCGD COc1ccc(Cl)c(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1F 1784055187 ZLFBWLMLIBRZKW-HSZRJFAPSA-N 490.724 0.854 50 20 JCGD CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCS(=O)(=O)CC3)C[C@@H]21 1784615914 CZWJRVHRWXTDEU-QAETUUGQSA-N 450.001 0.104 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1 1785278014 FIRLLRUSJOVNPC-QHCPKHFHSA-N 460.531 0.598 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1 1786605480 RORWQTGHFCBQJH-OWLYRPNTSA-N 458.964 0.348 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(F)c3F)C[C@@H]21)c1cccc(B(O)O)c1 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50 20 JCGD CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807364411 QEQMVUZGMWNGTO-BDWJNYAHSA-N 451.288 0.200 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)ccc2O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374544 ZZEMIHLDLBOLTO-JTSKRJEESA-N 461.283 0.806 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1)[C@@H](F)Br 1808650847 GIZJBMSUMBVVAT-NILFDRSVSA-N 456.272 0.330 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302478 KMZSSMVZNQUBOI-PXNSSMCTSA-N 478.557 0.682 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H]2CNC(=O)C2)[C@@H]1c1cccnc1 1812640247 ABRGGHUBIQOCAE-OXVMVGSVSA-N 465.514 0.358 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813073477 JAZZIQGQCHAXJE-IPJJNNNSSA-N 460.579 0.765 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813074922 WTHIKFRROZLHAE-IGHLBYLOSA-N 451.593 0.619 50 20 JCGD Cc1nc2ncccn2c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 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O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833025604 DQOBRKQMGBEVSI-RBZFPXEDSA-N 499.362 0.234 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1833265453 WUCDELWDWNUNOE-SWLSCSKDSA-N 472.384 0.187 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)nn3C)CCO2)C1 1833446849 SAXKSJIHILJJNQ-ACJLOTCBSA-N 459.341 0.672 50 20 JCGD Cc1nccn1CCCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799096 OBBWEZQGJIDTKL-UHFFFAOYSA-N 481.406 0.537 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccccc3O)CC2)CC1 1835737192 VFOFXIYPSMTHAZ-UHFFFAOYSA-N 466.542 0.890 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cnccc1Cl 1835859825 PVHNAHAPPKMBGH-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc4nscc34)C2)C1 1835932128 PCTCOILIJADTDD-HSZRJFAPSA-N 481.339 0.360 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1835933560 BWIRJKWBRMNTIA-WZDPVOGJSA-N 490.365 0.558 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3nccnc3C(N)=O)CC2)CC1 1836050404 RKILYLRHRXPTHX-UHFFFAOYSA-N 462.627 0.612 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3n(n1)CCC3)CCO2 1837090979 BQTLASMMKVGLGT-AJPHYDNBSA-N 483.529 0.033 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837717434 FMRQMDQFIROJJM-OAQYLSRUSA-N 452.628 0.887 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C[C@H](N)c3cccnc3)CC2)CC1 1837898748 XUNYTFOSUOZWNF-QFIPXVFZSA-N 495.584 0.782 50 20 JCGD CCOC(CC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)OCC 1837921000 QMMKADLNPWURBW-UHFFFAOYSA-N 476.379 0.768 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)/C=C/c3cnccn3)CC2)CC1 1838395306 BLRVVEFSIBHDAX-OWOJBTEDSA-N 479.541 0.801 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528180 KBGIABDKPXAKGU-UTKZUKDTSA-N 499.904 0.844 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1839145990 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CCOC(=O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840885554 OIHKDSQVYBEUEP-PXAZEXFGSA-N 453.305 0.723 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@@H](C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1 1842060939 XRZCIDMDPMALBE-CVEARBPZSA-N 467.954 0.978 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)CC1CC1)C2 1843428728 NHANZKPUAYUWGY-FQEVSTJZSA-N 485.390 0.806 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C[C@@H]2CNc3ccccc3O2)C1 1844220120 BYUQVSUDEHFWQJ-OAHLLOKOSA-N 450.499 0.765 50 20 JCGD CNC(=S)NCCC(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1844692809 MTMMRPOBLSUOQU-UHFFFAOYSA-N 463.516 0.821 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)C1 1847230537 BCYGNFCQBACESU-DQKQSUEQSA-N 459.971 0.796 50 20 JCGD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)C2=O)cc1 26955037 FLYCOFNZPQUSOI-QHCPKHFHSA-N 486.481 0.949 50 20 JCGD C=CCNC(=S)NNC(=O)c1cc(S(=O)(=O)N(CC)CC)ccc1N1CCOCC1 725908552 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CC(C)(C)OC(=O)NCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1792256601 WTTWUDAVDLXIIJ-IHPCNDPISA-N 489.378 0.265 50 20 JCGD CN1CCN(c2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)cc2)CC1 1792458336 QUYTVLSPZQYLAE-IRJINJETSA-N 486.617 0.015 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl 1793117937 LFNHSOIUVJDZAH-KHMAMNHCSA-N 461.943 0.681 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ncccn3n1)C2 1793880123 PZJQEUDDNMAUPB-XGUBFFRZSA-N 493.952 0.460 50 20 JCGD O=C1CSc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)ccc2N1 1796191053 TVKQLHHELNMUHM-BCDXTJNWSA-N 465.340 0.976 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)[C@@H](O)C1 1796361773 TWQFEECYRAUFCE-PLZKBRGSSA-N 463.934 0.728 50 20 JCGD O=C1Nc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)cccc2C1=O 1797539042 YZXCLTZACZESLD-QHBPRCKVSA-N 450.289 0.810 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748510 FVNWZQDCYANWIT-VPTLXERWSA-N 454.531 0.466 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1(N2CCN(C)CC2)CC1 1799976195 CTJIORBWKGXINX-KIWKKXJHSA-N 469.590 0.539 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCCCC1=O 1800890568 DGZNXZCXGZMCHM-RCJHGTSTSA-N 486.997 0.721 50 20 JCGD COC(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1 1801142060 WRDILRZTOPRQQW-RHZSSNLCSA-N 495.536 0.739 50 20 JCGD CN1CCN(CCC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CC1 1806916541 QXPSUOISZFENFV-RDPSFJRHSA-N 473.622 0.098 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc(Cl)nc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360022 OGDCGGQSXJCJOZ-QFBILLFUSA-N 465.706 0.838 50 20 JCGD COc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807363279 OIZTUUBTQSBYTC-NQIIRXRSSA-N 460.299 0.798 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807363479 CEPVQXVXRGVBDS-OZOXKJRCSA-N 452.320 0.882 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2cscn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365752 WFHKLSBFHAVFRG-UWJYYQICSA-N 450.329 0.780 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc3c(c2)CCNCC3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372627 HEZWUIDBCQMCIW-BWKNWUBXSA-N 499.380 0.478 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ncnn2C)[C@@H]1c1cccnc1 1808414016 DMRFNZABSVWLHD-GYPFKPTKSA-N 463.502 0.664 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnn2cccnc12 1809740796 GUFSVOQNIDMUMT-RXVVDRJESA-N 470.298 0.438 50 20 JCGD O=C1Cc2cccc(C(=O)NC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)c2N1 1812209014 WASRULOEOFADKR-CYFREDJKSA-N 484.321 0.889 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1 1813348314 SUPNMEZMUQIYLD-KBXCAEBGSA-N 481.542 0.310 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(-n3cnnc3)cc1)CC2)c1cccc(B(O)O)c1 1815354607 LNGCRRDFMCXARO-KRWDZBQOSA-N 488.338 0.943 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnn3c2OCCC3)[nH]n1)c1ccc(B(O)O)cc1 1817472736 VHADINHLQWPZNF-GOSISDBHSA-N 464.291 0.688 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nc1 1817473082 CTJBUDCESGAZCG-IBGZPJMESA-N 497.342 0.508 50 20 JCGD CC(C)n1cnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)n1 1817683062 LVGOPFKMUBRCNT-CQSZACIVSA-N 454.321 0.535 50 20 JCGD CC(=O)NCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)[nH]n1 1821946138 QHAZSZSGBWDWHN-IBGZPJMESA-N 484.561 0.884 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1 1822416329 ANHFCQFVDHVOFL-OAHLLOKOSA-N 488.505 0.545 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCNC(=O)C2)n[nH]1 1822482384 VOIMRRQXIGGYSF-MLGOLLRUSA-N 454.491 0.240 50 20 JCGD C[C@@H](CN)C(=O)N[C@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822518360 NKOWETYFASJSSF-HOCLYGCPSA-N 473.603 0.996 50 20 JCGD C[C@@](O)(C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)C(F)(F)F 1824832190 WXCQHKIZMIPSMJ-YLJYHZDGSA-N 456.270 0.913 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1825999967 HJFOTSRVBXUAMW-BXKDBHETSA-N 452.924 0.621 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1828132864 PCBYTIVXNWMRJX-ZFWWWQNUSA-N 452.581 0.733 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2 1828308399 VVJBYTWXGBXBKS-USWWRNFRSA-N 489.982 0.424 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc3ncnn3c2)CC1 1828734579 ZFYHELPWTFFCNO-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830726895 VSIWHQGDJLETBQ-QEEYODRMSA-N 461.943 0.052 50 20 JCGD CSCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831534129 NNZTZHVUXSSNDG-ZHNJOBQTSA-N 479.603 0.966 50 20 JCGD O=C(CCc1cc(F)ccn1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833795134 NSBMSMWDYHDFDL-UHFFFAOYSA-N 482.365 0.719 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C)on1)CCO2 1834346882 IPHRIOALZUEHJA-CPOKCXMASA-N 458.475 0.187 50 20 JCGD C[C@H]1CCc2c(C(=O)N3CCC(N4CCC(NC(=O)c5ccc(B(O)O)cc5)CC4)CC3)n[nH]c21 1834798521 GFBJBLXWJFDQGU-INIZCTEOSA-N 479.390 0.638 50 20 JCGD CCc1ncsc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801344 ZJNFKLOMBNTYKZ-UHFFFAOYSA-N 470.404 0.884 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1 1835116455 PHDVYIDCRLIKCD-UHFFFAOYSA-N 469.435 0.787 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cccn4ccnc34)CC2)CC1 1835578812 LQEXOVKZZQAJIG-UHFFFAOYSA-N 469.590 0.893 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1835737136 ODYGDYUUWUBEIF-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccc4)on3)C2)C1 1835926190 IAXCGDBVHUXPKT-RUZDIDTESA-N 491.309 0.405 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1)[C@@H](F)Br 1836412788 UXQHDNMXOKTHQU-CYBMUJFWSA-N 460.304 0.764 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)C1=O 1837136838 RKLOMLOWNWLSRA-HXUWFJFHSA-N 480.315 0.676 50 20 JCGD O=C(CCc1cnc[nH]1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837137017 CAVAQLKAGLWEBA-UHFFFAOYSA-N 454.336 0.335 50 20 JCGD CC(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054294 RRLKLMOGOYQVCC-DEOSSOPVSA-N 491.589 0.214 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1839804314 PFIBOAFBJTXXHN-WMZHIEFXSA-N 495.960 0.311 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CS(C)(=O)=O)C2)C1 1839962659 NBBVSMHYAUZUCJ-KEYYUXOJSA-N 469.398 0.297 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1839966525 HZXYMCPDBCBAJW-DYESRHJHSA-N 498.422 0.962 50 20 JCGD Cc1nn2cc(CC(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)nc2s1 1840030869 ZEKZHQGSPUWFEZ-KPZWWZAWSA-N 486.392 0.882 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1 1840033572 JTPMEBIUSJXWQD-RNODOKPDSA-N 482.331 0.871 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1840148807 VKGOXKLMWBSPDM-XXBNENTESA-N 498.960 0.723 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)C1 1840153763 ZCCAXUYUYUQUGU-YVHKJVDXSA-N 489.997 0.954 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(NC(C)=O)c3)C2)C1 1840156951 YQLLUCXEIFFSOH-NQIIRXRSSA-N 453.923 0.969 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840189332 LLPDZQXIOPIYNO-DJJJIMSYSA-N 484.377 0.522 50 20 JCGD Cn1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)cn1 1840463411 HTIYZLXOQCMITO-JTSKRJEESA-N 499.996 0.551 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1840883055 SETMQZPWDZYCCL-ARGWCVDVSA-N 495.932 0.434 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1841433725 IEKJGOVTQCDSSY-KRWDZBQOSA-N 486.529 0.081 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCN2CCOC2=O)C1)NC(=O)NCc1ccccc1 1843857891 NXIVBBQNFDCPSZ-UHFFFAOYSA-N 472.546 0.378 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263443 GDEMRPZZCFVJDZ-UHFFFAOYSA-N 460.535 0.805 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCOCC3)n1)C2 1844264164 NOKXSGAXGQKPOY-UHFFFAOYSA-N 465.514 0.048 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1 1844264403 OKSAIQMQRDBPKE-UHFFFAOYSA-N 450.499 0.703 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038388 XKXCSQIPARPOBQ-LJQANCHMSA-N 458.563 0.451 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 15379415 JOEHWUJYVUZCPN-UHFFFAOYSA-N 495.583 0.384 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)CNc1ccc(C)cc1 105185030 OFEHRAGEUOCVMG-UHFFFAOYSA-N 462.528 0.898 50 20 JCGD CCCn1nc(C(=O)NNC(=O)COCC(=O)NCc2cccnc2)c2ccccc2c1=O 727752677 HHQNZAGKOPXEOM-UHFFFAOYSA-N 452.471 0.296 50 20 JCGD C[C@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)N1C(=O)NC2(CCCC2)C1=O 728213568 AFKGBBKMAIQKRR-OAHLLOKOSA-N 478.575 0.319 50 20 JCGD O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 742454093 STWVGMNJGMSVOO-JSGCOSHPSA-N 462.450 0.571 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CCc2ccco2)o1 748265551 KWYJFAWUAUNWJJ-AWEZNQCLSA-N 453.473 0.983 50 20 JCGD O=C(NC[C@H](c1ccc(F)cc1)N1CCOCC1)NNC(=O)c1ccc(-n2cnnn2)cc1 807000775 WZSUNWWADJWKRZ-LJQANCHMSA-N 454.466 0.819 50 20 JCGD COCCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1 811835951 WSPWWJAUEFBMJK-UHFFFAOYSA-N 469.903 0.883 50 20 JCGD CC(C)(C)NC(=S)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C/c1ccccc1 825164360 UFEKIIGEGXOBEV-VOMSXAGXSA-N 476.646 0.674 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C2CC2)c2ccccc2c1=O 879508915 XUEAUOBJUVNPJN-UHFFFAOYSA-N 461.438 0.637 50 20 JCGD Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1C 913572984 BWCWELBFWGSLPZ-UHFFFAOYSA-N 471.539 0.907 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CC(=O)N(C3CCCCC3)C2)cc1 914830740 UQRYAGJKQBCNJD-MRXNPFEDSA-N 450.561 0.944 50 20 JCGD CC(=NNC(=O)C(=O)NN=C(C)c1ccc(S(C)(=O)=O)cc1)c1ccc(S(C)(=O)=O)cc1 916539690 DPPZMFYWZGRMEB-UHFFFAOYSA-N 478.552 0.874 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1C 916567512 MPDNRCIKYOSLIV-UHFFFAOYSA-N 496.567 0.273 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(C)cc3O)c2)CC1 918338757 LYVOJKJLHYXTST-UHFFFAOYSA-N 460.512 0.628 50 20 JCGD O=C(COC(=O)[C@H]1C[C@@H](O)CN1C(=O)Cc1ccccc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1 919179821 CLIYOZSISVTKCF-SJLPKXTDSA-N 488.428 0.243 50 20 JCGD CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)NCc2ccco2)cc1 920384735 OYNGSJDTEASYAJ-OAHLLOKOSA-N 454.530 0.968 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCN2CCOCC2)cc1 920848004 MKYJAJKKQNHPMC-NBVRZTHBSA-N 452.515 0.789 50 20 JCGD C[C@@H](OC[C@@H]1CCCCO1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 921146164 LUTDDOCZDCQCMN-WBVHZDCISA-N 455.533 0.443 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)C2)C1 1778236465 VVLJQWIOYNFRIQ-UZUQRXQVSA-N 481.594 0.446 50 20 JCGD Cc1ncccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029260 UUPPKOZQZXSIOR-HSZRJFAPSA-N 452.515 0.465 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779032529 RMPHZOYEWMOESC-XMMPIXPASA-N 480.525 0.330 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3cccc(F)c13)CCO2 1779037327 WADDQUIJQJJKAN-QFIPXVFZSA-N 467.461 0.458 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2n1 1780042311 XPFRMDVWZCJVHR-QHCPKHFHSA-N 464.287 0.009 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967891 BJEBTWMPKSZWGD-KKSFZXQISA-N 496.406 0.946 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 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50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374580 ZZRDOTFFJLZWIG-XMSQKQJNSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374703 HUKPXPZMLWNBEN-CRAIPNDOSA-N 464.247 0.026 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375351 SMTXYRGPFNNKLI-NQSCKRDGSA-N 461.331 0.614 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@@H]1c1cccnc1)C(=O)C(=O)O 1808316844 HWPBNCLFWRRDNZ-WTANOLMUSA-N 459.330 0.867 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808417735 OLXDEWFJRCQHLR-MGKPWUAXSA-N 499.528 0.286 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1 1809976568 GTYKVPLHYOIHDU-UHFFFAOYSA-N 498.410 0.994 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)n1 1809978118 MQPYSAIFPXABBF-UHFFFAOYSA-N 482.302 0.837 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1 1810302577 LSVHDAFZSJEXAN-SUMWQHHRSA-N 476.440 0.510 50 20 JCGD Cc1cc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n[nH]1 1810420682 WDROYSLSDHTAHV-IIBYNOLFSA-N 462.514 0.674 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H]2CCCS2(=O)=O)[C@H]1c1cccnc1 1812498269 JGHSMVBBBBIBTF-MBOZVWFJSA-N 465.576 0.038 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@@H](N)Cc2cscn2)[C@H]1c1cccnc1 1813070050 FWZXOVBXZSIRDJ-MMOPVJDHSA-N 473.603 0.487 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1cncn1)CC2 1817282509 HSWPHXREYSKICP-NSCUCBQXSA-N 469.531 0.871 50 20 JCGD COCCn1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)n1 1817614126 BKNSOGQFLOPKLB-LBPRGKRZSA-N 484.542 0.524 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1n[nH]c2c1CS(=O)(=O)C2 1817683489 ZXIWONPFMONDAO-QWHCGFSZSA-N 456.912 0.467 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](C)n2cnnn2)n[nH]1 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O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4ccccc4O3)CC2)CC1)c1ccc(B(O)O)cc1 1834799324 WUYAZAGYZGCZNK-RUZDIDTESA-N 491.397 0.945 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccccn3)CC2)CC1)c1cccc(B(O)O)c1 1834799981 LADZKYXYDYAQSE-UHFFFAOYSA-N 450.348 0.189 50 20 JCGD C[C@@H](CN)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835520475 HFKBISLDIMQGSI-AVYPCKFXSA-N 462.975 0.170 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1F 1835926430 NBQZNUPHAMWNBO-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD O=C(c1ccc2ccoc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939292 KUPGSLHBBFXKBB-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD CC(C)[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)CC1 1835939940 PNNHGVYNMRXZLV-RLSLOFABSA-N 472.391 0.899 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3[C@H]4C=CS[C@H]43)CC2)CC1 1836511508 CUVUMODGANCXIR-MISYRCLQSA-N 470.599 0.745 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836720731 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CC(C)(C)OC(=O)NCCOCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN 1847720456 BREJOCINPLYPPO-ROUUACIJSA-N 490.561 0.432 50 20 JCGD COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)N3CCN(C)CC3)CC2)c1C 206902441 YMYUVLXORNQCAM-QTCOBDOFSA-N 492.646 0.856 50 20 JCGD O=C(CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1 729481873 HDTZOCKMWOUCQD-MRXNPFEDSA-N 479.490 0.938 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1OC 730620197 NRBHIDWQWCFVRB-MRXNPFEDSA-N 499.476 0.832 50 20 JCGD Cn1c(=O)c2c(ncn2CCC(=O)NNC(=O)NCc2cccc(C(F)(F)F)c2)n(C)c1=O 742459108 FOSVGGNGBCKAEX-UHFFFAOYSA-N 467.408 0.373 50 20 JCGD CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)C(=O)N1CCCC1 748246308 IIAPKWRMNHELPG-SCOADAFUSA-N 454.574 0.468 50 20 JCGD CCOC(Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)nn1)OCC 748557845 QKEYPSOMQBZFPD-UHFFFAOYSA-N 494.574 0.927 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1 751208128 AECWJMKECWARNT-UHFFFAOYSA-N 496.475 0.998 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCc1ccccn1)N(S(C)(=O)=O)CC2 754573169 ADRUKGHNEBMYAI-KRWDZBQOSA-N 477.543 0.878 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)n1 761050297 SMPIVDBNNLHSMG-UHFFFAOYSA-N 494.595 0.932 50 20 JCGD Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1C 913391784 BMYHNRVQFFOTGP-UHFFFAOYSA-N 473.599 0.941 50 20 JCGD COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)[C@@H]4CCS(=O)(=O)C4)cnc32)c(OC)c1 914838941 CSIMKFOUFAKLLU-CQSZACIVSA-N 473.511 0.693 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1 915163929 GZRUEOQHDXCEEK-HNNXBMFYSA-N 466.903 0.179 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc1[C@]1(C)NC(=O)NC1=O 917722502 DMGZZMXNQOUJNX-IBGZPJMESA-N 464.525 0.923 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)N[C@H]1CCS(=O)(=O)C1 919886399 WECUQYWKBHRIMW-YJJOXIQCSA-N 470.573 0.217 50 20 JCGD Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 920424830 KIFMFUVMKGQAGP-MHWRWJLKSA-N 458.479 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DFMHOLPRGDDIKK-UHFFFAOYSA-N 466.347 0.731 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801449 KIGRWLWVFKWOHJ-UHFFFAOYSA-N 497.376 0.942 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1 1835645197 YBEYSDXTILGZRU-QFBILLFUSA-N 467.394 0.859 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CCc3nc(N)n[nH]3)CC2)CC1 1835666718 VXMKESCFEYAZJS-UHFFFAOYSA-N 451.648 0.743 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)C2)C1 1835937466 YEXPEIWQCJDAJZ-SGIRGMQISA-N 498.772 0.894 50 20 JCGD N#Cc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1Cl 1835938163 NXAUBIYUMQNCQR-HSZRJFAPSA-N 483.717 0.275 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cc4cccnn4n3)CC2)CC1 1836077655 GRGQOLGSGRMUJD-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C\C(=O)NC3CC3)CCO2)C1 1837247021 KYOOMHJJJGONFS-UBZBRERJSA-N 458.353 0.309 50 20 JCGD CC[C@@H](C)[C@@H](N)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837849831 RQNBTEJGNDPJNF-FOIQADDNSA-N 460.579 0.671 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1C[C@H]1F)CCO2)NC(=O)NCc1ccccc1 1839098192 FVBVSVQKSIIDMH-YCRNBWNJSA-N 477.537 0.147 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)N1CCN(C)CC1)CCO2 1839104559 GQCYLLHHXNRRIK-UWVAXJGDSA-N 475.428 0.252 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1839152060 MFUIMAOJHDLOCR-MOPGFXCFSA-N 452.379 0.401 50 20 JCGD CN(C)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839197841 JTTBEVZRDOHFSH-MAUKXSAKSA-N 459.316 0.908 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc21 1839200066 BJSXYIDQVZJQQH-OXJNMPFZSA-N 499.337 0.638 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202731 NZZJXBDMVKGKPS-QCUYGVNKSA-N 477.327 0.889 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1F 1839321722 QWSMPQUVCMRMKV-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1840038295 PBKSAHOIWLYCQD-DODAUVCRSA-N 477.945 0.607 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840108054 PRZXMBMLMQJWHP-VWKPWSFCSA-N 475.970 0.512 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3C(=O)c4ccccc4C3=O)C2)C1 1840150917 SLRDTLPGDUBDFW-MBSDFSHPSA-N 493.944 0.383 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Oc1cccnc1)CCO2 1840451674 SDAAIHCYDCKVOP-DBHUJENISA-N 498.540 0.439 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(F)c1F 1840700701 AIBGUXQNAHCMRE-HSZRJFAPSA-N 474.269 0.337 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1 1840802958 MWJYJXJXGJANFX-MGPUTAFESA-N 463.959 0.611 50 20 JCGD O=C1CN(CC(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)C(=O)N1 1841892461 JMWCOLMYWPBWSS-OAHLLOKOSA-N 463.332 0.748 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCNC3=O)C2 1844692487 CASFDUKECHAANN-UHFFFAOYSA-N 496.480 0.981 50 20 JCGD Nc1nc(CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)nc2ccccc12 25026297 IGNQGIMRWJMPKL-UHFFFAOYSA-N 464.486 0.699 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCCN(C(=O)OC)C2)c1 726717183 MVTGSYAXCDPLTQ-OAHLLOKOSA-N 455.537 0.892 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2nc(S(C)(=O)=O)n3ccccc23)n1 728729642 RTOUHYMBHIHGFT-UHFFFAOYSA-N 451.486 0.050 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)COc1ccccc1O 730781178 GPLFXJLRENYXJY-UHFFFAOYSA-N 465.484 0.262 50 20 JCGD C[C@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)C1 731219045 QNVLWIXTFTZBFN-WMZOPIPTSA-N 469.550 0.329 50 20 JCGD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)C1 731220497 INRQXRUBLHJXQT-UYAOXDASSA-N 486.621 0.746 50 20 JCGD O=C(NNC(=O)c1cc(N2CCOCC2)ccn1)c1cccc(S(=O)(=O)N2CCCC2)c1 743798104 PCPHLHNEZKCSNH-UHFFFAOYSA-N 459.528 0.778 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c2ccccc2c1=O 746385699 JZXRBALHGRSUIX-GOSISDBHSA-N 498.584 0.528 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1)C(=O)N1CCCC1 748247415 NOMHCXFYVDPKAR-UHFFFAOYSA-N 493.586 0.081 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CNC(=O)c3cccs3)c2)C[C@@H](C)O1 751210556 HEFIMWRDCVMYSD-OKILXGFUSA-N 480.568 0.737 50 20 JCGD CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1OCC 751326921 UKCWDWORVBAZSY-UHFFFAOYSA-N 499.567 0.627 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)n1 763949557 QSRBMESOEHEWCT-XUSGNXJCSA-N 479.559 0.821 50 20 JCGD CS(=O)(=O)Nc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 916246822 SXJFHEJOVULFHG-UHFFFAOYSA-N 495.583 0.987 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1csc(C)n1)c(=O)n2Cc1ccccc1 916333841 WMAGHWAILHUOOB-UHFFFAOYSA-N 481.538 0.970 50 20 JCGD CN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)CC1 916388158 WXMPDOLXNGXWQZ-UHFFFAOYSA-N 459.572 0.982 50 20 JCGD CCN1C(=O)c2ccc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc2S1(=O)=O 917532322 SAZHQDGRONTAML-UHFFFAOYSA-N 485.566 0.824 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1 919905942 MQUAJRSYTSLZDM-UHFFFAOYSA-N 490.586 0.505 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C#Cc1ccccc1)C2 1779371213 SCZZXHZIFCOWFH-PXDATVDWSA-N 461.522 0.864 50 20 JCGD Cn1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c2c1CCC2 1779372644 RIRIKDMLQSDOGG-NTKDMRAZSA-N 481.557 0.349 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc[nH]3)C2)C1)NC(=O)NCc1ccccc1 1779373550 ISWPPKRUKQWHDB-QHCPKHFHSA-N 454.531 0.804 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1 1779631787 JCFRGTUOGYYFGN-QFIPXVFZSA-N 455.519 0.288 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccnc2C(N)=O)C1 1779940518 PUENGMIJXPNMKJ-SEDUGSJDSA-N 454.325 0.486 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)c(F)c2)C1 1780922013 APYXWOFWULUAAD-AUSIDOKSSA-N 471.489 0.971 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)nc2nccn12 1781307406 ABDGEQHCKDPDCB-HYBUGGRVSA-N 477.330 0.159 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ccc1C 1781909804 CFYDZXIIUAGONS-DEOSSOPVSA-N 465.315 0.391 50 20 JCGD COC(=O)[C@H]1CCC[C@@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)C1 1782214051 LDWUVCPNZGLVHJ-NRAIQUKZSA-N 480.606 0.853 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)C1Cc2ccccc2C1 1783321591 PMUNTAARFXNWPM-ZEQKJWHPSA-N 462.355 0.909 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)CCO2 1783540604 ZNSTWKXZYJOMLP-LDNFRZNASA-N 490.395 0.970 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(Cc3cccs3)C1)CCO2 1783933020 AIFCSTNJCHEISJ-UZUQRXQVSA-N 491.614 0.300 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(C)(=O)=O)C[C@@H]21 1785076482 LNDAAIOBYIFETC-AJNGGQMLSA-N 481.999 0.143 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)[C@H]2C1 1785331923 IDUVIAJRSIQTMG-WUGWMSQLSA-N 468.938 0.226 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4nscc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786982011 XDSLAPHLHJCPLV-XERREHJYSA-N 465.340 0.883 50 20 JCGD Cc1cc2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)[nH]c2cc1C 1786984233 SFDMDRSMMLOIKT-JLMWRMLUSA-N 476.342 0.767 50 20 JCGD CCn1nccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508934 UFIKQOYCVBQDHA-GDJYOZILSA-N 455.519 0.630 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCn3cccc3)C[C@@H]21 1788610773 AAMJHYZKMRWECL-VDGAXYAQSA-N 454.531 0.560 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)C(=O)OC(C)(C)C)C[C@@H]21 1791289016 BFUCKSJIMXQBPN-ULQDDVLXSA-N 469.583 0.206 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(C)(C)C#N)NC(=O)NCc1ccccc1 1792633294 MCRMHCVPCJVLQH-OPVJXMOQSA-N 456.547 0.472 50 20 JCGD COc1ncccc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1794367317 OXYMGUFSMSSKSK-BJWYYQGGSA-N 452.515 0.973 50 20 JCGD COc1ccc([C@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cc1 1796439879 MBBIREJNEHRZCI-WNLGKQKWSA-N 483.525 0.452 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)nc1C(F)(F)F)C2 1796441700 SGYMPNPDQGOXTR-FUGBDTLGSA-N 495.462 0.776 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccn2c1C 1796846177 FQORJJBHZCQYHO-FKWFMORESA-N 477.525 0.980 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(F)CCCCC1(F)F 1797206612 KCXHZKGQYCEYNX-DOHHPOSVSA-N 454.254 0.487 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)nc1C(F)(F)F 1798113590 NWXWVULPUJGWIA-DRXBFXEBSA-N 460.457 0.015 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(=O)OC)cc1[N+](=O)[O-] 1799823090 GYINITWDIGLCGV-IARIHHJXSA-N 469.878 0.838 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2C(=O)C=CC2=O)cc1 1801868587 ZDXNVSWTXZCNDD-MQJTVSLUSA-N 461.902 0.573 50 20 JCGD CC(C)(C)OC(=O)CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1803897677 JEPIQJURQSFXDY-PGRDOPGGSA-N 467.331 0.813 50 20 JCGD Cc1[nH]nc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1805119714 WFKMSMMRIZTEDG-UZLBHIALSA-N 451.267 0.565 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1806340884 PLLVOACOSKVIQK-BBRMVZONSA-N 463.269 0.597 50 20 JCGD O=C(CCN1CCCCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1806645921 XIPKPCTZIHVJGI-QPPBQGQZSA-N 464.375 0.957 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CN2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374646 HAIOGMXXBGQPND-HVCNVCAESA-N 484.365 0.796 50 20 JCGD CCN1CCC(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1807374786 NESXETRETWWKFH-FYYLOGMGSA-N 464.375 0.813 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1 1810302909 NYAVNHPBUBFHPJ-HNAYVOBHSA-N 489.492 0.837 50 20 JCGD O=C(C/N=C/c1ccco1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810389942 JONQOLRMFSQINS-ZWWUYNHISA-N 460.299 0.793 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1 1813319560 WDXQPHMVNQBVOP-GYFHUBPDSA-N 477.529 0.903 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1 1813351029 LZFXYVJVXLTWBL-HNAYVOBHSA-N 460.564 0.371 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)ncn1)CC2 1817276215 PWXDQSUSXQKQHY-YZAVXKJMSA-N 468.499 0.999 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)/C=C\C(=O)NC2CC2)n[nH]1 1819272022 QATIEBHUVZXBEI-TUYSUELWSA-N 466.502 0.549 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(OCF)cn1)CC2 1819793358 MGZGMWLDDADIBN-SNVBAGLBSA-N 486.489 0.777 50 20 JCGD C[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2 1825626335 NPEXBAMQMHQZTD-ZFWWWQNUSA-N 460.560 0.782 50 20 JCGD O=C(CN1CCCCC1=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053115 DELFFTHFOZKWJH-NRFANRHFSA-N 455.364 0.612 50 20 JCGD CC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551880 XAKLYNVPWXKOFZ-GCJKJVERSA-N 480.949 0.174 50 20 JCGD O=C(c1cc(O)n[nH]1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828995967 VNIAQRSDLUQMEW-VGSWGCGISA-N 491.932 0.781 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ccc(Cl)cc3[nH]1)CCO2 1829614765 SPSDXKKHPIIMTP-XMMPIXPASA-N 497.744 0.885 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829715235 VIQBGKSRAXLGBX-MSOLQXFVSA-N 454.420 0.728 50 20 JCGD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726160 OFHOMMJUJMEFBK-LPHOPBHVSA-N 459.858 0.333 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1831192754 HTIYTWMOEVJNCR-HNAYVOBHSA-N 462.385 0.780 50 20 JCGD COC[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1833526777 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1837919423 QHJYPJKEKCFBNI-UHFFFAOYSA-N 477.330 0.564 50 20 JCGD Cc1nccn1CCCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922195 WQXMNMDCCQRDDU-UHFFFAOYSA-N 482.390 0.964 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cncc3cnccc13)CCO2 1838466864 WGLIBYOZYABFRL-HSZRJFAPSA-N 470.530 0.073 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C(=O)c3cccn3C)CC2)CC1 1838788849 BIWSEOPXWOALPM-UHFFFAOYSA-N 461.563 0.579 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)ccc3-n3ccnn3)CCO2)C1 1839479590 SYWTXPOSDCSBER-GCJKJVERSA-N 477.949 0.900 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3nscc13)CCO2 1839576392 VOQZRMLRIQTQHT-HSZRJFAPSA-N 496.549 0.679 50 20 JCGD O=C(O)C#CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839801767 CAAUJPRAHXIQSR-UWJYYQICSA-N 479.327 0.537 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4[C@H]3O)C2)C1 1840149951 CMKOGJJOWCATGH-AWWSKVOZSA-N 466.962 0.993 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)C(=O)c3ccccc3)C2)C1 1840150338 IYLZJMXSSNSGLL-XMSQKQJNSA-N 467.950 0.469 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1 1840155579 FEXAAIICXXXCEH-KKSFZXQISA-N 450.923 0.747 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc2c[nH]nc12 1840184987 GSOFVBWVJBMOGP-HSZRJFAPSA-N 472.546 0.314 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840189129 YUSJZEOEXNIKHF-IBGZPJMESA-N 486.312 0.552 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840881619 ZTROLAXVGIPSIO-FAGWGIEHSA-N 470.906 0.527 50 20 JCGD CN(C)c1cccc(OCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1841908415 CIJBEMPTKKYFID-UHFFFAOYSA-N 452.515 0.647 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)C(C)(C)C#N)C2 1843428850 TYRDEIVKKSSWCZ-IBGZPJMESA-N 498.389 0.555 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C)C2 1846383980 OIWDZDOUDIPQMV-INIZCTEOSA-N 465.551 0.141 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2ccc(N3C(=O)C=CC3=O)cc2)C1 1846891275 PTCHAGMUHAOUIT-UHFFFAOYSA-N 453.499 0.306 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847562853 BXDSXMYSINAYAT-QPSCCSFWSA-N 481.999 0.116 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(Cc2ccccn2)CC1 1848246239 YSPOAUFVSJFXKB-SFTDATJTSA-N 456.591 0.868 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 11309318 XYODMVJFIWUDBS-MRXNPFEDSA-N 468.871 0.888 50 20 JCGD C[C@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C 16205639 YULDWADZCLIOIA-AWEZNQCLSA-N 464.482 0.592 50 20 JCGD COCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)OCC(=O)NNC(=O)c1ccccc1 19420070 CRQLMAYTMKOQJO-XMMPIXPASA-N 480.477 0.616 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CC1 22139118 PZYJRYICZDRHNV-UHFFFAOYSA-N 486.597 0.982 50 20 JCGD Cc1ccc([C@@H](CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)N2CCOCC2)o1 729044733 IRWWROKJQGQXNW-GOSISDBHSA-N 457.535 0.998 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccnc3N3CCOCC3)cc2)CC1 729533742 FYBGIESNWKDERF-UHFFFAOYSA-N 460.560 0.611 50 20 JCGD CC(=NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1 730576794 KZTUXRNXDZHRMR-MRXNPFEDSA-N 471.557 0.447 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)sc1Br 744464231 ZOPQEYDEPOWQRL-SECBINFHSA-N 462.303 0.759 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cnn(C)c1C1CC1)c(=O)n2Cc1ccccc1 747149714 LVYWWAPHAVDQFB-UHFFFAOYSA-N 490.524 0.500 50 20 JCGD NS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)CC1 747778948 NXGGOBJUSAETNS-OAQYLSRUSA-N 471.583 0.676 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1)[C@@H]1COc2ccccc2O1 751266812 KHMFURWTDHODND-HNNXBMFYSA-N 495.457 0.677 50 20 JCGD Cn1c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1[N+](=O)[O-] 754703293 OOKBUYQEYYEYSO-UHFFFAOYSA-N 465.488 0.348 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC)c(OC)c2)c1 768648860 FKPGTBSHJBOVCR-UHFFFAOYSA-N 453.473 0.461 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCn2c(=O)nc(O)c3ccccc32)ccc1Cl 789372769 AGCLIAVZKPJIKK-UHFFFAOYSA-N 465.875 0.254 50 20 JCGD CC1=CC(NC(=O)c2ccco2)=S=C1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 811263030 BJPCDJNNXYZKKH-UHFFFAOYSA-N 490.563 0.781 50 20 JCGD COc1ccc(CC(=O)NNC(=O)CNc2ccccc2)cc1S(=O)(=O)N1CCOCC1 823327848 KAULFVFNYHGUIM-UHFFFAOYSA-N 462.528 0.518 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)C2CCN(C(=O)c3ccoc3)CC2)ccc1Cl 912988673 SAOCSMOPFUZVML-UHFFFAOYSA-N 454.892 0.894 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)NNC(=O)c1cccnc1 913108938 YKUNHPLAWFEKIA-UHFFFAOYSA-N 479.946 0.809 50 20 JCGD CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1F 914748120 HZHKTPDVQXIVAE-UHFFFAOYSA-N 486.547 0.838 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3cccc(C(=O)NC4CC4)c3)nc2)CC1 916649084 SNCKTDQAAOBXNV-UHFFFAOYSA-N 487.586 0.736 50 20 JCGD O=C(NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1)NNC(=O)C(=O)NC1CC1 919782489 KSXXQFSCPBOGLS-UHFFFAOYSA-N 456.482 0.051 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)cc(OC)c1OC 921018714 ARNAQBRAAAHCLG-UHFFFAOYSA-N 484.556 0.853 50 20 JCGD COCCNC(=O)CSc1ccccc1C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 933512898 YWLDQTNHTJKNBP-UHFFFAOYSA-N 469.523 0.863 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CC(=O)N(c4ccc(C#N)cc4)C3)cc2)CC1 1318258695 CHDMCEUVJPBLSD-SFHVURJKSA-N 482.566 0.991 50 20 JCGD Cn1ccnc1[C@@](O)(CCNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)C(F)(F)F 1318268241 XODTXDGXCVIQLK-SFHVURJKSA-N 470.456 0.597 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c2n1 1779036972 KXTBQZNTVQKJRI-DEOSSOPVSA-N 477.525 0.707 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)ncc1[N+](=O)[O-] 1779373448 SHQBBVBBRJLVQB-AUSIDOKSSA-N 497.512 0.738 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1780328473 OMBISQHRMQGEHP-HXUWFJFHSA-N 453.927 0.560 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)N1CCOCC1)C2 1780712714 VQGMPWQSHZMGNU-VVWQDTPRSA-N 452.379 0.387 50 20 JCGD Cc1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1[N+](=O)[O-] 1780757626 KYFSQZKIEUGAAR-RCZVLFRGSA-N 495.341 0.953 50 20 JCGD Cc1cc(CC(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)on1 1780969719 NWKCTCZGEMUDGW-DEOSSOPVSA-N 484.557 0.702 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1781232478 VDAOSRXOYANCIQ-MOPGFXCFSA-N 454.314 0.769 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781332478 ZHGMZWHZIOAOLN-XTQGRXLLSA-N 458.288 0.115 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccn3cncc3c1)C2 1782215018 PJZUGINYRPEMBP-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1 1783499687 YPNYHCJRPWZIQU-VEYWIMSWSA-N 469.542 0.099 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1783550125 AMIVSSAXVPVJKZ-UFNANVBGSA-N 457.955 0.816 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C[C@H]1CCN(C(=O)OC(C)(C)C)C1)CCO2 1783938054 QYMQRIPQHQJGEC-HOYKHHGWSA-N 495.621 0.836 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1)NC(=O)NCc1ccccc1 1784130721 YDSRHBZTNHICAN-WATLYSKOSA-N 487.601 0.714 50 20 JCGD O=C(CCBr)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785538406 NHWJXSMHFZLZPQ-HNNXBMFYSA-N 450.380 0.462 50 20 JCGD CC[C@@H](C)[C@H](N)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786820713 KEZKWRKKZSPLKE-JJSQAQTOSA-N 488.633 0.686 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccnc4c3)C[C@@H]21)c1cccc(B(O)O)c1 1786982810 CUODDWIGMRQRJW-JLMWRMLUSA-N 460.299 0.217 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)C1 1787449819 YBHPCINCRVRDJU-IATJYDTKSA-N 463.934 0.728 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)N1CSCSC1 1788682536 BYXWLEXRBRDDMX-BODMPHMZSA-N 494.643 0.321 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1)C(=O)C(=O)O 1790695469 KRISRYMWLVUDCT-MEFGBEIZSA-N 490.463 0.394 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CNC(=O)C3)C[C@@H]21 1790695861 XHFXSTANMCKZGS-OOPWCRBXSA-N 458.465 0.988 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCn3ccnn3)[C@H]2C1 1791648178 ZGPHSZMFDVSKML-QSFXBCCZSA-N 486.485 0.795 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC[C@H]1NC(=O)OC(C)(C)C 1793154368 KTMKUXALZPSDSP-JUZZZCAGSA-N 495.621 0.642 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C\c1c[nH]c3ccccc13)C2)c1cccc(B(O)O)c1 1795737208 DJRYXWHIGGNJFH-KALPFLKPSA-N 459.311 0.764 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(C(F)(F)F)c1)C2)c1cccc(B(O)O)c1 1795737350 UWEXGDRYLMZPNR-JLVBRIDZSA-N 463.221 0.297 50 20 JCGD C[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)NC(=O)OC(C)(C)C 1796191036 QVHYABMZGYNDMA-DQEVTTJGSA-N 459.352 0.922 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796369982 GKCVFTHZFALNAD-NDKCEZKHSA-N 465.906 0.567 50 20 JCGD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(C(F)(F)F)o1 1796406928 FMYOPVWNMDNQBP-AGGWBTHJSA-N 467.209 0.199 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)NCc1ccco1 1797891636 GVGDUPQUNLGSCC-RZNUDEGDSA-N 496.524 0.176 50 20 JCGD COc1cc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1OC 1799704527 CIEGTXMGGFTMKP-FAQVEIGNSA-N 468.315 0.209 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(=O)OC)cc1[N+](=O)[O-])C2 1800979539 OOLYAVQYIRCRLC-YXPYIKCWSA-N 469.878 0.838 50 20 JCGD COc1cccc(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1804396240 BYSSYNNZWLQASJ-NTKDMRAZSA-N 474.326 0.727 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1804577404 MCXYHUURAJAZBX-NFBKMPQASA-N 461.331 0.595 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1805304855 JCIPDSSVHDTQOU-DNVCBOLYSA-N 478.513 0.456 50 20 JCGD COc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1 1807360918 MIPVJHNODXRGJX-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363843 PUHUMDUSFYPNJS-GCJKJVERSA-N 488.309 0.561 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807367592 MITDKEIOMTYYNO-HOJAQTOUSA-N 457.361 0.195 50 20 JCGD Cn1cc(F)cc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373944 DRTFCFRPYMFKOR-UWJYYQICSA-N 450.279 0.872 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1 1807412541 HVFYCQVORTYLNF-QRWLVFNGSA-N 482.932 0.950 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808358921 QQFDXBSGEQEIPA-ACIOBRDBSA-N 473.342 0.046 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1 1810302508 LDOAWIKHBYTUEK-YCRPNKLZSA-N 485.508 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCN2CCCC2)[C@@H]1c1cccnc1 1810307735 HGBRQMWSUSGKNQ-XMSQKQJNSA-N 465.558 0.886 50 20 JCGD COCCOCCOCCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1812933867 SNZFGKRXHAIKEO-YKSBVNFPSA-N 493.605 0.530 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(Cl)ncn1)CC2)c1cccc(B(O)O)c1 1815361122 YFWIYEAOCRQVJM-GFCCVEGCSA-N 457.708 0.806 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816674052 SPSKIGJRBOYDGJ-SECBINFHSA-N 462.568 0.346 50 20 JCGD O=C1COc2ccc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3cccc(B(O)O)c3)CC4)cc2N1 1819146430 RCXGPMOIWKVVGU-OAHLLOKOSA-N 492.322 0.693 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819402961 PRYABGNMJTWNAU-PXAZEXFGSA-N 456.507 0.581 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn3ncccc3n1)CC2 1819797212 QEFBAPATKBBYQD-LLVKDONJSA-N 477.510 0.724 50 20 JCGD COc1cc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)n(C)n1 1825475651 FHLMYTDPDYOSJO-GOSISDBHSA-N 469.546 0.974 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C#CC(=O)O)C2)C1 1829339744 ASEDRMJYPHZDKW-WZONZLPQSA-N 491.928 0.780 50 20 JCGD O=C(c1cnc2c(Cl)cccn12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830722868 IAMLOJPJAGYNJP-BEFAXECRSA-N 457.314 0.657 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732233 WMFWWYPGLHAUTN-XMSQKQJNSA-N 452.935 0.610 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830888318 QIVDJQMLAPDPIU-AVRDEDQJSA-N 468.934 0.462 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C1CCC(C(F)(F)F)CC1)CCO2 1832142997 IFGGNSJYKRTYME-QRFVXNFXSA-N 498.307 0.805 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cn[nH]c3)C2)C1 1832549695 XQBCAWUCXPCTOZ-JTSKRJEESA-N 499.996 0.931 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1OCC1CC1)CCO2 1833629240 SNSCCKDOFHCKPU-DEOSSOPVSA-N 489.573 0.313 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC1CCN(C2CCN(C(=O)C(O)O)CC2)CC1 1833726836 LIPIKPDYKKKKOF-HNNXBMFYSA-N 462.975 0.001 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1 1834821451 LAUJNHAAPSRWJG-WIYYLYMNSA-N 466.376 0.942 50 20 JCGD Cc1nnsc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835183104 MFVSYKCIZKTRQF-UHFFFAOYSA-N 457.365 0.025 50 20 JCGD Cc1csc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835927488 PUXFMOUOXJUJAJ-QHCPKHFHSA-N 472.372 0.439 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3ccc(B(O)O)cc3)CCO4)c2c1 1835927826 YGPFUVLJRQQIHK-AREMUKBSSA-N 491.353 0.469 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)c(F)cc3F)C2)C1 1835932297 YGWJRSMHSUKIEP-QFIPXVFZSA-N 478.232 0.168 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)COc3ccc(O)nn3)CC2)CC1)[C@@H](F)Br 1836413883 QAKDTZVSKRXZFL-QGZVFWFLSA-N 474.331 0.823 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1836656211 QWDRHWCFWBFSJM-GHTZIAJQSA-N 453.923 0.244 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccs3)C2)C1 1837456250 GGVVQVALHZCVGQ-QFIPXVFZSA-N 473.555 0.449 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3Cl)C2)C1 1837460063 RHIQPTYLBZYRCU-JOCHJYFZSA-N 491.907 0.861 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(O)c3)C2)C1 1837460521 HCBCQJDYFLUONV-DEOSSOPVSA-N 483.525 0.094 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)n[nH]3)C2)C1 1838528312 QAHHFUGPEPOCMQ-NRFANRHFSA-N 489.441 0.333 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838789402 OVTMIEXGSBWDLT-UHFFFAOYSA-N 476.622 0.951 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)C2)C1 1839147065 GEHCYMPWBFRNFI-FSTVOOFJSA-N 489.997 0.688 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@H]3COc4ccccc4O3)C2)C1 1839199329 UIDXMVQXCCFSFI-GJYPPUQNSA-N 473.295 0.973 50 20 JCGD CCNC(=S)NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1 1839655585 IFNGEFKLYWDTEF-SUMWQHHRSA-N 465.414 0.100 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839743893 CRCNFUHSRPWMFL-UDUWVDIRSA-N 488.491 0.949 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C=CCN3)C2)C1 1839744095 OHYYVJVWNLZONZ-FORFGNHHSA-N 458.465 0.856 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1840031097 FPRNSAVMLXKJOB-AUUYWEPGSA-N 469.336 0.051 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nn1C(F)F 1840184782 AIGZSWGMDJVPLG-HXUWFJFHSA-N 472.493 0.030 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1 1840185185 MTYABVGQBMXJNU-QHCPKHFHSA-N 475.521 0.069 50 20 JCGD CC#C[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccc(O)cc1 1840219531 QQHPBDBWXLOXFP-GREBRCKQSA-N 464.946 0.945 50 20 JCGD Cc1cc(C)cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840305971 AZWMBXJTRHTBPZ-SANMLTNESA-N 480.370 0.686 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1840850892 FYJKETGCLKZJRQ-SIXWZSSISA-N 462.385 0.779 50 20 JCGD CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840914124 BGAMYBTUEZSZDD-DVSDUFGPSA-N 492.013 0.982 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841353930 YCCKPVJASMRTLB-GVRJEKJASA-N 457.955 0.548 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1843886274 OSFWTYXMMMTWMF-IEBWSBKVSA-N 489.353 0.779 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1847007624 FMSWVWGYICALGC-FQEVSTJZSA-N 472.590 0.841 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)CC1 1847303824 BCUMBTBYBGKZFA-ROUUACIJSA-N 457.336 0.487 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1 1847502300 NSFDQCWRIOMKFY-YYFQZIEXSA-N 487.420 0.399 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl)C(C)C 1847565439 QZRRMTSSVFGLHV-VIQHNZTISA-N 472.970 0.160 50 20 JCGD CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)OCC(=O)NNC(=O)c1ccccc1)n2C 9093189 JTYWLYPWSROCNB-UHFFFAOYSA-N 487.538 0.761 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H]1CC=CCC1)c(=O)n2Cc1ccccc1 10161602 BMFIWQDKKGFVCG-SFHVURJKSA-N 480.525 0.558 50 20 JCGD C[C@@H](C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N1C(=O)NC2(CCCC2)C1=O 726523253 HGRHVSFOEPLZTG-AWEZNQCLSA-N 477.543 0.485 50 20 JCGD O=C(COC(=O)Cn1nc(-c2ccc(F)cc2)oc1=O)NNC(=O)[C@@H]1COc2ccccc2O1 749733285 NEWYFFJVFGYCIY-INIZCTEOSA-N 472.385 0.173 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](C)NS(=O)(=O)c2ccccc2F)n1 760005011 YNLPPIURVRLTJU-NSHDSACASA-N 458.493 0.191 50 20 JCGD C=CCNS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1 760947667 USQVODHBWZACIL-UHFFFAOYSA-N 452.514 0.463 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc(C)n1C)c(=O)n2Cc1ccccc1 789855564 RIKPWJVLIMNIPN-UHFFFAOYSA-N 463.498 0.536 50 20 JCGD CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 912852256 ZMBXWSSMTUPSOE-UHFFFAOYSA-N 457.509 0.444 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(O)c(O)c1)c(=O)n2Cc1ccccc1 916331674 JKOTXGOWABPZEB-UHFFFAOYSA-N 462.466 0.989 50 20 JCGD CO[C@H](C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O 917706999 GPORQCDJMYLNMU-QGZVFWFLSA-N 490.520 0.639 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1[C@]1(C)NC(=O)NC1=O 917713085 DOKFOFDWWIKTIU-NRFANRHFSA-N 469.479 0.921 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCOC1CCCC1 918084714 GCJIAOANCZHVFN-UHFFFAOYSA-N 468.576 0.930 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1)N[C@H]1CCS(=O)(=O)C1 919885924 PTFINKVODMKLCW-ZDUSSCGKSA-N 470.504 0.758 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)NCC1CC1 1317993923 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CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785592384 RNMJMBWJJVRGNA-DMEDLEQBSA-N 499.373 0.208 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)ccn1 1786980154 OUVKCBSPFBGFFM-JBACZVJFSA-N 465.359 0.966 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)OCCO4)C[C@@H]21 1787509017 PZOHDMUCMBRURN-WNFKGGOLSA-N 496.524 0.580 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3F)C[C@@H]21 1788609903 BVBSHAGMIAOCJP-KHDYIWLOSA-N 457.462 0.437 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)c3cnccn3)[C@H]2C1 1788705950 GMDBBSDOMXFWDT-JGFGOLAASA-N 482.379 0.748 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc2cc[nH]c2cc1F 1789251634 ROMHZIMIMOUOLK-BPXKWBHBSA-N 465.290 0.894 50 20 JCGD COc1cc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(F)c1 1790104612 BCJPZVZMCPRSJR-VHFSOBRXSA-N 474.269 0.560 50 20 JCGD 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SWWWIAMHBLBCCJ-MRAZWZEMSA-N 471.606 0.834 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1ccccn1)CCO2 1837741430 RVGSBPMLMDHYKC-UXWGWJTHSA-N 497.556 0.472 50 20 JCGD N=C(N)SCCC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837863874 SFLFULPGEVRUBK-UHFFFAOYSA-N 477.591 0.314 50 20 JCGD COc1ccnc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1OC 1837919152 KCOYNRQASPRTKW-UHFFFAOYSA-N 497.357 0.705 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838503548 ZWIPYFVPTCYUJW-JLTOFOAXSA-N 494.346 0.333 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054267 QGUQKSUALPJVJB-CVDCTZTESA-N 496.008 0.806 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839149853 UMNIRWKTTYOKEM-KPOBHBOGSA-N 498.404 0.565 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1839152063 MFUIMAOJHDLOCR-RTBURBONSA-N 452.379 0.401 50 20 JCGD CN(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1 1839201146 XMYXFRSAJKOTLD-CRAIPNDOSA-N 459.316 0.908 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)NC(=O)c3ccccn3)CCO2)C1 1839667774 IODPUMAKINTGSV-GCKMJXCFSA-N 497.390 0.830 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccccc1)CCO2 1840118239 RFIKGRBZBQLUCQ-HWBMXIPRSA-N 464.327 0.240 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)CC1 1840156357 NFHWSQHCLWCGSQ-UWJYYQICSA-N 475.970 0.565 50 20 JCGD Cc1ccccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840185517 RPZRWYRKCOUCKT-XMMPIXPASA-N 460.575 0.757 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cccnn3)CCO2)C1 1840409827 GMRUAYITBIEIAV-RDTXWAMCSA-N 457.325 0.485 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(CCN3CCCC3)nc1)C2 1844264146 KYCWHIKTWLWJGC-UHFFFAOYSA-N 477.569 0.849 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2 1844264671 VVYKJMVMXRBVOR-UHFFFAOYSA-N 468.426 0.453 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1848099821 XJBXHNCURSZISK-ULQDDVLXSA-N 465.743 0.314 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1 9931438 JLSQRHHODUZCSE-AWEZNQCLSA-N 495.535 0.454 50 20 JCGD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2cc(OC)cc(OC)c2)c1 16094825 FZRFRRXBHFVBNU-UHFFFAOYSA-N 452.441 0.900 50 20 JCGD C[C@@H]1Cc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc2N1S(C)(=O)=O 16594092 DNKBVEUZQOOZGE-CYBMUJFWSA-N 480.568 0.722 50 20 JCGD COc1ccc(CCN2C[C@@H](C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cc1OC 728179392 KHLCGCYIJABXTG-IRXDYDNUSA-N 453.561 0.587 50 20 JCGD COc1cc(OCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1[N+](=O)[O-] 728333780 SUPMUEJLOXHWPX-KRWDZBQOSA-N 461.383 0.513 50 20 JCGD O=C(CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)NNC(=O)Cc1cccnc1 728852817 ZJQUHBNKAHWNRG-UHFFFAOYSA-N 473.511 0.554 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)COc1ccc(N(C)S(=O)(=O)c2cccs2)cc1 729274929 HSOHRHTYZDKMDT-LBPRGKRZSA-N 490.585 0.037 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1 746387083 BXZLCXZYTOKVGF-CQSZACIVSA-N 469.336 0.156 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)cn1C 750664318 ZQWIIYZDQDSHJH-NSHDSACASA-N 488.364 0.774 50 20 JCGD N#Cc1ccccc1S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1 769199626 XDUTVQFWTQLWLF-UHFFFAOYSA-N 450.860 0.494 50 20 JCGD O=C(COC(=O)c1cccc(N2CCCS2(=O)=O)c1)NNC(=O)[C@H]1COc2ccccc2O1 830414084 AOIXAEVKZUFBNC-GOSISDBHSA-N 475.479 0.371 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc(Br)s3)cc2)CCN1 914462903 HKRAMVMTTVWHQQ-UHFFFAOYSA-N 487.357 0.706 50 20 JCGD O=C(NCCC(=O)N1CCOCC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 916251354 HONBOGGCMNFCII-UHFFFAOYSA-N 481.556 0.742 50 20 JCGD Cn1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc2c(=O)n3ccccc3nc21 917351884 KIFBCBLGWIPADH-QGZVFWFLSA-N 477.433 0.330 50 20 JCGD Cc1c(/C=C(/C#N)C(=O)Nc2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc(C#N)n1C 918132977 MAPSWLNOZDBHJQ-PXNMLYILSA-N 452.496 0.871 50 20 JCGD CS(=O)(=O)N1CCC[C@H](NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1 920239037 UIOLMASKQSKOGC-KRWDZBQOSA-N 498.565 0.813 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c[nH]c3nccc-3c2)C1 1777896708 BDODDPYYALVFJP-NTKDMRAZSA-N 477.525 0.954 50 20 JCGD O=C1CCCc2cc(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)ccc21 1777925588 PFONZUMATIBKNW-RUZDIDTESA-N 462.311 0.643 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2 1778091342 QIRYKDTUSVSACE-CXAGYDPISA-N 456.392 0.730 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=N/N3CCCCC3)C2)C1 1779017334 MYFMWZWSWZJZTE-YAEAXANISA-N 457.535 0.422 50 20 JCGD Cn1c(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc2ccccc21 1779029222 OFCOTXVKCGSWSB-VWLOTQADSA-N 476.537 0.863 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(O)cn1)C2 1779375370 MDPUKISGQOJPIG-AUSIDOKSSA-N 468.514 0.156 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccnc2C(N)=O)C1 1779940520 PUENGMIJXPNMKJ-VNBZBWLYSA-N 454.325 0.486 50 20 JCGD COc1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)cn1 1780970050 QOPNTYRJWYZZCJ-XMMPIXPASA-N 497.556 0.275 50 20 JCGD N#Cc1ccc2[nH]nc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)c2c1 1781204584 FQMPTTIOSQYVRP-PXDATVDWSA-N 487.325 0.556 50 20 JCGD COC(=O)N(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)Cc1ccccc1 1783687383 UPIGWUKYSJYHPZ-UWJYYQICSA-N 453.923 0.685 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)CCOC1 1784091990 BRQDYOYZNDFNAS-FKAQHNMISA-N 475.970 0.250 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)s1 1784688288 NDXZZKOXVIAMKL-GMKGHPLGSA-N 456.528 0.607 50 20 JCGD Cc1ncoc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786150816 OAWPUQLRPIEVTI-UFYCRDLUSA-N 484.557 0.923 50 20 JCGD COC(=O)CCCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786983126 KEECGCIDOQAWQQ-IHPCNDPISA-N 460.336 0.083 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(Cl)ccc3F)C[C@@H]21)c1cccc(B(O)O)c1 1786984583 PXYVVYOCBDPTTE-QRTARXTBSA-N 461.686 0.461 50 20 JCGD Cn1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)ccc1C(F)(F)F 1787743012 VRMFRDQGIRJLKA-NUTKFTJISA-N 494.474 0.950 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1n[nH]c2cc(Cl)ccc12 1788410102 CEEDFYYCLJNARU-DCPHZVHLSA-N 482.733 0.803 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3COc4ccccc4O3)C[C@@H]21 1788607904 UKMLSMKHIDYMSR-BXYJTDFISA-N 495.536 0.509 50 20 JCGD C[C@@H](Cc1ccco1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610918 DYRTZTGTWREKDI-SLUIBLPYSA-N 455.515 0.750 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCNC4=O)C[C@@H]21 1791058069 OKOUGUVETUDVFS-YXMPFFBPSA-N 454.325 0.003 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(O)c3)[C@H]2C1 1791109730 RQHSQDGGWACFKW-PSUWLIPFSA-N 454.487 0.515 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1792867873 NPTHFGXTADITBL-NJBDSQKTSA-N 475.365 0.072 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(Cl)c(F)c1)C2)c1ccc(B(O)O)cc1 1795732922 QTEZEOWKZGKRSV-USGNIVHTSA-N 476.697 0.441 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@H]1CC(=O)N(Cc2cccs2)C1 1796189877 KXCQHRBHZOKTDR-FFGOWVMKSA-N 481.383 0.728 50 20 JCGD COC(=O)CCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754384 UFVYFACTWFWIOF-YVWYUNDQSA-N 461.519 0.012 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(N3CCOCC3)cn1)C2 1798440596 DLDXSMZLOHMISG-BJWYYQGGSA-N 479.541 0.482 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(-c3ccccc3)c3c1COC3)C2 1801013422 VOKWYXQINDGMEG-GPVSGQMNSA-N 496.568 0.479 50 20 JCGD COc1ccc([C@H](O)C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1 1802799957 ZHJCFWCGCBWJNE-QDSKXPNFSA-N 489.337 0.823 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCNC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1804464567 XWUIGBBGBZFHBC-FDDCHVKYSA-N 483.573 0.609 50 20 JCGD C[C@](O)(C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(F)(F)F 1807360751 CWOBKQIWROARBU-MDYRTPRTSA-N 465.237 0.394 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807361006 NYJJRLXMTAQVKB-OZOXKJRCSA-N 462.319 0.009 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374036 WPQSHNPWVSBUIO-IKJKNFHUSA-N 490.369 0.482 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1812939036 JPEZIJPNXDHPLB-QKNQBKEWSA-N 487.981 0.383 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1 1813072200 BJPNAFRNDGATDQ-VGSWGCGISA-N 464.530 0.817 50 20 JCGD CCOc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1 1815355583 WOEDNNWVVODUJO-CQSZACIVSA-N 467.316 0.551 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)N2CCCC2)[nH]n1)c1ccc(B(O)O)cc1 1817470545 UXGMFXJMLWEJLT-IBGZPJMESA-N 467.335 0.798 50 20 JCGD CC(=O)O[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)C(C)C 1819481229 YIMPQLNMWPFGPR-YJBOKZPZSA-N 459.333 0.636 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(=O)Nc2cccnc2)n[nH]1 1819529772 VGEHHPCZLNVHSQ-QGZVFWFLSA-N 477.485 0.748 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797947 PGAPKPADIDKUKK-WDEREUQCSA-N 457.516 0.058 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3nc(O)n4c3CCCC4)sc2C1 1820239866 BYGFMYRDQGKNOP-GFCCVEGCSA-N 475.575 0.980 50 20 JCGD COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)nn1C 1820377206 ZMYVIQVCOYSRQX-QGZVFWFLSA-N 452.280 0.451 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnc4c(c3)CCNCC4)sc2C1 1824642928 AMZZXFKLUIVCFN-INIZCTEOSA-N 485.614 0.825 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)sc2C1 1825691415 YJCBVZMPQMSGLS-MSIPSHCFSA-N 456.528 0.935 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cn2ccccc2=O)CC1 1827096370 BXFXITMNMXCWBG-NRFANRHFSA-N 451.332 0.462 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1827561180 BVRJZBALPPIBAR-MSOLQXFVSA-N 459.551 0.365 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829049854 HRWWXQHYXVIIFN-UWJYYQICSA-N 453.352 0.528 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830719302 BUHPHRRFZSTQCL-AVYPCKFXSA-N 463.959 0.203 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(C)c1C(=O)O 1830735727 MGFDETLBVRVYQT-KKSFZXQISA-N 454.907 0.671 50 20 JCGD CCNC(=S)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831874101 AUVQOLBZDWGOFX-KRWDZBQOSA-N 454.641 0.463 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccc(C)n3)CCO2)C1 1832613892 HRQNACZVSAWIEV-GQUZIAHASA-N 496.568 0.913 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccn1C)CCO2)NC(=O)NCc1ccccc1 1833910380 IDMZWQZMXZZGBN-RUZDIDTESA-N 498.584 0.441 50 20 JCGD O=C(c1cnccc1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1834108676 HDIVHNICZFYORH-WMLDXEAASA-N 451.829 0.770 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](CN)c3ccccc3)CC2)CC1 1834758880 SSVSHNJIAUEXKG-JOCHJYFZSA-N 472.634 0.674 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3snnc3C3CC3)CC2)CC1)c1ccc(B(O)O)cc1 1834798646 UMLBWWIYCBFUCA-UHFFFAOYSA-N 483.403 0.594 50 20 JCGD NC[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccc1 1834801042 JQVWCCHUFQDPSK-DEOSSOPVSA-N 478.402 0.294 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cn[nH]c3)CC2)CC1 1835117854 RXGPZCQAJNINNG-JFLMPSFJSA-N 454.535 0.729 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835449740 QYDNOAWUPJCYKQ-VQIMIIECSA-N 462.385 0.339 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cc(Cl)n3)C2)C1 1835938101 LAZGKBMDHBOEFQ-NRFANRHFSA-N 494.140 0.452 50 20 JCGD CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1836395267 BLWGSTLPDMBNBJ-AWEZNQCLSA-N 450.931 0.015 50 20 JCGD O=C(NCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccs1 1837176017 UVKKUNNLUYUFJU-UHFFFAOYSA-N 499.398 0.470 50 20 JCGD CCn1nc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1C 1837921251 QJDQMFGKQWFVKO-UHFFFAOYSA-N 468.363 0.817 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ncccc1Br)CCO2 1838076097 YXIYRPZHLDEFFV-FQEVSTJZSA-N 498.378 0.287 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(-c4ccncn4)noc3C)CCO2)C1 1838492002 BHEJUOODJBNEOE-VFNWGFHPSA-N 479.921 0.764 50 20 JCGD CCCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1839013368 MAWRVASIYIRNTD-DEOSSOPVSA-N 476.574 0.918 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1839148678 GFLROBRBMXNGPY-FSNCLGKMSA-N 489.997 0.831 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cccc(F)c1F)CCO2 1839982827 DFMDKXQENMYIBP-JOCHJYFZSA-N 468.501 0.337 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1840035459 SAUIAMWENGPAIA-BTYIYWSLSA-N 481.391 0.623 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1 1840153136 FPBOHLLQKAYYLC-YCRPNKLZSA-N 467.906 0.341 50 20 JCGD Cc1cc(F)cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185132 KAGCBAAKWLBPDI-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187254 PIABXNBCHQLXPP-QHCPKHFHSA-N 480.537 0.206 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc31)CCO2 1840257497 XNWASMHHMQIAGO-DHLKQENFSA-N 464.327 0.166 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840391020 QCAYPTPNKDTKKS-GAJHUEQPSA-N 485.371 0.012 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)CN2C(=O)OC(C)(C)C)C1 1841434029 RGEPQUUHLFAWCU-INIZCTEOSA-N 465.551 0.141 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CC(F)(F)C(=O)O)C1)NC(=O)NCc1ccccc1 1843355669 QGOJXLUINDJQML-UHFFFAOYSA-N 467.473 0.646 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1847601521 OEZXXESZWKHHLC-UFYCRDLUSA-N 483.374 0.971 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)n1 728722178 MUZMYUMRNZWGCY-UHFFFAOYSA-N 458.518 0.668 50 20 JCGD CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(N2CCOCC2)c(F)c1 730571928 YXFZTHGJCVZDHD-UHFFFAOYSA-N 450.496 0.087 50 20 JCGD COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccn3C)CC2)cc1OC 747599360 UCZBHKURQSNOFW-UHFFFAOYSA-N 450.517 0.904 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1 748246455 LEESXNBBYMFBCB-GASCZTMLSA-N 466.560 0.745 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(CS(C)(=O)=O)c2)c1 749192017 NAFWZSIJFXQUPY-UHFFFAOYSA-N 468.557 0.626 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)c1 749851098 PKAYUYQGIQFAAS-UHFFFAOYSA-N 496.386 0.654 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=O)CNC(=O)c2ccco2)cc1 751204561 JHSPASIIKDGDTC-UHFFFAOYSA-N 450.517 0.820 50 20 JCGD CCc1ccc(C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1S(=O)(=O)N1CCOCC1 913660849 LNLHXUMSKHLMLA-UHFFFAOYSA-N 472.523 0.982 50 20 JCGD COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNc2nccc(OC)n2)c1 914763166 UZHVJRCUXIRYJI-UHFFFAOYSA-N 460.310 0.929 50 20 JCGD CN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2)CC1 916387905 LPHUSLHNWFHBGP-UHFFFAOYSA-N 473.603 0.871 50 20 JCGD C[C@@H](CN1CCCCC1)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916461504 HDYQCPJXEVPFRF-SFHVURJKSA-N 481.619 0.845 50 20 JCGD Cn1nc(C(=O)NNC(=O)CSCCOc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 918548780 LUWOWYZGEAFUPV-UHFFFAOYSA-N 491.551 0.154 50 20 JCGD CC(C)NC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Br 1318038095 UZOCFOVNXYORSG-CYBMUJFWSA-N 463.354 0.721 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(=O)n3[nH]nnc3n2)C1 1777823562 OPZZYOYYOKTCQZ-WHWRDJHUSA-N 482.339 0.114 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2 1779473111 JWCKRQZDLMUVFW-AQOAWAETSA-N 477.638 0.960 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Cn2cncn2)C1 1779497234 HJVYZFYYYPEOCD-NZWQFLGHSA-N 484.561 0.562 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ncccc3C(F)(F)F)C2)C1 1779708265 TWZKMGAGYWHDLB-FQEVSTJZSA-N 463.221 0.538 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)nn1 1779900226 MERFOXRGWWBNKM-XMMPIXPASA-N 497.556 0.275 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)N(C)C)C2 1780054316 KJGIXUBDJOMSAN-XMSQKQJNSA-N 476.486 0.736 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3cnc(O)[nH]3)CCO2)C1 1780097825 NBXBVGQZJLBIJZ-HXUWFJFHSA-N 459.415 0.706 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)CC(C)(C)O)CCO2)NC(=O)NCc1ccccc1 1780969863 KSEINUNZEIYMCH-HSZRJFAPSA-N 461.563 0.324 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc2c[nH]nc12 1781250439 RXNVDWXECINLJJ-PXDATVDWSA-N 476.342 0.992 50 20 JCGD Cc1cnn([C@H](C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1782512227 FXFXCDBPGMHIOC-HCLVMJGWSA-N 454.336 0.260 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c(C)c1 1783081411 AKZNWMIHFMPVHJ-ATIYNZHBSA-N 494.353 0.903 50 20 JCGD CCN1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)CC1 1783298814 SZZUSLFMIMJWNO-ZJSXRUAMSA-N 457.380 0.226 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3cc(C)c(O)nc3=O)CCO2)C1 1783354776 WORNWGJWGHPMFH-ACJLOTCBSA-N 457.325 0.261 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1 1783535028 VWDCQDCDEJESFA-ACJLOTCBSA-N 474.377 0.853 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c[nH]c1C 1783932882 IKPCUFQUQDCIDM-XMMPIXPASA-N 491.589 0.635 50 20 JCGD COc1ccc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)[nH]c2c1 1783935131 PKJDFNKTGZFECE-QHCPKHFHSA-N 457.531 0.993 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)C1 1783936963 BNNKTVBRLWYXIN-YVHKJVDXSA-N 452.552 0.169 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cc3cccc(F)c3)NC(C)=O)C2)C1 1785457850 FEAINMWDGPPXDX-CNNODRBYSA-N 469.941 0.957 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 1785531472 XURBDHUGNTUHTI-QFIPXVFZSA-N 486.460 0.419 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(-c4ccccc4)n3)C[C@@H]21)c1cccc(B(O)O)c1 1786984841 PARIGKHTWDNIBW-HARLFGEKSA-N 474.326 0.459 50 20 JCGD CCn1c(-n2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)cc2C)cccc1=O 1787153591 FCFQWYQGWYRTFX-DKKFBQAASA-N 491.976 0.555 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1788705928 DODRTGUNSVLTSU-YLXLXVFQSA-N 472.315 0.265 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCn3ccnn3)[C@H]2C1 1791646645 CNISGIJTCRLGHZ-QAETUUGQSA-N 484.985 0.780 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1COc2ccccc2O1 1793841811 YWXIYNVWVOMWTR-XNUXWRHASA-N 481.509 0.550 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cc([N+](=O)[O-])ccc1F)c1cccc(B(O)O)c1 1794060403 DQUWSGYNDJEKKT-BCDXTJNWSA-N 455.251 0.908 50 20 JCGD COC(=O)C12CCC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)(CC1)CC2 1797267856 DOZCFSRDWIQEFS-BIPWODODSA-N 499.568 0.402 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ncccn3n1)C2 1798522379 RZXIHGJEKVDPJK-ZSBFGKGUSA-N 495.452 0.475 50 20 JCGD CCNC(=S)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799869528 KMUWMMABQFKGII-REPLKXPHSA-N 489.646 0.455 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCS(=O)(=O)c1ccccc1)C2 1800975293 LTGJEZJILZYJCV-HIRMHNASSA-N 458.964 0.694 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc(C)s1 1801332007 FGBWRIMFZIONAR-UYNJTKMTSA-N 458.544 0.718 50 20 JCGD O=C(COc1cccnc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804332307 FCXGXWNLVAFQRN-WMZHIEFXSA-N 460.299 0.555 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)CCN3C(=O)C=CC3=O)C2)CC1 1806383698 HYQAALAIGHYNRN-YZSQISJMSA-N 482.541 0.667 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1807027540 YHPAJJIAANSKCH-YJBOKZPZSA-N 458.528 0.664 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360581 LHWTUXSCKZBZGM-MAUKXSAKSA-N 479.220 0.187 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CC[C@H]2CCOC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363771 BKVOOZNTKFZBMT-NYDSKATKSA-N 451.332 0.898 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807367997 PHADKTQGNRSVKT-XUZZJYLKSA-N 475.358 0.985 50 20 JCGD Cn1nc2c(c1C(=O)N1CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC1)CCC2 1809980759 RPEBXFLEYDRTCK-UHFFFAOYSA-N 450.348 0.747 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2ncnn2c1 1810053062 SEUQUVTXGYLYNP-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2)c1cc(=O)n2[nH]cnc2n1 1815330409 OGTYVMGWJKRGCM-KSBSHMNSSA-N 470.284 0.790 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CC(c3ccccc3)=NN1)CC2)c1cccc(B(O)O)c1 1815360217 QEPWOTHBKJPYQN-PXNSSMCTSA-N 489.366 0.815 50 20 JCGD CC(C)(C)n1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nn1 1815360782 NQSLEPFFAXOZPY-CQSZACIVSA-N 468.348 0.709 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnn3cccnc23)[nH]n1)c1ccc(B(O)O)cc1 1817471826 PVUDTRLYBVDVBX-GOSISDBHSA-N 459.275 0.752 50 20 JCGD COCc1oncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1818354506 KYKXVFXXNFCDKV-KRWDZBQOSA-N 453.264 0.844 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1 1819025837 QONYMZOFBQGGBE-NSHDSACASA-N 477.510 0.724 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2)n1ccccc1=O 1820128147 GVTHLAWDNLDLCX-OLZOCXBDSA-N 481.538 0.790 50 20 JCGD Cn1nc2c(c1C(=O)Nc1cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n1)CCC2 1821530134 VUSWXEWKHGVMJP-IBGZPJMESA-N 462.319 0.931 50 20 JCGD CC(=O)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)[nH]n1 1821946139 QHAZSZSGBWDWHN-LJQANCHMSA-N 484.561 0.884 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccnc2C(N)=O)[nH]n1 1822410659 NPSMHEHSBPBONE-OAHLLOKOSA-N 456.507 0.583 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)C(F)(F)F)n[nH]1 1822441323 LKCABIGMHPKNFG-CYBMUJFWSA-N 482.423 0.393 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CCN2CCOCC2)CC1 1826746002 WYRLCEJQAXKBMY-JOCHJYFZSA-N 457.380 0.322 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051472 YVQDCUSSEOYEFL-OAQYLSRUSA-N 454.380 0.882 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC[C@H]1C1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC1 1827056412 YLFRKJYFRHTBFB-INIZCTEOSA-N 488.243 0.955 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828926034 WTLXKNHGKKCMDP-GOSISDBHSA-N 465.576 0.353 50 20 JCGD O=C(COCCO)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829224043 YXWZXEYVLZAFAB-GCJKJVERSA-N 483.949 0.047 50 20 JCGD COC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1829937811 MZOOWWPYAOKUFT-XMMPIXPASA-N 491.589 0.214 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccc(Cl)cc1 1830261777 ZGMKTUHXDHVQDR-OSPHWJPCSA-N 486.761 0.894 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1830450312 QASHPNFITGGDPD-BVZFJXPGSA-N 482.342 0.249 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1830540367 PSTQJKZSZZCLMY-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD O=C(c1cc(Br)ccc1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830730646 BSYCUFXOHXHZKO-CRAIPNDOSA-N 477.739 0.824 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)nc1 1830733456 MWSORQNRPWBRLR-IIBYNOLFSA-N 455.939 0.604 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c[nH]c1C 1830940866 CYPJCEWZNHWDDQ-VGOFRKELSA-N 485.965 0.489 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)[C@@H]3SC(=N)NC3=O)C2)C1 1831646157 GHEWNQFDMXORLO-BZIRYSOJSA-N 460.984 0.653 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(Cl)c1 1832535511 NRVLZWZSANGQPJ-XLIONFOSSA-N 461.342 0.947 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832800615 VOZVVEWCINJACN-IRXDYDNUSA-N 464.306 0.484 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1 1833565437 LFAZUCQEDLXLTP-OXQOHEQNSA-N 473.979 0.714 50 20 JCGD O=C(CCc1ccco1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833841190 SVLIGAXCINYVFN-UHFFFAOYSA-N 453.348 0.777 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C[C@@H](NC)C(=O)O)CC2)CC1 1834740201 SGABUCDJKBQAAG-HZPDHXFCSA-N 461.401 0.794 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccncc3F)CC2)CC1)c1ccc(B(O)O)cc1 1834798543 JBAPWRWWBUEGND-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD CC(C)n1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834800212 YGWLSDOMFSLZJU-UHFFFAOYSA-N 468.367 0.038 50 20 JCGD O=C1CSc2ncc(C(=O)N3CCOC[C@]4(CN(C(=O)CCBr)CCO4)C3)cc2N1 1834825163 SNTLEQKKEJUFKG-IBGZPJMESA-N 499.387 0.981 50 20 JCGD Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)s1 1835258905 FJHWWRPCFYRENR-UHFFFAOYSA-N 471.587 0.949 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1cccnc1)CCO2 1835686501 DGZLCIJBOOLIHB-GTTVDESPSA-N 497.556 0.472 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(F)(F)F)C2)C1 1835929587 XJRVPTLFIJPYHD-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD O=C(c1ccc2ccoc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939293 KUPGSLHBBFXKBB-XMMPIXPASA-N 464.283 0.496 50 20 JCGD N#Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(C(F)(F)F)n1 1836320460 DKFBUQOMWGHBQT-KSSFIOAISA-N 476.839 0.642 50 20 JCGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(C(F)(F)F)o1 1836511228 SRGYDZZGGLVEMJ-BZNIZROVSA-N 455.817 0.672 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc12 1836919253 NSCUPQOJWOWYTA-XMMPIXPASA-N 471.558 0.919 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3)C2)C1)NC(=O)NCc1ccccc1 1839054095 GTNNVWANUFMFIB-VWLOTQADSA-N 496.568 0.498 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839139536 KNTOMRVASIJWNB-IBGZPJMESA-N 484.377 0.788 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1839148105 MVXSELRAKPVKGL-GCJKJVERSA-N 450.967 0.857 50 20 JCGD NC(=O)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802585 DEAKBOHYRSGBSC-OXJNMPFZSA-N 483.363 0.117 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1840038298 PBKSAHOIWLYCQD-QOKUDNMUSA-N 477.945 0.607 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840110944 NAIOOUSXSCMGFA-KXBFYZLASA-N 473.935 0.743 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])C2)C1 1840154427 WXQCTIPKHILHBU-VLIAUNLRSA-N 487.893 0.633 50 20 JCGD Cc1ccn2ncc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2c1 1840184263 YCOBOVCLCPKSQT-HSZRJFAPSA-N 472.546 0.086 50 20 JCGD Cc1cc(Cl)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840697872 XVDSOYHTKBJKGB-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1 1840855203 ABUHDQJSTWVOJQ-TXPKVOOTSA-N 462.385 0.921 50 20 JCGD O=C(c1cnc2ccc(Br)cn12)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011536 NEIJXCGDQQWFBW-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD CN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847563062 MDUIXYGFFWBUFB-UGUYLWEFSA-N 474.986 0.550 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnc(O)nc1O 1848100118 PBKXIIOZIPXBSG-AVGNSLFASA-N 455.899 0.835 50 20 JCGD O=C(COC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 9362712 XMIMCZXDPSAGOM-UHFFFAOYSA-N 490.494 1.000 50 20 JCGD O=C(Cn1nnc2ccccc2c1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 17633771 AVIABWCEJVMQDK-UHFFFAOYSA-N 481.476 0.955 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)CNC(=O)c1ccco1 725740828 ZGNCYDCAMBISBA-UHFFFAOYSA-N 478.405 0.424 50 20 JCGD O=C(CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)Nc1ccc(-n2cccn2)cc1 728961805 QIDFTDDKNPNSLD-UHFFFAOYSA-N 463.502 0.848 50 20 JCGD C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)CCOc3ccccc3)CC2)C[C@@H](C)O1 747104676 HCIOMERVFHKDSS-CALCHBBNSA-N 469.564 0.168 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)COc3ccc(Br)cc3)cnc2n(C)c1=O 861629347 PXOGJSQHLIJUFR-UHFFFAOYSA-N 462.260 0.235 50 20 JCGD O=C(CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 913606403 HXJHIXSZDXRCOZ-HDICACEKSA-N 476.555 0.797 50 20 JCGD Cc1nc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cs1 916254720 LXHZDARRDPDOAO-UHFFFAOYSA-N 453.546 0.659 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c2ccccc2c1=O 920030517 ZRDJKLUHKSDQIE-QTJNJRLBSA-N 488.504 0.498 50 20 JCGD COCCCNC(=O)NNC(=O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1Br 920862534 QPRKRONEBISACD-LBPRGKRZSA-N 493.380 0.887 50 20 JCGD Cc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1NS(C)(=O)=O 928993910 XSERDSKGEMEFEY-KRWDZBQOSA-N 463.468 0.511 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1nccc2nc[nH]c12 1777922623 CGDLQHMXPAETOM-WZONZLPQSA-N 463.303 0.079 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CSCc3[nH]cnc3C)C2)C1 1778912031 OJKLNMXGQFOJCJ-SYOQMXFQSA-N 487.586 0.915 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)c21 1779996530 CBXPKPGZVUBAGQ-CJFMBICVSA-N 492.341 0.400 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780095606 URFAMIUXHRNICM-FUMRIQNTSA-N 486.481 0.822 50 20 JCGD O=C([C@H]1CCc2nc(O)nc(O)c2C1)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781326972 VPEPTUOVYXCAPA-OGJWQKAUSA-N 473.299 0.513 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2 1782212118 WAEQNODRNPTIOQ-HOYKHHGWSA-N 486.573 0.467 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21 1783847122 HZUICGVMMYGHAW-GCPWLZLNSA-N 491.661 0.997 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)CCO2 1783870786 GFUIDSHVDZZUBJ-MDOVXXIYSA-N 463.959 0.346 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1C 1783934264 CAFIMSRMRFRXGP-HSZRJFAPSA-N 459.547 0.770 50 20 JCGD C[C@H](CC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)NC(=O)OC(C)(C)C 1783935574 VSEPWMWHLYPVBD-ZHRRBRCNSA-N 469.583 0.493 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1NC(C)=O 1783935742 WGJRRFTWCYSKDF-HSZRJFAPSA-N 475.546 0.470 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1csc(C(F)(F)F)n1)CCO2 1783936017 ZVDWTVBZZIOWPW-QGZVFWFLSA-N 463.482 0.978 50 20 JCGD O=C(CSc1ccncc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785159155 ALLSOGNPEHIDTR-VDGAXYAQSA-N 455.345 0.147 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCC3=O)[C@H]2C1 1786730548 CHBZSYCDNUMKIC-QAETUUGQSA-N 486.997 0.721 50 20 JCGD COc1cc(C)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981914 GLKGYSMEIBRRIO-XJABCFGWSA-N 452.316 0.591 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1 1787449110 NDYYOSHLYWDHNK-RGHULWKBSA-N 451.923 0.776 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)[C@@H]3SC(=N)NC3=O)[C@H]2C1 1787499782 ZALWZJZZWABPMW-ORWNZLQRSA-N 475.409 0.942 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc2ncncc2c1 1788379040 ZCUYGKJPCYJYNK-XJABCFGWSA-N 460.299 0.217 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4[C@H]3O)C[C@@H]21 1788607766 FVSYQSTUZYRKJS-NGVXDUQMSA-N 493.564 0.574 50 20 JCGD 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2ccc(O)nn2)C1 1781466955 ULDPDSIDQXZYCK-CAAOGRNVSA-N 497.556 0.763 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1781901125 HTHDWAOXWOMABM-RZQQEMMASA-N 482.379 0.986 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781998437 UMFWWCOUBJOHOT-VVFCZOMOSA-N 453.142 0.277 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1 1782839737 TZCPGBMWCCZJLU-CVDCTZTESA-N 450.499 0.165 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F 1783937429 LDXVDJGXXRCBAD-JOCHJYFZSA-N 450.511 0.580 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784096619 IVIZMQJJJBNRSV-QXKUPLGCSA-N 491.969 0.022 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)ccnc3Cl)[C@H]2C1 1785483503 XASVMWKHPBWGMU-YDHLFZDLSA-N 455.918 0.840 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cnc3Cl)C[C@@H]21)c1cccc(B(O)O)c1 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459.971 0.986 50 20 JCGD O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1793866781 UWPHXYMSLJQDJQ-CSHUHZATSA-N 463.918 0.252 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)CCBr)C2 1795116402 FYJNAKSLUFGXHC-ZXFNITATSA-N 497.390 0.997 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)C1 1795732765 HEKGZIKFKJSAQC-CEQLMSFQSA-N 499.373 0.137 50 20 JCGD COc1cccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1 1795741227 NTAUCUXTKXPYBR-BAHCYQSUSA-N 450.300 0.292 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1796443884 PIQSQBJCYXAMET-YOSNBGTRSA-N 458.288 0.401 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1ON=C(c2ccccc2)O1 1797641312 BNZITNWYIOHSJF-COIWVXNHSA-N 494.508 0.445 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)[C@H](C)O2 1798584146 DJVJFLWPPXHWIO-VGXVWSLXSA-N 451.907 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COCc1oncc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1808824248 XHMSCLGOXSTGGM-IERDGZPVSA-N 458.519 0.909 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCCNC3=O)[C@H]1c1cccnc1 1809680046 KJNZWPRBGCKXNT-TXPKVOOTSA-N 474.949 0.985 50 20 JCGD O=C(CCC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)N1CCCC1 1809969347 RJLCQNUIOFOOBF-UHFFFAOYSA-N 455.364 0.614 50 20 JCGD COCC1(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1810293595 GAETZZNMJCAAGX-VQIMIIECSA-N 452.515 0.826 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(=O)oc2)[C@H]1c1cccnc1 1810297114 AMHCXOCWCUUZJI-QRWLVFNGSA-N 462.466 0.667 50 20 JCGD NC(=O)c1ccccc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1811278953 BTTBDBIDLXCVPY-GCJKJVERSA-N 472.310 0.494 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCNC3=O)[C@@H]1c1cccnc1 1813029757 WOJWJHSFHJKDKN-RVKKMQEKSA-N 460.922 0.595 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813072322 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CN1CCN(C2(C(=O)N3CCO[C@@]4(COCCN(C(=O)CO[Si](C)(C)C)C4)C3)CC2)CC1 1839107041 PMDWGULKOAFUDU-OAQYLSRUSA-N 468.671 0.074 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CS(C)(=O)=O)nc3)C2)C1 1839144360 WFGLMYMPQCJTDE-FXAWDEMLSA-N 473.979 0.714 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1839173550 XXAQYLQFLNKLBL-HNAYVOBHSA-N 461.353 0.983 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCOCC3)C2)C1 1839743497 UNTWWWWBIVWJPK-XFWAWQDHSA-N 490.507 0.660 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1 1840032888 MTTLBFVXCJPALB-QKKBWIMNSA-N 493.358 0.787 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1840035411 QJCFUJMVQCTBHI-ADLMAVQZSA-N 459.293 0.657 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccncc34)C2)C1 1840184865 DJLIJWAQKVXPAR-DEOSSOPVSA-N 469.542 0.678 50 20 JCGD COc1ccc(F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840688983 CGGBTNRSGXVPKQ-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CCCN(c3cc(NC4CC4)ncn3)C1)C2 1846385481 LMYQORPIYVUZIT-GOSISDBHSA-N 498.632 0.844 50 20 JCGD CCn1nc(C(=O)NNC(=O)Cn2c(=O)n(CC)c(=O)c3ccccc32)c2ccccc2c1=O 17190676 NHPXVDZPLUQKFY-UHFFFAOYSA-N 462.466 0.374 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)c2ccccn2)c1OC 27339631 DDSDHCWDFPZTTL-UHFFFAOYSA-N 450.473 0.195 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(C(=O)OC)s1 726520066 WGRBVUIVNQGKSC-UHFFFAOYSA-N 476.510 0.348 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=S)NCCc3cccs3)cnc21 727176109 LLGMIIARCKJUOI-UHFFFAOYSA-N 470.378 0.692 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])N[C@H]1CCS(=O)(=O)C1 728505512 KBVVSQAPZGHMCR-QMMMGPOBSA-N 457.284 0.037 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CCCn1cccn1)N(S(C)(=O)=O)CC2 748834388 HZWDIHRGMFDCRV-KRWDZBQOSA-N 479.559 0.777 50 20 JCGD O=C(COC(=O)CCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)[C@H]1COc2ccccc2O1 762407891 MAWBTOSOZNSYEV-HXUWFJFHSA-N 470.434 0.951 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C\c1ccco1)c(=O)n2Cc1ccccc1 901374716 BNJJXDONABOZHC-KHPPLWFESA-N 462.466 0.882 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccccc1 914781440 FISRBTOPFKQUOQ-UHFFFAOYSA-N 453.546 0.370 50 20 JCGD CC(=NNC(=O)Cn1nnc(-c2ccccc2)n1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1 915906797 AVDOJLRPJMUCGI-UHFFFAOYSA-N 471.499 0.634 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C(=O)Nc1ccccc1)c(=O)n2Cc1ccccc1 918017420 UUWBUHUXURKYRR-UHFFFAOYSA-N 489.492 0.214 50 20 JCGD C[C@]1(NNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)CCS(=O)(=O)C1 918093690 KKOKVNRVSLHUAI-FQEVSTJZSA-N 453.565 0.228 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1ccc(F)cc1Br 918341648 TZNLLWCWNUMLHQ-ONGXEEELSA-N 462.297 0.385 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778090962 JDMSTNPEFOGBPO-ZVJVYNAXSA-N 472.546 0.325 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1OC 1779037337 WLIPFUUHNUVBFK-XMMPIXPASA-N 483.525 0.768 50 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N[C@@H](Cc1cccnc1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474877 INFSLNKPCKMQPF-ICSRJNTNSA-N 462.319 0.360 50 20 JCGD O=C(/C=C\C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)NC1CC1 1817476477 TVVVDVUPAWDFRH-HJCTWCACSA-N 451.292 0.230 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnnn1C)CC2)NC(=O)NCc1ccccc1 1822518319 JHLMQBDXLAAUEI-OAHLLOKOSA-N 497.585 0.844 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)nc3cccnn13)CC2 1826088438 XTQOLZJOZRQHCY-LBPRGKRZSA-N 484.542 0.145 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1827030293 CKBYOKFUXWDSJN-BLLLJJGKSA-N 453.333 0.815 50 20 JCGD O=C(c1cnn2ccncc12)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059026 DJGPFCCDZMDQCG-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cn3ncccc3n2)CC1 1828261114 LHIANARUQYNYQX-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD COCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCN2C(=O)OCc1ccccc1 1829000881 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CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(C(F)F)c1)CCO2 1833324011 JTIOISYJJBMPEC-OAQYLSRUSA-N 469.489 0.462 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CNc3ccc(F)cc3)CC2)CC1)c1cccc(B(O)O)c1 1834801134 QZDWNTLMIAICDC-UHFFFAOYSA-N 482.365 0.803 50 20 JCGD O=C1CSc2ncc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCBr)CCO4)C3)cc2N1 1834825182 SNTLEQKKEJUFKG-LJQANCHMSA-N 499.387 0.981 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)cco3)CC2)CC1 1835118355 SPZHFZJHKFWJLT-JVWAILMASA-N 482.541 0.959 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cnoc3)CC2)CC1 1835150184 WFHPTELKLCOCFI-CVKSISIWSA-N 455.519 0.994 50 20 JCGD Nc1n[nH]c(CCC(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Br)CC3)CC2)n1 1835668372 NUIMXPNEPUBYGV-OAHLLOKOSA-N 460.352 0.582 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)c3ccccc3)CC2)CC1 1835736979 OSRDVLGWMPKVFD-JOCHJYFZSA-N 480.569 0.604 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1nc(O)n2c1CCCC2 1835852282 OZPDHBNZXPVWTE-UHFFFAOYSA-N 495.389 0.104 50 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CUDCTDUVDQQERI-IFXJQAMLSA-N 456.883 0.622 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C2)C1 1840154341 TVDWFYVOBGXGMH-GAJHUEQPSA-N 489.960 0.894 50 20 JCGD CC(C)COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccn1 1840183960 KNMNKTYXQRCWHA-DEOSSOPVSA-N 491.589 0.559 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4ccccc34)C2)C1 1840184282 GQRNZFRBEPMTNQ-XMMPIXPASA-N 469.542 0.678 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1844156479 GJRAYWIONXTUKC-STQMWFEESA-N 462.931 0.386 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C[C@H]2C[C@H]21 1844265557 OIRZSKSSFQOWMP-OLMNPRSZSA-N 484.557 0.900 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@H]1CCC(=O)NC1)C2)NC(=O)NCc1ccccc1 1845038271 LGRNSANTTWLFRB-SFHVURJKSA-N 456.547 0.062 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@]1(C)CN(C(=O)OC(C)(C)C)CC[C@@H]1O)C2 1846383539 IPSSQTCYYUPIMJ-GAJHUEQPSA-N 495.621 0.571 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCC2(CN(C(=O)OC(C)(C)C)C2)O1 1847289111 XVSHMDNYFSZKGW-BZSNNMDCSA-N 493.605 0.730 50 20 JCGD COC(=O)c1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)s1 27805612 ZZJKIRDLCYSFST-UHFFFAOYSA-N 481.552 0.949 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(CC(=O)NC2CCCCC2)CC1 728597999 YRZLZUIUMNITKU-UHFFFAOYSA-N 450.565 0.285 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2C[C@@H](O)CN2C(=O)c2ccc(F)cc2)n1 728730624 SRRXPWOXJGYANP-CABCVRRESA-N 464.475 0.099 50 20 JCGD COc1cccc(/C=C(/C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n2nnnc2C)c1 728847654 JOQSMQGWLPSEOK-RGEXLXHISA-N 463.502 0.842 50 20 JCGD CCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)OCC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 730006919 HRGRDZXOTSSOEF-HSZRJFAPSA-N 495.448 0.898 50 20 JCGD CN(C)C(=O)Cn1cc(C(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)nn1 747785607 WGFDPTKAVBWNKO-OAQYLSRUSA-N 461.526 0.754 50 20 JCGD CCc1ccccc1OCC(=O)NNC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1 747862330 GLSYYKBHHSAROV-UHFFFAOYSA-N 463.560 0.918 50 20 JCGD O=C(COC(=O)c1ccccc1NC(=O)Cn1cnnn1)NNC(=O)c1ccc(Cl)cc1 749279873 QSZGEOBJBSNQCS-UHFFFAOYSA-N 457.834 0.583 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CCc3ccccc3)cc2)CC1 749803526 DLKGDYXPZQFNHT-UHFFFAOYSA-N 458.540 0.933 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)CS(=O)(=O)Cc1cccc(Br)c1 751203183 KMZYHXOEDCCWAE-UHFFFAOYSA-N 458.290 0.534 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2CCN(c3ccc4nncn4n3)CC2)c1 913465529 KSCMMVZNBLNNSD-UHFFFAOYSA-N 472.531 0.052 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(C)c(=O)nc2O)c1 916095744 QWSAPFXNJWTQJT-UHFFFAOYSA-N 473.467 0.370 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCc1cccnc1)N(S(C)(=O)=O)CC2 916262638 LZLYEXOZKQRONY-GOSISDBHSA-N 491.570 0.921 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)n1 918552013 SVSSCXZCYHWNBW-OAHLLOKOSA-N 461.500 0.285 50 20 JCGD Cc1ccc(CNC(=O)N[C@@H](CC(C)C)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 919888441 CRKBHFBEAIHQDX-IRXDYDNUSA-N 453.565 0.726 50 20 JCGD CN1C(=O)C(=CNNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)C(=O)N(C)C1=O 920978027 QJTCEYLFUNHZNG-UHFFFAOYSA-N 471.495 0.334 50 20 JCGD CC(C)Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)n(C)n1 1777766264 QCNSXOXIXYNUIN-RCZVLFRGSA-N 482.390 0.740 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1c[nH]c2ncccc12 1778519276 NRGCJPJKKPLWIJ-HYBUGGRVSA-N 462.315 0.684 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)C[C@@H]3COc4ccccc4O3)CCO2)C1 1779028314 CTHDEHSPSRAKFK-GYCJOSAFSA-N 481.509 0.359 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](COC(C)=O)OC(C)=O)C2)C1 1779076510 NEYONWZWCPLPSZ-MPGHIAIKSA-N 463.325 0.485 50 20 JCGD C[Si](C)(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)co1 1779351143 WQQFOSJAEHFSET-HYBUGGRVSA-N 484.434 0.946 50 20 JCGD Cc1nc(F)ccc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372673 VGQIRDYRRXFYAA-WZONZLPQSA-N 470.505 0.969 50 20 JCGD Cc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)s1 1779373128 DPNDQTPHFBAKCA-DYESRHJHSA-N 458.544 0.891 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779564983 YOXGOZJQCUFWSK-SWWFSWNPSA-N 481.557 0.708 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C2)C1 1780037036 FHBKERNPQFTOIU-DEOSSOPVSA-N 481.557 0.387 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)[C@H]1SC(=N)NC1=O 1780773112 CQNHDTVQTMILDH-INABMFAFSA-N 479.372 0.993 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968154 AXNOHNYGWQZCFA-NLFFAJNJSA-N 497.600 0.695 50 20 JCGD O=C([C@H]1CCc2nc(O)nc(O)c2C1)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781326967 VPEPTUOVYXCAPA-IMQJOWEQSA-N 473.299 0.513 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)C1 1782169685 RPKBRGHDTNVEAC-PFBKUSTMSA-N 486.374 0.473 50 20 JCGD O=C(/C=C/c1ccc(O)c(O)c1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1783218279 IUOVQERMONFEQL-MNCAVIKISA-N 454.907 0.930 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1O 1783786011 NYFRQBSNZFMNRD-ZWOKBUDYSA-N 462.547 0.296 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCN3C(=O)Cc4ccccc4C3=O)CCO2)C1 1783870479 CIXRNCKWQOZROC-JPYJTQIMSA-N 477.945 0.685 50 20 JCGD C[C@H](NC=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785079559 POXMBOWGOXMCRF-QXKUPLGCSA-N 460.959 0.233 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3CCN(C(=O)OC(C)(C)C)CC3=O)C2)C1 1785669856 QHOHJZDUMPZGOV-OPAMFIHVSA-N 486.997 0.913 50 20 JCGD CCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786501543 MUFKFQQIBIDNRP-UFYCRDLUSA-N 461.563 0.349 50 20 JCGD COc1ccc2c(CC(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)c[nH]c2c1 1786982827 IPFYDCHKJUFKLT-OWSXEPHWSA-N 491.353 0.692 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCC4)C[C@@H]21 1787508393 HSAHMXNNVIETKY-HBBIPVJPSA-N 481.557 0.947 50 20 JCGD O=C(CCCCn1cccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788711828 SBCYSSFJPFYDKI-BVSLBCMMSA-N 453.348 0.632 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-n4ccnc4)ccn3)[C@H]2C1 1789372343 QNSFXICYFCOSGI-ZRCAFCQKSA-N 490.524 0.173 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1789694298 CZSNXOWWIIJVHF-PPIXQQLYSA-N 455.914 0.523 50 20 JCGD COc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1OC 1790159000 OQWKMYLBNMPXCG-KNBMTAEXSA-N 486.305 0.430 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCN(C)CC3)C[C@@H]21 1790961795 QVLOGWDQWDIQSO-XSLAGTTESA-N 459.429 0.777 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)c3ccccc3)C[C@@H]21 1791292400 OYSZSUSDXFPEAL-UFYCRDLUSA-N 473.574 0.159 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(Cc3cccs3)C1)C2)[C@H](O)CCl 1792975326 NVIYREIXKXYZOQ-ARULTKQDSA-N 455.964 0.286 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732514 ODOLKZOFUPTOCU-OPMZPASUSA-N 490.325 0.083 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)C2)c1ccc(B(O)O)cc1 1795734244 KYFIJXGKIGSHLP-WEUCMPTNSA-N 464.352 0.458 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(C)c1C(F)(F)F)C2 1796440258 JRPJRIHJDBBVJN-JXUYHFQDSA-N 495.462 0.776 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccn(-c2ccccc2)n1 1798698876 NECMWLJYXMQUMU-OPMZPASUSA-N 460.299 0.069 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799865666 HBMBROGPFXGFJY-FFGOWVMKSA-N 493.630 0.652 50 20 JCGD COc1cccc2[nH]cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)c12 1800002740 KFCLXKHKGOFITH-MFKICJERSA-N 463.299 0.373 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1800788556 WOCONCKKDUINRB-GBTLNWJISA-N 475.945 0.869 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc([N+](=O)[O-])c(OC)c1)C2 1800977743 WWFDJDGZIFRGCZ-NXEZDXNNSA-N 455.895 0.989 50 20 JCGD C=C1C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)N(C(=O)OC(C)(C)C)C1 1801102052 ZHOMJQDQCVWGQX-NNXHMXCWSA-N 457.955 0.741 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1Cl 1801199439 IRFHPXLLEHJGFW-JSVGYJQLSA-N 473.917 0.275 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc([N+](=O)[O-])o1 1802258367 DOYZSXUBAWRBSR-OXQOHEQNSA-N 464.243 0.896 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368249 RBZAXXXMINAQRR-WZONZLPQSA-N 460.299 0.424 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(Cl)ncn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374504 HOZVDWBNCYKZQT-OXQOHEQNSA-N 465.706 0.838 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1808409909 WLUQUXIZPAXUGC-LZLYRXPVSA-N 458.968 0.113 50 20 JCGD CN(CC(=O)N1CCC2(CCCN(C(=O)CNC(=N)N)C2)CC1)NC(=O)NCc1ccccc1 1809690534 GPMJVLZVOIRXFZ-UHFFFAOYSA-N 472.594 0.047 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1 1810948609 PVVVKNJRUQZMSG-ATCQHKGGSA-N 464.486 0.964 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1 1813070951 ONRHEVUTOPABOS-VGOFRKELSA-N 464.530 0.817 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCNC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1813071873 ZGIHRHAPCJXJEN-FDDCHVKYSA-N 483.573 0.609 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1813073052 FLMRSMOSIMXMKX-MGPUTAFESA-N 492.627 0.321 50 20 JCGD O=C(COC(=O)C(F)(F)F)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343986 AGNFWLBQSVSIDW-LLVKDONJSA-N 471.222 0.154 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCCO3)[nH]n1)c1ccc(B(O)O)cc1 1817471356 FXUQAVNXWLAWPO-SFHVURJKSA-N 464.291 0.688 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)CN)n[nH]1 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456.396 0.038 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1834797162 CKNIWVZMCMVQAV-HXUWFJFHSA-N 484.388 0.839 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798308 GHUXZCVHBYLXGR-NRFANRHFSA-N 470.206 0.788 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccncc3Cl)CC2)CC1)c1ccc(B(O)O)cc1 1834798313 GPCPDVSPIPPMSQ-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1 1835081393 OLKWOOMQRCWCKX-HOCLYGCPSA-N 450.939 0.936 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCN(C)CC3)CCO2)C1 1835404720 LGXWILBYLWDXTE-XLIONFOSSA-N 475.428 0.254 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(=O)CNC(=N)N)CC2)CC1 1836107350 BVUDPDVNYLEJNF-UHFFFAOYSA-N 489.533 0.188 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cccn3)CCO2)C1 1836169042 YSNOCPNDGYREHE-QFIPXVFZSA-N 487.469 0.487 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836577872 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0.353 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc4c3CCCO4)C[C@@H]21 1788610238 LVRYVWXDGZQPCL-IXDGSTSKSA-N 485.566 0.979 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1 1789221990 ZJVDIFHMSCLQLF-IBBHNLMTSA-N 476.486 0.638 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1790684594 UNUIXMAVXOODRA-ROUNMYMPSA-N 464.872 0.723 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1792322903 PVBOFCIUJQUTDK-XQLPTFJDSA-N 463.934 0.525 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2 1792868364 WRYXNNFBWBBECT-JJAZEVLHSA-N 488.404 0.860 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc(C(F)(F)F)n1 1792980564 LRQBMFFIYFLJSX-NWJSVONSSA-N 451.829 0.912 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792982988 XPGXHCQWMKIREV-RGHULWKBSA-N 459.927 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COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)n(C)n1 1825475660 FHLMYTDPDYOSJO-SFHVURJKSA-N 469.546 0.974 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCCNC3=O)CC2 1826000136 MKJMIMPHYSYSGQ-QWRGUYRKSA-N 466.951 0.953 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060203 BUTPWCIECKGCCP-PKTZIBPZSA-N 495.389 0.070 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)no1 1827660335 MRNIYLYQRCFTDY-FQEVSTJZSA-N 482.346 0.925 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1830543204 MKEGSVPFXKYNBV-ORAYPTAESA-N 499.387 0.857 50 20 JCGD Cc1c(Br)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)nn1C 1830730951 GUCPDQXLAGRSJH-SJCJKPOMSA-N 479.759 0.161 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1[N+](=O)[O-] 1830733352 JQSGXIYLGWYJNS-XLIONFOSSA-N 455.895 0.502 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1830886933 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CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)c(O)cc1O)CCO2 1839253731 ZQVNIFGQLKQOND-NRFANRHFSA-N 484.937 0.194 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1)n1cnnn1 1839743805 WTXRJYSHAXKVET-DHJRUUKHSA-N 487.467 0.576 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccnc(OC)c3)C2)C1 1840150052 DYUKMIBOWJIYLG-DYESRHJHSA-N 455.939 0.733 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1 1840152264 CWLSQNJFHDHUQJ-DXIQSLLYSA-N 451.951 0.411 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCOC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1840190698 IMVBWIXMGVMZEA-WOJBJXKFSA-N 496.388 0.618 50 20 JCGD Cc1cc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1F 1840708248 XWGHJOBXKJPQBO-HSZRJFAPSA-N 489.479 0.656 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CN2CCc3sccc3C2)C1 1841934776 WFEFYCFGDNHJQP-UHFFFAOYSA-N 454.556 0.622 50 20 JCGD COc1ccc(CC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c([N+](=O)[O-])c1 1845259753 CHEAYJBBLRIGFU-UHFFFAOYSA-N 453.260 0.343 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)c1ccco1)NC(=O)NCc1ccccc1 1847279769 YUVSIGOATXHTDV-WFXMLNOXSA-N 455.515 0.861 50 20 JCGD CN1N=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCC1=O 1848045238 DDAXJAASEHOYTM-KKUMJFAQSA-N 455.943 0.929 50 20 JCGD COc1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1 10372718 KPPPJKZCAPELBR-UHFFFAOYSA-N 473.511 0.794 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(S(=O)(=O)N2CCOCC2)c1 12802988 RWXGYCZQBZHUFM-UHFFFAOYSA-N 481.556 0.075 50 20 JCGD CN1C(=O)Cc2cc(S(=O)(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)ccc21 12969436 RMCFSWCRLZSCKJ-UHFFFAOYSA-N 458.905 0.130 50 20 JCGD COc1ccccc1NC(=O)COc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1OC 16785792 ZBFZGXIAYDVQLB-OAHLLOKOSA-N 491.522 0.917 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN/C=C1/C(=O)NC(=O)c2ccccc21 29184905 MFHRIFDXXAXZKU-HMMYKYKNSA-N 484.534 0.572 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H]1CCCOC1)c(=O)n2Cc1ccccc1 727724021 HTFKAYQBVBHWIB-INIZCTEOSA-N 454.487 0.002 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)n1 728723464 RJVLEDXBRQPEQU-UHFFFAOYSA-N 481.556 0.181 50 20 JCGD Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc(C3CC3)nc21 728890081 VKPKFNBZKKSZGM-UHFFFAOYSA-N 464.486 0.379 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1)C(=O)N1CCCC1 748247746 SMPROUCAYUQXDX-UHFFFAOYSA-N 462.553 0.879 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)CNC(=O)c2cccs2)c1 751209901 XNWUYQAHTOJQSD-UHFFFAOYSA-N 468.557 0.978 50 20 JCGD O=C(CSc1nnnn1C1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 849129203 FAYAUHDRJQOVDS-UHFFFAOYSA-N 451.534 0.346 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(-c2ccco2)nc2c(C(N)=O)ncn12 913081768 FRTAAQTYOFCRAI-UHFFFAOYSA-N 496.509 0.765 50 20 JCGD Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1 914536226 MSPOZNLZMSWZNX-UHFFFAOYSA-N 458.500 0.809 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1 915165760 KOWIHTFHIVAXSQ-UHFFFAOYSA-N 455.489 0.745 50 20 JCGD COc1ccc(OCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 916214637 RVHONBHHTDJUBC-UHFFFAOYSA-N 478.527 0.739 50 20 JCGD O=C(NCc1cccnc1N1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916400245 YKVJHYWEVGUHJE-UHFFFAOYSA-N 488.570 0.847 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCC(=O)N[C@@H]1CCS(=O)(=O)C1 916635995 LNICPQPKFXIWPA-WCQYABFASA-N 491.364 0.240 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)COc3ccc(F)cc3)CC2)cc1 917917554 XJFLGQLQTBNRNY-UHFFFAOYSA-N 464.519 0.667 50 20 JCGD CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1 918223835 OCRRHNJZGKXYQF-UHFFFAOYSA-N 452.471 0.545 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)c3ccc(COc4ccccc4)o3)n(C)c2n(C)c1=O 919691872 VQXYHHGJUGKSCG-UHFFFAOYSA-N 451.439 0.823 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 919822763 IAFDKYPCCLPEMI-QGZVFWFLSA-N 483.568 0.167 50 20 JCGD Cc1cc(=O)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nn1-c1cccc(C(F)(F)F)c1 919885190 NKJGSZCHCOPRII-GFCCVEGCSA-N 473.433 0.691 50 20 JCGD Cc1ccc2cc(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)ccc2n1 1777906052 ABVCIXGTFWNFKW-VWLOTQADSA-N 459.311 0.980 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CCn3c(=O)oc4ccccc43)CCO2)C1 1779029536 YTSRIJIUUVAYOF-DEOSSOPVSA-N 494.508 0.127 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2 1779370973 ABZNYRPIOKEDLE-DNVCBOLYSA-N 468.352 0.598 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[S@@](=O)c1ccccc1 1781500945 RPMPZQFIVPOADB-YJBHOBEYSA-N 498.410 0.690 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)C2 1781905216 KQIYIAAPLQGCIY-SNUQEOBHSA-N 462.341 0.217 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nn[nH]c3c1)C2 1782213214 DCBSYFTXULRJFG-XMSQKQJNSA-N 457.535 0.458 50 20 JCGD CCOc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1783389725 XSAVWNYLJAVXOU-VDGAXYAQSA-N 453.304 0.067 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2 1783940124 RISVKBQKBIHBEX-OAQYLSRUSA-N 467.567 0.247 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)[C@H]2C1 1783996395 YRHBRLYHZTVYBV-QXKUPLGCSA-N 463.959 0.106 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCc3ccncc3)[C@H]2C1 1785355628 CARMRBBZJYSFIE-YYWHXJBOSA-N 466.542 0.696 50 20 JCGD O=C(CCN1C(=O)C=CC1=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1786553389 CZYVFALZRSAGHS-UHFFFAOYSA-N 461.283 0.429 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1 1786979531 VTFJTCGUUHAOHN-VJBMBRPKSA-N 466.343 0.601 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1 1786982884 BYVLPFOQYZXIBI-OYDLWJJNSA-N 479.386 0.659 50 20 JCGD O=C(NC1(c2ccc(NC(=O)c3cc4n(n3)CCNC4=O)cc2)CCC1)c1cccc(B(O)O)c1 1787570562 DOBXGWSHLXBJFE-UHFFFAOYSA-N 473.298 0.368 50 20 JCGD COc1cc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1OC 1788609765 IAMRDSFGPIPPLM-OHEPNIRZSA-N 497.552 0.918 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccn3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726703 OEEUVGSFVLPMOI-PMVMPFDFSA-N 494.596 0.950 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1n[nH]c2c(Cl)cccc12 1790339870 QFXBVTWTMGPUGD-FNHZYXHNSA-N 482.733 0.803 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C[C@@H]21 1791256414 QCSJOFYMAYGNOS-WNHJNPCNSA-N 475.929 0.963 50 20 JCGD C[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)Oc1ccccc1 1795736984 SPKBAAYIBMVXMK-CVFMPKEZSA-N 452.316 0.427 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)nc2ccccc12 1795738756 DXXVASBKQHPURY-FEJSZKPUSA-N 459.311 0.740 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2)NC(=O)NCc1ccccc1 1799097256 LMTWCRUEVMIZPE-HATOLVCRSA-N 491.665 0.774 50 20 JCGD CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOCCOCCOCCOC)C2 1799268123 LFDFQULQJHZMBK-AJYBTWMASA-N 464.987 0.680 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl 1799273912 VCUWESXJJLZLOC-UUUMGPIQSA-N 468.378 0.698 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)[S@](=O)c1ccccc1 1800213258 UERUCACFTZEKLT-IZAYKJJWSA-N 499.593 0.906 50 20 JCGD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c(O)c1OC 1800571006 XIFNZQTWEVZTJM-BJWYYQGGSA-N 454.288 0.655 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@](C)(O)CC(=O)O 1801006638 XBEFEOMFIXPJTJ-WPCGYXSLSA-N 493.469 0.339 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1804221510 LGAZCTZVMNYOAY-BJESRGMDSA-N 481.333 0.505 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnc(OCF)cn1 1805031663 UZWDMJWPWDJDHW-LAUBAEHRSA-N 479.277 0.491 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807364024 GVZMPWNVNYWCHE-UZLBHIALSA-N 464.243 0.896 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807376717 XLAUWODAOWDRKO-WIYYLYMNSA-N 473.298 0.115 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)c2nc[nH]n2)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807868708 BCSPHCNYDOGIAY-TZIWHRDSSA-N 491.556 0.866 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1 1808175503 IBMMKVRTVXTQPR-VGSWGCGISA-N 464.530 0.817 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1 1808413514 BQVHKCLIQBJZQR-PZMWHVSESA-N 479.541 0.844 50 20 JCGD O=C(c1cnc2snnc2c1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809970792 BDJHJVOWYXPGER-UHFFFAOYSA-N 465.344 0.925 50 20 JCGD CN1CCN(CCC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1810303946 XYKUNTNIMWPZHV-CVDCTZTESA-N 494.600 0.037 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)[C@@H](N)Cc3cscn3)C2)CC1 1810792536 NYBFYLRWRDAJHT-SFHVURJKSA-N 471.587 0.556 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@@H]1CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]1c1cccnc1)CCC2 1812225592 JUIOJLFDDADNCV-HRAATJIYSA-N 488.552 0.936 50 20 JCGD CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1 1812778441 HUVZVULNSNWLRL-IJEWVQPXSA-N 469.336 0.804 50 20 JCGD CC(=O)N[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(C)(C)C 1815056523 CGEFUMARVLJYIN-ICSRJNTNSA-N 469.351 0.946 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1 1815336038 XQFKLEMLXKKKOS-MRXNPFEDSA-N 499.379 0.766 50 20 JCGD CN(C)c1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815344202 NWXXNTRINRWJKO-INIZCTEOSA-N 465.344 0.824 50 20 JCGD O=C(C/N=C/c1ccco1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344286 RGQKTZREALRTEJ-QCXKMSLLSA-N 452.301 0.761 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccnc2C(N)=O)n[nH]1 1816077612 WGZJSBYMLZLNMY-HNNXBMFYSA-N 456.507 0.583 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)N1)CC2 1817280428 VRMLGKBILKYFGT-VZIASUOKSA-N 457.516 0.468 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1 1819402028 JFDFJEOEYFGKNH-SFHVURJKSA-N 470.534 0.436 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)CC2 1826084075 ZBONOGLBKADIJB-MRVPVSSYSA-N 483.444 0.783 50 20 JCGD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n(C)n1 1827049997 CYEYHFNPLQNUBP-LJQANCHMSA-N 454.336 0.656 50 20 JCGD Cc1cc(Cl)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830118751 AKXYEPMOSLHEGT-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1830539052 ZWAXMAQVVYWGOB-VBKZILBWSA-N 484.347 0.954 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C3CC3)CCO2)C1)NC(=O)NCc1ccccc1 1830791167 UWETUZRDWULLSC-YHZGQTRVSA-N 485.585 0.755 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)CCO2 1831110659 LZLAZIJQJGWQPR-YOSAUDMPSA-N 493.988 0.745 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3CCC4(CC3)OCCO4)CC2)CC1)c1ccc(B(O)O)cc1 1834799215 QLZCTDYKDVVVJT-UHFFFAOYSA-N 499.417 0.485 50 20 JCGD O=C(NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2)c1ccc[nH]1 1834819209 KIZDLLHHNYXXEO-LJQANCHMSA-N 471.352 0.376 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1 1835050302 RFTJNGPQPBZIGZ-HSZRJFAPSA-N 471.489 0.137 50 20 JCGD CC(C)NCCC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737122 ZFIHDZLYYMNFIQ-UHFFFAOYSA-N 459.595 0.258 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835933829 GQCKMEYXXIZVOF-UQBPGWFLSA-N 466.343 0.315 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cn3ccncc3=O)CC2)CC1)[C@@H](F)Br 1836413451 CSDLUNUKYNLYIK-QGZVFWFLSA-N 458.332 0.505 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](COC(C)=O)OC(C)=O)CCO2 1837503474 VJBAQGDAASTLJH-FCEWJHQRSA-N 493.351 0.111 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)Cc3cscn3)CC2)CC1 1837944408 WXMSUGAOEMOUEA-UHFFFAOYSA-N 472.571 0.997 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 1838568677 JWXYHUKIUSTYLN-XMSQKQJNSA-N 484.933 0.160 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)c1ccc(F)cc1 1839039393 FOOVWAOOORVKJR-FUHIMQAGSA-N 459.877 0.994 50 20 JCGD N[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1cccnc1 1839199105 JMEPQNNQJDQRNY-KYJSFNMBSA-N 459.316 0.618 50 20 JCGD Cc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1839311881 QPTPYFYUEHNAEA-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839449671 XWEBKGOLNQAKKJ-FXAWDEMLSA-N 470.910 0.331 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1839939114 CLECUHOMHGEYES-XMMPIXPASA-N 460.575 0.757 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(=O)n3C)C2)C1 1839963888 ZPRCIZICLBHFHO-LIRRHRJNSA-N 456.337 0.629 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1840031614 XCZYGDPPJCWDAG-FZKQIMNGSA-N 490.376 0.339 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(OC)nc3)C2)C1 1840151175 XBXFQQABBRQNEA-LAUBAEHRSA-N 455.939 0.733 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2)C1 1840153918 FSIKZOQJPXXNOL-WHSLLNHNSA-N 477.986 0.952 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Cl)COC)CCO2)C1 1840156917 YAKIIRZWQYWMAR-PNLZDCPESA-N 487.981 0.613 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(F)ccc(F)c3F)C2)C1 1840182260 BDKOLLMHOIUNBK-JOCHJYFZSA-N 486.491 0.476 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)c4ccccc4o3)C2)C1 1840183317 XVOFIVXECOJBQY-XMMPIXPASA-N 486.525 0.236 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COCc3ccc(OC)cc3)CCO2)C1 1840254835 KTENRMYAOVDCJC-SIKLNZKXSA-N 470.950 0.922 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840277346 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CC(C)(C)OC(=O)NCCOCCOCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847558823 QAHYIXWTBBSJJW-JYJNAYRXSA-N 463.959 0.346 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)c2cn(CC(=O)N(C)C)nn2)c2ccccc2c1=O 108922182 ILWFAVUZQACOJG-UHFFFAOYSA-N 454.491 0.341 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1)c1ccc2c(c1)OCCO2 109206154 AZXOZEVOZCQBKI-UHFFFAOYSA-N 452.514 0.598 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)COC2 726381878 JBKUKUZXOBDYDV-UHFFFAOYSA-N 481.556 0.058 50 20 JCGD Cc1cc(C(=O)N2CCC[C@@H]2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1[N+](=O)[O-] 726527739 IZSNRQGJDXWZOP-DZGCQCFKSA-N 453.477 0.025 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCNS(=O)(=O)c3ccccc3)cc2)CC1 728212971 OFFXCPZHIXHMLV-UHFFFAOYSA-N 481.600 0.434 50 20 JCGD O=C(COC(=O)c1cn(-c2ccc(C(F)(F)F)cn2)nn1)NNC(=O)[C@@H]1COc2ccccc2O1 728341809 GMSFFXFIHMDUOP-HNNXBMFYSA-N 492.370 0.825 50 20 JCGD CC1(C)COCCN1CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 728400882 QTRMKOZBAPYHJL-UHFFFAOYSA-N 453.565 0.526 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](NC(=O)NC(C)(C)C)C(C)C)cc1 729511942 ZMMKTHTZRFXXAH-KRWDZBQOSA-N 455.581 0.885 50 20 JCGD CCS(=O)(=O)NCCNC(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1 747867416 XTEGEISVIMGXLL-HXUWFJFHSA-N 459.572 0.883 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1 760370955 IASAWAQTNFEORE-UHFFFAOYSA-N 454.530 0.280 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1OC 784375821 UHFHIJPJAPDZRY-GASCZTMLSA-N 461.471 0.573 50 20 JCGD Cc1c(NC(=O)[C@@H](C)SCC(=O)NNC(=O)CN2CCCC2=O)c(=O)n(-c2ccccc2)n1C 789857406 RXGCWOTYDUQXRT-OAHLLOKOSA-N 488.570 0.314 50 20 JCGD Cn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc21 903928026 OOHVBMXHTUJGOE-UHFFFAOYSA-N 480.524 0.539 50 20 JCGD CN1C(=C(C#N)C(=O)COC(=O)[C@@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)N(C)c2ccccc21 914653456 KEZLBTVOFGMVJJ-HUUCEWRRSA-N 472.523 0.456 50 20 JCGD CC(=NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccc(S(=O)(=O)NCCCC(=O)O)cc1 916352188 RKEBXAOLZFQVPW-UHFFFAOYSA-N 471.499 0.959 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])[nH]1 917934143 XBOQRPQAOMJCPD-UHFFFAOYSA-N 451.461 0.338 50 20 JCGD O=C(COc1ccc(CCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1)NC1CC1 918107344 JEHUJARCJGFMOJ-UHFFFAOYSA-N 464.486 0.506 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN1C(=O)Cn2c(cc3ccccc32)C1=O 920275228 PHOFTTYUADDJBK-UHFFFAOYSA-N 482.522 0.686 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1)NNC(=O)c1ccccc1 920634523 DKDPKLYJGFHIAQ-MRXNPFEDSA-N 490.494 1.000 50 20 JCGD Cc1nnc(NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2I)nc1O 1317898029 OLTQWYAMRISOFN-UHFFFAOYSA-N 478.272 0.497 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1 1778627887 FFGPZHMQJBRNBP-GQBLCDNYSA-N 469.527 0.973 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2 1779029729 XQMDMZDOSWYWQU-WAIKUNEKSA-N 453.499 0.527 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)Cn3ccnc3)CCO2)C1 1780097158 RMTQBMVNMPJCBD-OAQYLSRUSA-N 457.443 0.860 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc(Cl)cn1)C2 1782212084 SNHIBXDFOUAHGJ-OXQOHEQNSA-N 454.959 0.423 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214537 UHZFGDUQBWSICY-RQBNJVACSA-N 487.601 0.692 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4c3)C2)C1 1782383527 QMNBHNSPMAVVKH-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCOC2)C1)NC(=O)NCc1ccccc1 1782693813 FMVWUSXGEGMWGA-BPYKYCOYSA-N 487.601 0.883 50 20 JCGD N=C(N)NCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783021816 COTVMZFDOUHAQB-BEFAXECRSA-N 452.353 0.306 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1783508678 BKNJNDPPNXVAIS-CJAUYULYSA-N 495.341 0.125 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC3CCN(C)CC3)[C@H]2C1 1783655475 YBDNKCURVPBUIR-HDHADGOUSA-N 472.590 0.832 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COCCOCCOCCOC)C2)C1 1783685341 AHSHGELJDHHEKE-PXNSSMCTSA-N 450.960 0.530 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)C(F)(F)Cl)C2)C1)NC(=O)NCc1ccccc1 1784175547 UGKUBDIIWKLAPC-LJQANCHMSA-N 473.908 0.994 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1 1784851795 DQWULUKLAFBOHT-TYYYZTEESA-N 459.455 0.856 50 20 JCGD COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)n1 1785197871 FALTUPBZSSBJOU-ZCQORZAUSA-N 482.541 0.746 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785734899 LHBOPEMAGJBZDR-DEOSSOPVSA-N 489.378 0.361 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(O)c3)C[C@@H]21 1787508107 GCIVDXFMCYIRHH-PSUWLIPFSA-N 454.487 0.515 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nonc4c3)[C@H]2C1 1787879795 NSXMAVMPBXJPPP-NRJQGIQSSA-N 479.497 0.950 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790694415 OFUXRFMTKBJFCK-NSTZSLEWSA-N 495.291 0.845 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1O 1791286328 AIEGBBXWUYBOGE-ZWOKBUDYSA-N 462.547 0.296 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791291014 HNVPOOFMBPFWOD-LRQRDZAKSA-N 468.558 0.905 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccnn3)[C@H]2C1 1791601429 VXFVNXDKBDOJTM-QAETUUGQSA-N 497.980 0.967 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)C2)C1 1792983539 MAOGFWCFUUKXLD-YYIAUSFCSA-N 471.982 0.823 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792983954 WCOUHYRXOYHGEP-BVRUVYRISA-N 455.914 0.062 50 20 JCGD CC(=O)NC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1793376115 DJOCQTBNKLDCRT-CCWDJLKJSA-N 476.486 0.638 50 20 JCGD 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O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cnc2ccc(Br)cn12 1797571862 VXRAPKCVYJQCLG-VAECKANCSA-N 471.739 0.900 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O 1797686179 IQFZBFWBUORWDE-RHQZKXFESA-N 495.621 0.616 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc2cnccc12 1798458522 AXTZYILNOJOBKK-YVWYUNDQSA-N 461.482 0.145 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@H](O)c1cccc(Br)c1 1799098816 HYIYMYWIGQRCFV-UDUPFKKZSA-N 461.740 0.672 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2 1800759700 CYGKSJAUTXTNJG-BYNIDDHOSA-N 450.330 0.203 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1803791221 LQNDOQKLARFRNG-DENIHFKCSA-N 461.331 0.745 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cncn1-c1ccncc1 1805103923 IBHFJWICHKGKOK-YKSBVNFPSA-N 496.336 0.976 50 20 JCGD COc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1805207762 GFWGTLZYBNCFJE-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C[C@H](N)c2cccnc2)[C@@H]1c1cccnc1 1807263420 DOTNUSQMDNNSEC-JZWVFAODSA-N 488.552 0.885 50 20 JCGD CC(C)NCCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1807324136 UVQFCAICUNTCDS-LAUBAEHRSA-N 453.547 0.788 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370415 CZZPPKPHMUFGPQ-VGOFRKELSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371335 SVMFUURJYVXBBZ-LAUBAEHRSA-N 467.722 0.631 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc3c(c2)CCNCC3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372633 HEZWUIDBCQMCIW-OFVILXPXSA-N 499.380 0.478 50 20 JCGD C[C@@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)O1 1809557017 GESHKBKXGOIZHJ-HIBPSGHXSA-N 452.515 0.967 50 20 JCGD CN(C)c1ncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)o1 1815337296 RBJMQYAMRKIHOB-ZDUSSCGKSA-N 455.305 0.417 50 20 JCGD CCOc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nn1 1815360941 RNISWNAIFHVISC-AWEZNQCLSA-N 467.316 0.551 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)Cn3cncn3)sc2C1)NC(=O)NCc1ccccc1 1815669108 MNGMJAFVLDAIEY-INIZCTEOSA-N 497.585 0.693 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)no1 1817472464 UAEGAWPQRVZYBO-GOSISDBHSA-N 480.290 0.122 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc2nncn2c1 1819175228 KDZINUUUWWUNAZ-OAHLLOKOSA-N 462.300 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CC(F)(F)C(=O)O)CC2 1819796918 IBXLTMYFNSSKFQ-MRVPVSSYSA-N 468.442 0.477 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819798116 WKFPEVPWWUIXCT-NWDGAFQWSA-N 481.542 0.658 50 20 JCGD C[C@@H](NC=O)C(=O)N[C@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822517897 BLRZQTKEJGHMNR-ZBFHGGJFSA-N 487.586 0.536 50 20 JCGD CNc1nsnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1823741092 OEFNFPOFWJNHPS-KRWDZBQOSA-N 457.365 0.807 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)C(=O)C(=O)O)sc2C1 1824677443 SCVHXHLKCZMMLY-RKDXNWHRSA-N 461.338 0.772 50 20 JCGD C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2 1825642228 PTBLLJUAVCAVAZ-RQJHMYQMSA-N 467.309 0.278 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051801 FWHOATFDYHSFJV-OAQYLSRUSA-N 464.331 0.633 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CC(F)(F)C(=O)O)CC1 1827594394 GQZQBDULEKFAGU-KRWDZBQOSA-N 452.263 0.710 50 20 JCGD CCSc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1829580406 UHOVPKXPVCWFMG-QFIPXVFZSA-N 479.603 0.637 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1830541117 XXOUNTHTPFODGL-HNDWEXJHSA-N 498.374 0.939 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1830544415 XMYRXLATDNOYHR-OPAMFIHVSA-N 495.418 0.871 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)N(C)C(=O)OC(C)(C)C 1830732806 ATBAUBMFTKBIFS-STXHMFSFSA-N 463.959 0.298 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830735803 NDCFSCXJUNVTOF-WMZHIEFXSA-N 497.976 0.148 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1831694778 UHWOGUQEYIBZBK-MOPGFXCFSA-N 452.379 0.841 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873261 GFNFFVFABMOIGA-APWZRJJASA-N 455.556 0.044 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1833611685 LMXCCMOFCSYNGS-WGSAOQKQSA-N 499.417 0.531 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)CC2)CC1 1833833574 QAIZAKNBDHXUKG-RDTXWAMCSA-N 496.008 0.818 50 20 JCGD O=C(COCc1ccccc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834608849 JDCFHRMOSDZIIZ-UHFFFAOYSA-N 479.386 0.768 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@@H]1ON=C(c2ccccc2)O1 1835673809 IZABCCJATQHCBJ-AVRDEDQJSA-N 464.950 0.892 50 20 JCGD O=C(C#Cc1ccc(Cl)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926706 ZOVBAWUZESAFMH-DEOSSOPVSA-N 482.729 0.142 50 20 JCGD O=C(CSc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835936010 ZYGPLBGPJWQZPE-QHCPKHFHSA-N 470.356 0.229 50 20 JCGD CCOc1ccsc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837455871 GKAIYNHMRNTWIG-QFIPXVFZSA-N 489.554 0.529 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3c3ccc(F)cc3)C2)C1 1837456718 PYVNXKLQAQLPLL-RLSLOFABSA-N 497.527 0.698 50 20 JCGD N#Cc1ccccc1OCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922217 YQTPYBPDCADUFE-UHFFFAOYSA-N 491.353 0.929 50 20 JCGD CN(CC(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1)C(=O)C(=O)O 1838648168 KBFCWMGVOMWMAK-AWEZNQCLSA-N 466.304 0.219 50 20 JCGD Cn1nc2c(c1C(=O)N1CCOC[C@@]3(C1)CN(C(=O)[C@@H](F)Br)CCO3)CCC2 1839202434 FKVPKDKIPFDKTE-CRAIPNDOSA-N 459.316 0.669 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CCO2 1839384621 MOFAKCQPMPFRKV-LPMFXHHGSA-N 494.383 0.317 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCS(C)(=O)=O)C2)C1 1839967732 WQRTXFNVNRTSDO-CZUORRHYSA-N 455.371 0.051 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3cc(F)c(F)c(F)c3)C2)C1 1840185393 PIFQMXOJAFZDBO-UUCGHWEQSA-N 498.502 0.947 50 20 JCGD COc1cnc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)cn1 1842551839 IGACULRIIDOLPY-UHFFFAOYSA-N 467.530 0.648 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C[C@H]1CNc3ccccc3O1)C2 1844264296 DENLBFYCMZZLFX-HNNXBMFYSA-N 450.499 0.765 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cncc(O)c1)C2)NC(=O)NCc1ccccc1 1845039401 LZBHAWJYBUNNGX-UHFFFAOYSA-N 452.515 0.950 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc(N2CCCC2=O)cc1)NNC(=O)c1ccccc1 10689627 WCGOEECNELJJER-UHFFFAOYSA-N 474.495 0.096 50 20 JCGD COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 15243460 VLECCCLIMMOYHX-UHFFFAOYSA-N 483.524 0.117 50 20 JCGD CC(=O)Nc1cc(NC(C)=O)cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 24399115 IIYHXDXXTTZBGG-UHFFFAOYSA-N 461.500 0.929 50 20 JCGD CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)CNC(=O)c1cccs1 725872866 HOFBQEZLDFSHSD-UHFFFAOYSA-N 467.573 0.836 50 20 JCGD CC[C@@H](C)N(C)CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 727229696 POKIXQATWFKMAJ-QGZVFWFLSA-N 469.608 0.701 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21 728433741 FNFWKCZICIACRY-QMMMGPOBSA-N 471.293 0.137 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cnc3c(c2)c(O)nc(=O)n3C)cc1 728502806 QMRJXDOAYIHMLO-LLVKDONJSA-N 463.472 0.210 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(F)c(S(=O)(=O)N(C)C)c2)n1 728729638 SSDVYGSQBRNLJI-UHFFFAOYSA-N 458.493 0.388 50 20 JCGD O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)c1ccc(-n2cnnn2)cc1 730769246 RHGOHMXSBTUPCM-INIZCTEOSA-N 468.861 0.982 50 20 JCGD CCn1c(CCC(=O)NNC(=O)N(C)C)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 746006006 IRSNLIIMZQYXFN-UHFFFAOYSA-N 452.537 0.312 50 20 JCGD Cc1cc(NC(=O)CSCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)no1 782701429 FDGMHRVAZLNZDL-CQSZACIVSA-N 464.456 0.185 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccccc2F)cc1OC 848387305 DUANIPMQQTYBPE-UHFFFAOYSA-N 469.447 0.126 50 20 JCGD Cn1c(=O)nc(O)c2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)cnc21 879295872 JWSVMFDZILSGED-UHFFFAOYSA-N 486.510 0.284 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)N1C(=O)[C@H]2CCCC[C@H]2C1=O 912848151 HGCQAQZMRICKEH-QLFBSQMISA-N 495.627 0.956 50 20 JCGD C[C@H]1CCCC[C@]12NC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C2=O 915789008 AKQPSDAHACGZFW-YPMLDQLKSA-N 471.923 0.249 50 20 JCGD C[C@@H]1CN(C(C)(C)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@@H](C)O1 916234417 DPZLJDQJNPAKEP-IAGOWNOFSA-N 483.639 0.532 50 20 JCGD CC(=NNC(=O)[C@@H](C)CN1CCOCC1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1 916363657 XLRKGLPTXPHBGA-INIZCTEOSA-N 480.587 0.980 50 20 JCGD Cc1cc(C)cc(OCC(=O)NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 916559438 DBVVMJPSQJMBTL-UHFFFAOYSA-N 462.528 0.510 50 20 JCGD COc1ccc([C@@H](CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)NC(C)=O)cc1 921173787 RMPFTTFZCBXZEX-YLJYHZDGSA-N 471.466 0.793 50 20 JCGD O=C(C1=NO[C@@H](c2ccccc2)C1)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1778173590 WPBZBLXYUGOSCD-QPPBQGQZSA-N 463.299 0.328 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1778951185 RLIDAVKWXHPRKO-VFCRVFHLSA-N 490.001 0.656 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)o1 1779024313 RSGAZIIAYNYFDV-PWYGXMRTSA-N 470.486 0.816 50 20 JCGD COC(=O)CCCCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779375698 RIZVTMGTSFOXKD-NTKDMRAZSA-N 489.573 0.936 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CS(C)(=O)=O)CCO2 1780095172 IKKGCHNZRIGIEF-QKKBWIMNSA-N 497.526 0.644 50 20 JCGD COc1ccccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1780301868 RKSUPBTZFSSKMC-ZJSXRUAMSA-N 452.316 0.816 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2)[C@H](F)Br 1780773710 RXFNYOXCPIFDAI-HACGYAERSA-N 493.355 0.656 50 20 JCGD N#CCc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1781010841 NWWGLTFLAZARFO-RCZVLFRGSA-N 461.327 0.874 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1784417211 MHARMLBWPOQHAP-IVZQSRNASA-N 470.555 0.704 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)[C@H]2C1 1787492700 KBRVGKZHBPEOQG-ORWNZLQRSA-N 475.409 0.800 50 20 JCGD CO[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726615 FUWORMDIXWMYQP-LEAZDLGRSA-N 461.563 0.347 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cc(F)ccn1 1794024641 TWMHUTIGLURMAU-BSBFHTJNSA-N 470.505 0.877 50 20 JCGD CCOC(=O)/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1795087003 AIHSFWLQWOVUGH-DZDOSFCXSA-N 473.954 0.827 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CN)c1ccccc1 1795673930 SLLMNBSFYKZMBT-LYLAWYLISA-N 466.542 0.453 50 20 JCGD CCc1c(Br)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)nn1C 1795952816 PJZDNIPXJLDMHZ-QPPBUOOMSA-N 463.760 0.548 50 20 JCGD C[S@](=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796361337 NYQXZSGJRCFFHY-UVEPIENXSA-N 483.990 0.772 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnc2cc(C)nn2c1C 1796924599 RYXKKDZFHAUSBZ-GSBKIRKESA-N 493.528 0.078 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cccc(O)c1)C2 1797754253 ZOBJVIJDVASYQL-BZGPJFGBSA-N 451.483 0.307 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)nc1 1799095009 UACAANLKGZZWLE-UPHUGPLXSA-N 461.563 0.510 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1N(C)C 1799206617 SOENZHWTQBYHLX-VPTLXERWSA-N 482.541 0.277 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1800712004 OKHQDHGZTRWOPF-IXXKSVCMSA-N 457.955 0.433 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCS(=O)(=O)c1ccccc1)C2 1800975294 LTGJEZJILZYJCV-LORHWOILSA-N 458.964 0.694 50 20 JCGD COc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc(OC)c1OC 1801010535 DHVRZCOZDDCUSP-GPVSGQMNSA-N 492.573 0.218 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1802019237 XBWAGIZHHWLFPU-AIEDFZFUSA-N 461.943 0.681 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)C(Cl)Cl)N1 1802346977 VFMWEMFUSISOSM-FPYNETTCSA-N 463.387 0.608 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1805307402 FYUCWPQTRMOMSC-OXQOHEQNSA-N 457.535 0.516 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(=O)OC(C)(C)C 1807362415 GYDNXQNSONSXES-SIKLNZKXSA-N 496.373 0.948 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1 1807937860 UANDTZVHMMRIPD-LAUBAEHRSA-N 464.530 0.817 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]1c1cccnc1)C(=O)C(=O)O 1808316840 HWPBNCLFWRRDNZ-MUKKUYKPSA-N 459.330 0.867 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1nn[nH]c1C(F)(F)F 1811559168 ZNJCPSXQZOUUNB-WMLDXEAASA-N 488.235 0.532 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccn(C(F)F)n1)CC2)c1ccc(B(O)O)cc1 1815344242 PBXQJPJTXUVNLK-GFCCVEGCSA-N 461.259 0.954 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356978 XPLPYOKNYTVSRK-DOMZBBRYSA-N 466.332 0.339 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCc3nc[nH]c3C2)[nH]n1)c1ccc(B(O)O)cc1 1817475659 QLTGOXOOJTWRPK-QRWLVFNGSA-N 462.319 0.924 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3c[nH]c(=O)cn3)sc2C1 1821470768 ZOFHINRRIDTXDU-YCBFHKDISA-N 468.499 0.586 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824886062 ZCSJWFDGCZCPGH-FQEVSTJZSA-N 458.563 0.787 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)CC2 1826008606 DJGGOGGSZUMSLD-NJZAAPMLSA-N 468.967 0.779 50 20 JCGD Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c(=O)[nH]c1C 1826080501 OFBRYYPMGZRECQ-LBPRGKRZSA-N 461.548 0.442 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1826719931 WLDCQIUTYRFSDH-HSZRJFAPSA-N 470.423 0.237 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826824469 CQMIHAYTHYSAQJ-CJNGLKHVSA-N 453.333 0.582 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829640302 FQFSKFKBWUKSSW-NRFANRHFSA-N 451.332 0.612 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)cc1F)CCO2 1830085457 QILSCWASJIGGHS-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1830358026 OJUDAANQOAKFIT-FQEVSTJZSA-N 451.911 0.770 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1 1830539862 JRZAYQMQIPSCPX-SPYBWZPUSA-N 470.368 0.764 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)n1 1832764697 XMOUHXJTTAXTLD-FXZATJRASA-N 498.540 0.223 50 20 JCGD CCS(=O)(=O)CC(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1833453792 SHYHJJHJHOURON-UHFFFAOYSA-N 452.415 0.778 50 20 JCGD CC(C)N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)C 1834784649 SGGYMDLBFQTDTP-HSZRJFAPSA-N 472.439 0.574 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H]3C[C@H]3C3CC3)CC2)CC1 1835734628 NPRCARZXOYTTMR-PMACEKPBSA-N 454.575 0.916 50 20 JCGD CCN1CCC(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1835737519 YLXQQBKYLCHIFL-UHFFFAOYSA-N 485.633 0.602 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3occc3Br)C2)C1 1835928038 BRWAZIRQGRNNLL-FQEVSTJZSA-N 493.119 0.106 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccccc3OC(F)F)C2)C1 1835934540 XMTILQZYEXNBTD-HSZRJFAPSA-N 490.268 0.352 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccsc3)CCO2)C1 1836099635 KWNSGXQAOCSHRB-NRFANRHFSA-N 459.528 0.059 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(=O)Cn3ccnn3)CC2)CC1 1836107622 ZEZBSCISYHXDJG-UHFFFAOYSA-N 499.528 0.997 50 20 JCGD CC(C)Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n(C)n1 1836336793 RTTCIOREBGINIF-XMMPIXPASA-N 499.572 0.001 50 20 JCGD O=C(c1nn(-c2ccccc2)c2c1COC2)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836391347 VBYYVTSGTJIBCO-AUSIDOKSSA-N 490.944 0.572 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3ccccc13)CCO2 1836944280 GWMZCPMHDKGGPQ-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C)c4ncccc34)CCO2)C1 1837191631 SKLAEBAEVYIXJY-LAUBAEHRSA-N 450.923 0.897 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncncc4c3)C2)C1 1837459006 HAVWKUADURBACO-XMMPIXPASA-N 491.508 0.012 50 20 JCGD O=C(C#CC1(O)CCCCC1)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1837489797 VIYIGJQLDRIBIE-FQEVSTJZSA-N 457.365 0.926 50 20 JCGD CCOc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)nn1 1837715084 UYZLHDCYWKSYRS-HXUWFJFHSA-N 452.584 0.797 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1837715937 SILSSPOGGNNSJU-FQEVSTJZSA-N 482.566 0.064 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837948761 HPYMWEGGYALHPV-ROUUACIJSA-N 461.302 0.481 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1838357182 VGIVLWXNYMDDKD-KBPBESRZSA-N 468.320 0.740 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838498674 APBWSKGKJYYTSN-OAQYLSRUSA-N 463.922 0.425 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2)C1 1839145032 RCXDOCLDXIBXPO-WHSLLNHNSA-N 477.986 1.000 50 20 JCGD Cc1nc(N)sc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198893 FJGGFJCWQLLBKK-ABAIWWIYSA-N 451.318 0.794 50 20 JCGD O=C(c1ccc2nncn2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200994 PTUYDYHWLOLGAS-YOEHRIQHSA-N 456.272 0.490 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)no1 1839201277 TWFBRWKFHCKFGW-WBVHZDCISA-N 477.287 0.459 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201390 WGWVLGNEABXAOV-PBHICJAKSA-N 463.304 0.290 50 20 JCGD CC(C)(C)Oc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839342646 KMEGRYMLOXIJTK-SANMLTNESA-N 496.369 0.928 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1839964844 GEWBZAZQQIALEU-LIRRHRJNSA-N 466.336 0.973 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1 1840033713 NNJVZCRCTWHHOI-QMTMVMCOSA-N 456.337 0.649 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2)C1 1840152581 MRKDXRHYBXSWGR-MRUHUIDDSA-N 493.985 0.236 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c[nH]nc34)C2)C1 1840184065 PRSZSXPBZRZIAQ-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1 1840185589 PLQJOBJKVFUQNK-HXUWFJFHSA-N 453.927 0.178 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840335319 KSMZZWODUFOARZ-JPYJTQIMSA-N 461.563 0.090 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1840436638 SCIFQNHQZVPVGL-NRFANRHFSA-N 452.628 0.887 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1 1840648607 VATBVYMVSNPDJA-BFUOFWGJSA-N 454.321 0.639 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)O2)C1 1841348988 YDLFHHGFTYTVSR-HUUCEWRRSA-N 457.955 0.958 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O)C2 1846383504 HCAMNFCQSNRJCK-IAGOWNOFSA-N 481.594 0.181 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2ccc(OC)cc2)c2ccccc2c1=O 17163838 HXTHCTDJGNDBAJ-AWEZNQCLSA-N 487.538 0.943 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)c1 26745700 FSWVWWJYRGCIDF-UHFFFAOYSA-N 497.551 0.333 50 20 JCGD COc1ccc(CCN2C[C@H](C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cc1OC 728179391 KHLCGCYIJABXTG-IAGOWNOFSA-N 453.561 0.587 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)c1 747625577 SLMFRCQIBQOLGI-UHFFFAOYSA-N 465.532 0.608 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCOCC2)c2ccccc2c1=O 748111270 KENLKEUGEQICNN-UHFFFAOYSA-N 494.574 0.193 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)Cn1cc(Br)c(O)nc1=O 751200226 PSTJMVTWMWCZDP-UHFFFAOYSA-N 476.081 0.700 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 912848158 IHJCTUJDVLMEDG-UHFFFAOYSA-N 481.556 0.230 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1)[C@@H]1COc2ccccc2O1 914746282 NMIANMCQOZRVKM-PXAZEXFGSA-N 461.452 0.274 50 20 JCGD O=C(NCc1nnc2n1CCC2)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 916235453 VNIFKKMKZOFHMS-UHFFFAOYSA-N 469.527 0.847 50 20 JCGD O=C(NNS(=O)(=O)c1csc(C(=O)O)c1)c1cccc(S(=O)(=O)N2CCCC2)c1 917717921 NOOXBDJPQWJYIJ-UHFFFAOYSA-N 459.527 0.854 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)Cn2nc(-c3ccccc3)ccc2=O)ccc1Cl 917918977 KALQVRQPJVEOCH-UHFFFAOYSA-N 461.887 0.672 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1 919743661 QKYXFGLLAKVCNA-LLVKDONJSA-N 474.948 0.840 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1cnn(C)c1)c(=O)n2Cc1ccccc1 920827223 JZHNZGGLLFMPSI-UHFFFAOYSA-N 478.513 0.328 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc4c(F)cc(F)cc4[nH]3)C2)C1 1777797406 NPJMWBSTUQQBDT-QHCPKHFHSA-N 469.253 0.883 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2noc3c2CCCC3)C1 1777867329 WZXZBUIICUYCMU-NTKDMRAZSA-N 482.541 0.993 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1 1778238093 QBHOAEOMSWHQNR-HOYKHHGWSA-N 487.362 0.067 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2C1 1778372453 AWLXTRHQOHYYOV-HTAPYJJXSA-N 497.980 0.677 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cn2ccccc2n1 1778475198 FAYZWIVPXHXRAN-HYBUGGRVSA-N 462.315 0.455 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(Cl)nc1F)CCO2 1779028696 OHAOQQNPTDZRRA-FQEVSTJZSA-N 462.869 0.630 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029195 NTTQWPAWCAVZCJ-KPZWWZAWSA-N 454.325 0.160 50 20 JCGD CC(C)N[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)C(C)C 1779373171 KHXYYOPBFZADNS-JXALWOEJSA-N 474.606 0.835 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn3nccc13)C2 1779374721 ZDBRFRRYLDIFOU-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cnc(Cl)c(Cl)c3)C2)C1 1779494222 ZAXFFXPWNGKADZ-HXUWFJFHSA-N 464.114 0.826 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C2)C1 1780237161 QDPXUIRBVAZZPQ-QFIPXVFZSA-N 498.452 0.079 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)on1 1780968813 FRNDBNDTCWEWAC-QHCPKHFHSA-N 470.530 0.773 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)CCO2 1783870702 GFUIDSHVDZZUBJ-AUSJPIAWSA-N 463.959 0.346 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1783936304 UDHHHTJHNVELQP-HSZRJFAPSA-N 459.547 0.390 50 20 JCGD COC(=O)CSCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1 1783963914 DXHDSMKSCDSMKR-RFGFWPKPSA-N 451.383 0.903 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)C(=O)c3ccccc3)[C@H]2C1 1784346165 RCLZMFNYCKBJRD-OKYOBFRVSA-N 451.951 0.992 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CC(=O)NC3=O)[C@H]2C1 1785032181 SYAYITUKJFRXAL-JLBONTIYSA-N 487.463 0.403 50 20 JCGD O=C(Cc1ccc2c(c1)CCC2)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785044729 PFCFCJHBLJXGPO-XWGVYQGASA-N 462.355 0.691 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1 1785228917 JEOSSOKMSNETEY-NRFANRHFSA-N 484.550 0.046 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cn[nH]c3)[C@H]2C1 1785279375 OYTGGQDNPZPUJX-CCYFIYGFSA-N 455.519 0.456 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(O)nc(Cl)c1 1785693629 LBFUQWAUQNMPCV-JQFCIGGWSA-N 459.695 0.028 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787507612 JBPQKVFDODNNPN-ZJEDPXCGSA-N 477.518 0.662 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc2ncccc12 1787822228 IBULOOOMESRQFL-HYVJGQCMSA-N 459.311 0.822 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)c(F)c3)C[C@@H]21 1788610879 YYUSIDMNKJBIQA-VHFSOBRXSA-N 473.480 0.799 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccnc3C(N)=O)[C@H]2C1 1789090518 IWTHSGRBSFKCNM-VOAKCMCISA-N 454.325 0.200 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CNC(=O)C3)[C@H]2C1 1790861495 SNFMLYBSXZUZOH-JNLSPVFGSA-N 458.465 0.988 50 20 JCGD CC(C)(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)ccn1 1794299067 MMINHQUVOTUHOG-RMFSNUHRSA-N 451.332 0.576 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)n1 1795115586 AXHDHDVDIYWCHV-XOIINTDNSA-N 455.353 0.661 50 20 JCGD O=C(COc1ccc(Cl)c(Cl)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1795192856 GPWFGWJVADCMKO-USGNIVHTSA-N 493.152 0.955 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C=O)s1 1795743924 REUIFSOZSCZVEC-GBQKICQVSA-N 457.512 0.898 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796368604 ODZJHTOOXFKELI-HKQPUQOZSA-N 463.934 0.871 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)CC1 1796371162 RDTMJSHEBGVNHR-YALNPMBYSA-N 462.950 0.663 50 20 JCGD COC(=O)C12CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)(C1)C2 1796446366 UOADOMNSZNFONO-MIWJPFKNSA-N 471.514 0.053 50 20 JCGD COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1C 1797754145 WQJBYJLJFBWZGD-FAQVEIGNSA-N 467.526 0.448 50 20 JCGD COc1nccnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799094867 FGAJPBDIGLNVAI-OPVJXMOQSA-N 497.556 0.035 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(N2CCN(C)CC2)CC1 1799193068 TUAOCLDDDXWUEE-YVSFHVDLSA-N 457.413 0.530 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1)C2 1801011561 NURYOUQQXYSKQD-QIEVIBBNSA-N 499.584 0.298 50 20 JCGD CC#C[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)c1ccc(O)cc1 1801058699 LTIOEQUPYVYFFB-MVOHMCPASA-N 470.570 0.852 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C(Cl)Cl)C3)N1 1801447096 IDZAGTSKGWUGHS-FPYNETTCSA-N 463.387 0.608 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1 1803644312 GPPIWQCWYKVYQE-ABVZAHHRSA-N 467.486 0.330 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)ncn2)[C@H]1c1cccnc1 1803745036 RYPNQVHVDCKTPP-IFXJQAMLSA-N 462.470 0.209 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnc(OCF)cn1 1805030966 KKJTUUCBVFAVFA-UWJYYQICSA-N 479.277 0.491 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)N1CCCC2(CCN(C(=O)[C@H](F)Br)CC2)C1 1806700705 HSVUWLRRNQAKFI-HNNXBMFYSA-N 468.389 0.639 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1cc(=O)n2[nH]cnc2n1 1807357391 GAMFSMQWVMBPCH-TUKIKUTGSA-N 478.282 0.823 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369791 VVWXKRNLZBSCNP-LAUBAEHRSA-N 479.277 0.491 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1 1808417506 ZTHVIIIGCSRURY-GYFHUBPDSA-N 477.529 0.903 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc2nncn2c1 1809909969 IEBWUPNGBFWUQA-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)CCC(N)=O)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1812633140 MPAUUAFPSQLKBZ-GBXCKJPGSA-N 495.584 0.699 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1814218092 BOHBDZUHCLJGSG-NBOOPKSLSA-N 497.980 0.456 50 20 JCGD CC(=O)Nc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)ccn1 1815356540 JDYYJSVYJJTHMP-MRXNPFEDSA-N 479.327 0.716 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccccc3=O)sc2C1 1815447446 CDHHJQBXUNECLU-LBPRGKRZSA-N 467.511 0.229 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cnn4ccncc34)sc2C1)c1cccc(B(O)O)c1 1818501818 ANPMYQBZFFLGKO-CQSZACIVSA-N 462.300 0.405 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)[nH]n1 1822412730 HCASVMYISZBGMW-OAHLLOKOSA-N 471.522 0.029 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1C1CC1)CCO2 1830492979 BCSZHNQBZCNEHJ-ZZVYNUNKSA-N 457.531 0.623 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cncnc3)C2)C1 1830538290 AZAULAVRCCRTPS-KXBFYZLASA-N 455.353 0.897 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830738427 OTZCUPQCXKMBFU-PNLZDCPESA-N 492.013 0.839 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1 1833027781 SKKDWSOCVMYEAH-IFXJQAMLSA-N 488.404 0.965 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ncccn3)CCO2)C1 1833162211 NKFSYLHHWDEFDI-KSFYIVLOSA-N 497.980 0.608 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1 1833902527 QJGXEAHPGXWPBV-FZKQIMNGSA-N 459.341 0.984 50 20 JCGD CN(C)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834015811 RSIXYERSCJDNNZ-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(O)c(F)c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798302 FLEXSHLDJYZSCZ-UHFFFAOYSA-N 469.322 0.710 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)no1 1835108964 UOFHFLIXPMTQKI-UHFFFAOYSA-N 491.593 0.256 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)[C@@H](C)Br)CC3)CC2)CC1 1835513370 YEHPUCMYSSPSRR-MRXNPFEDSA-N 486.455 0.506 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc4ncnn4c3)CC2)CC1 1835631804 SRYZVWXPRDLCDR-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD C[C@H](Sc1cccs1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938093 KREHEEZXXCEEEJ-AOMKIAJQSA-N 490.412 0.679 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1 1835939226 ICXDBZSJEDVSHK-XMMPIXPASA-N 464.283 0.496 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457792 RNEXEKSCQOQSOJ-DEOSSOPVSA-N 497.508 0.053 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cnn4ncccc34)CC2)CC1 1837919396 MGIZRQUMGHLCTP-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920017 BYSFWEDXGHPKKF-FOCLMDBBSA-N 457.336 0.019 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3c(O)cc(O)cc3O)CC2)CC1 1837921391 GQRVZJTWKPFWRW-UHFFFAOYSA-N 484.314 0.409 50 20 JCGD C[C@@H](S)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054108 HDSDBQQABLKJRX-VGOFRKELSA-N 479.603 0.107 50 20 JCGD CNC(=S)NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839153847 TUSZSYIYEFHUGM-IAGOWNOFSA-N 455.408 0.163 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccn1 1840032672 GYJMGEFDIRVGTI-DJJJIMSYSA-N 469.336 0.893 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1 1840033933 VCYDPTYNOYDUIL-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD CC(C)[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1840106406 FWANFFHDUAFVTH-HOIFWPIMSA-N 492.013 0.982 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(O)c4ccn(C)c34)C2)C1 1840154540 YSXCNMNNCMEKHG-KKSFZXQISA-N 466.922 0.603 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cc(Cl)ccc4n3)C2)C1 1840184272 GDYMYDCJKRBGKV-QFIPXVFZSA-N 492.964 0.431 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cc1 1840188014 JVUVCZITTYLYFH-LJQANCHMSA-N 479.382 0.893 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1 1840346324 RBVBINUEOIJGFZ-IKUOUCRASA-N 499.572 0.480 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840895515 WPZZQZAWMUHCJO-GOSISDBHSA-N 464.009 0.568 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(c4ccccc4)(C1)C3)CCO2 1840953257 BMPOWLJMLTWJCZ-WZDPVOGJSA-N 490.365 0.558 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C1)C(=O)NC[C@H]2C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841354749 UFDODZNVVULSPY-DFFLPILJSA-N 484.981 0.163 50 20 JCGD COc1cc(CC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc(OC)c1OC 1841784560 VGEVJFNALNUIIJ-UHFFFAOYSA-N 468.315 0.452 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)C(=O)c2cccn2C)C1)NC(=O)NCc1ccccc1 1846650993 QLRDAQYSHBLXHP-UHFFFAOYSA-N 466.542 0.757 50 20 JCGD Cc1nnc(NNC(=O)CCc2nc3cc(S(=O)(=O)N4CCCCC4)ccc3n2C)[nH]c1=O 11547812 MUZAHELLAOFDJO-UHFFFAOYSA-N 474.547 0.611 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)c2ccccc2c1=O 110326482 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CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1799366521 QPTNJNQSCJOADY-XXUMUBMXSA-N 482.347 0.542 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2 1800755943 APKRPZUONWPVPD-YGSHXTJESA-N 451.321 0.953 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2F)[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1800766010 KDPAOZBQBLLIMK-KVBVCBKMSA-N 489.972 0.912 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(S(C)(=O)=O)ccc1F 1800848454 DHCCNIVWKOZYMC-QDMKHBRRSA-N 468.551 0.854 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(N3CCCC3)ccn1)C2 1801011467 OHVLRYDUSCJUJN-FAQVEIGNSA-N 458.563 0.258 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1)C(=O)C(=O)O 1806346172 APMASHBERZRMLW-CZUORRHYSA-N 455.309 0.415 50 20 JCGD CN1CCC(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1807367092 XGGFNPCBLLPLFK-IFMALSPDSA-N 450.348 0.423 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(=O)n3O)C2)CC1 1807553789 AKDMKPPXMBMAQF-UHFFFAOYSA-N 454.487 0.243 50 20 JCGD CN1CCN(C2(C(=O)NC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@H]3c3cccnc3)CC2)CC1 1807950110 KIJRWHHBGXUDKD-REWPJTCUSA-N 485.633 0.240 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1[nH]nc2ncccc12 1808106962 MJCSNLYGCTYKJQ-LAUBAEHRSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1n[nH]cc1[N+](=O)[O-] 1810632905 LBDUJVLWTHZSSH-KXBFYZLASA-N 464.247 0.026 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1813072192 BBPSZZAEFMFRLQ-VTCZHREGSA-N 456.591 0.801 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1 1813072387 CTUFHOZDNMCIDO-JTSKRJEESA-N 485.545 0.187 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCSCC2)n[nH]1 1814415179 FQWZAQNNFMORMQ-QGZVFWFLSA-N 472.575 0.763 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1 1816119387 CEVTVCNDJHHRQE-IBGZPJMESA-N 497.342 0.508 50 20 JCGD COc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nn1 1817472514 UVCVLFVFRRGHAG-KRWDZBQOSA-N 450.264 0.508 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)[nH]n1)c1ccc(B(O)O)cc1 1817472770 XCGFPHNBDWTLLJ-CYBMUJFWSA-N 477.212 0.846 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)c4cccc(B(O)O)c4)n[nH]3)nc2N1 1817474471 GTVRZJVFMKRGKQ-LJQANCHMSA-N 488.313 0.989 50 20 JCGD Cn1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c2c1CCC2 1818717120 GGSQSTJGNLHNIJ-LJQANCHMSA-N 462.319 0.931 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CC1 1819401924 GHZTYFZXJQHNBW-IBGZPJMESA-N 483.577 0.352 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](N)c2ccccn2)[nH]n1 1819402102 NDGIDXZNYYHEAT-PKOBYXMFSA-N 463.502 0.809 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1cncnc1)CC2 1819796777 FTBIGANFSYZRDY-ZDUSSCGKSA-N 466.527 0.790 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)nc1)CC2 1819797383 BEQNPOLJVCPPOJ-NSHDSACASA-N 453.484 0.782 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CNC(=O)C1)CC2)NC(=O)NCc1ccccc1 1822518821 VKABJHVCTIVWRW-HOTGVXAUSA-N 499.597 0.537 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc2)CC1 1829693843 YFMUXKIPTRSWNF-REWPJTCUSA-N 480.993 0.108 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccc(Cl)cc1 1830259839 BONVKHSOJWUOLX-XDHUDOTRSA-N 486.761 0.894 50 20 JCGD COCCn1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1 1830538644 LTYIRQUWRQLTJT-DNVCBOLYSA-N 473.368 0.631 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)C(C)(C)C)CCO2 1830630252 JFDNLKDHSKOFGZ-AUSIDOKSSA-N 493.513 0.997 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737272 CSMKKLGGORWIBF-VCAMNPENSA-N 493.960 0.390 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2 1832162634 QGSMZMFMLIKKLU-RRFJBIMHSA-N 451.269 0.992 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2 1832166256 KYAYJVXMRBRKFW-NILFDRSVSA-N 461.275 0.930 50 20 JCGD CN(C)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549207 HFUBVVYNVSKNMW-KKSFZXQISA-N 477.002 0.527 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn(C(C)(C)C)n1)CCO2 1833587118 JEIPNJVCXZISRN-OTZYPNAKSA-N 499.572 0.842 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncc[nH]3)CCO2)C1 1833712487 LMBOGCJYLNDIQP-VBKZILBWSA-N 471.942 0.612 50 20 JCGD Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cs1 1833818474 GVRARYHGVXSRFM-UHFFFAOYSA-N 470.404 0.559 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CN(C)C(=O)OC(C)(C)C)CC2)CC1 1834555341 AAYHPIRCZAVPPP-UHFFFAOYSA-N 496.653 0.798 50 20 JCGD Cc1cccnc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797407 IWZNTTXOSYJJKQ-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc4c3OCCO4)CC2)CC1)c1cccc(B(O)O)c1 1834799972 JVTZQDFOLHRLHN-UHFFFAOYSA-N 493.369 0.637 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCC#N)CCO2)C1 1835354761 ADCGPVBQNULYKG-YWZLYKJASA-N 458.943 0.879 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](F)Cl)CC3)CC2)CC1 1835439974 JVCLXGFEIWVQOG-QGZVFWFLSA-N 467.007 0.764 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2 1835467085 KEPGUDUOAXEDCN-IBGZPJMESA-N 470.253 0.169 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4c(Cl)cccc34)C2)C1 1835932051 LKQSHPMJQWRHGU-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD O=C(Cc1ccc(Cl)s1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935257 KTSPCZGKXFZTSF-NRFANRHFSA-N 478.763 0.394 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3c(F)ccc(Cl)c3F)C2)C1 1835941159 JFKAZQFAHIRBMB-JOCHJYFZSA-N 494.687 0.682 50 20 JCGD O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)CCO2 1836687588 MHUTUSGEBPMLFR-DXIQSLLYSA-N 469.941 0.878 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)C(C)(C)C 1836801036 HBMBHJRPWGJBAZ-QFIPXVFZSA-N 481.638 0.909 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1 1837443366 HNBUILLSLXDQPY-ZIQPLYDASA-N 487.561 0.049 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1837713271 RPLGAVPGHVMLTD-QFIPXVFZSA-N 476.606 0.977 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1 1839625551 ZYLXKKFQIVRQRL-KPZWWZAWSA-N 470.299 0.722 50 20 JCGD NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839865620 MTCXZILHLAAYRU-LAUBAEHRSA-N 482.375 0.715 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1 1839989202 UNZFMQNPERZHTH-ACJLOTCBSA-N 464.357 0.751 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1 1840102970 FGSWKPHGQQKXQW-HRAATJIYSA-N 450.923 0.747 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1 1840102972 FGSWKPHGQQKXQW-IIBYNOLFSA-N 450.923 0.747 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1840154265 QVTUSOYANFTCNT-HRAATJIYSA-N 495.920 0.002 50 20 JCGD COC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1840321434 BXDUZSPDXYLUIL-DYESRHJHSA-N 498.374 0.805 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1840379130 YVVJQNIMYGKDSQ-MLGOLLRUSA-N 462.370 0.384 50 20 JCGD C[S@](=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841348431 RIQMLSBIKLNLLB-GKXFIBDASA-N 466.000 0.451 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CN2C(=O)COc3ccc(Cl)cc32)C1 1841855655 RRCANQIVWMREEN-UHFFFAOYSA-N 483.717 0.262 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011859 CHICDOQCVGHQMC-SFHVURJKSA-N 479.342 0.746 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012404 MEFVFIOLDUIGDU-GOSISDBHSA-N 469.347 0.440 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C[C@@H]2C[C@@H]21 1843012767 LPXWWHOZBKDTAG-WDSOQIARSA-N 469.347 0.581 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)CO2)C1 1843014997 XHCVNKKBDYYPLC-GOSISDBHSA-N 499.373 0.209 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(F)cc1 1845005808 RUUVHDMAOSEZOO-FQEVSTJZSA-N 453.279 0.200 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)C1 1847549480 UEOYWGHDTWAADD-QXGSTGNESA-N 457.531 0.870 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1)C1CC1 1847620423 NHQOBUHRCRLMGB-AABGKKOBSA-N 471.363 0.875 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cn2cc(Br)c(=O)[nH]c2=O)cc1 23569270 JRNGEGRAJSLDDO-SNVBAGLBSA-N 455.265 0.313 50 20 JCGD CCn1c(=O)nc(O)c2c(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)cc(C3CC3)nc21 728723697 SEYDAULDCKSNRW-UHFFFAOYSA-N 486.510 0.706 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCO[C@H](C(N)=O)C2)cc1 747775598 FNEGLWQUEHUYSX-BXBOZWQASA-N 452.471 0.054 50 20 JCGD C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)CNC(=O)c1cccs1 751209313 OTESPQHBCQIJTI-NRFANRHFSA-N 455.496 0.624 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cnn(Cc3ccccc3)c2)cc1 751261802 LLFKVCXNXOTSOE-UHFFFAOYSA-N 477.568 0.870 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)cc1 751280436 QWDSZCSENMMCJP-UHFFFAOYSA-N 474.586 0.518 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2OC)c1 825791635 RLKMWFSBJZABQA-UHFFFAOYSA-N 478.527 0.598 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)cc1 913081459 QDCAOCVUYAOLFP-SFHVURJKSA-N 478.538 0.989 50 20 JCGD CCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(C)=O)c2)c2ccccc2c1=O 913572993 CSOTUOUGBAMUDT-UHFFFAOYSA-N 471.495 0.359 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cnn(C)c2)c1 917718645 SZRUNUMCEXJIGK-UHFFFAOYSA-N 465.513 0.853 50 20 JCGD Cc1ccc(S(=O)(=O)N2Cc3ccccc3C[C@@H]2C(=O)NNC(=O)CN2CCCC2=O)cc1 920826724 OIQZBOTZXMLRMT-HXUWFJFHSA-N 470.551 0.880 50 20 JCGD COc1ccc([C@H](CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)NC(C)=O)cc1 921173785 RMPFTTFZCBXZEX-PXNSSMCTSA-N 471.466 0.793 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc3ccccc13)CCO2 1779030859 YJAALKVZJLOBSZ-DEOSSOPVSA-N 476.493 0.696 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779421404 KROSVABHUTWNIK-ZHTARJIDSA-N 473.335 0.023 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)N1CCOCC1)C2 1780712709 VQGMPWQSHZMGNU-LVFSCSRESA-N 452.379 0.387 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H](F)Br 1780771548 KXCVTRCINOLMJO-RVKKMQEKSA-N 457.105 0.184 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCN(C(C)=O)CC1)C2 1781901482 ORBMHWKNEQUIGJ-WAOWUJCRSA-N 487.439 0.838 50 20 JCGD Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc(C)c1C(=O)O 1782173825 ATMWRCFJVRRUSP-QHCPKHFHSA-N 460.531 0.818 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)nc2nccn12 1782213477 VJLKWYBKRJYLDX-WZONZLPQSA-N 471.562 0.538 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCOC3=O)C[C@@H]21 1785075586 REZMQZVDFUEXLX-VGWMRTNUSA-N 488.969 0.550 50 20 JCGD CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1785584824 XSIFNHDNTLVVKC-DVECYGJZSA-N 489.378 0.503 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COc3ccc(C(=O)OC)cc3)C2)C1 1785721991 GEDBUXHHUQBOTN-UTKZUKDTSA-N 454.907 0.936 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C)c3)[C@H]2C1)NC(=O)NCc1ccccc1 1786033734 AHTDGEFPPZLHMP-JBACZVJFSA-N 483.573 0.360 50 20 JCGD N#Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1 1786978580 AKCHXXPBZCAPOG-PMVMPFDFSA-N 461.327 0.464 50 20 JCGD CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CS(=O)(=O)C4)[C@H]2C1 1787150798 BOOKOHQIZRUHSC-HUBLWGQQSA-N 458.968 0.696 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)[S@@](=O)c1ccccc1 1788609772 IUKIVNVTWNQSQF-LTUPOAQJSA-N 499.593 0.475 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)ccc1C 1789616709 OXJLQXHRJJUXSW-VCOUNFBDSA-N 452.316 0.591 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790267810 IAXBIGXHIASKGS-BUKVSMQUSA-N 496.329 0.248 50 20 JCGD COc1ccc([C@@H](O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cc1 1792716302 WENHHZNGTFBGDH-UPGWYZPTSA-N 483.525 0.452 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792983995 WPTAVRLNAUDHRM-IXXKSVCMSA-N 457.955 0.645 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1793154613 PLIJBONJHRLPKE-HAEOWDPNSA-N 459.971 0.869 50 20 JCGD CC(C)c1csc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)n1 1794256006 JIAMPIGZIMFERD-FVCICTRLSA-N 458.544 0.782 50 20 JCGD O=C(CCc1ccccc1Cl)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1795314641 YIXWGMHQUWXDDJ-OPMZPASUSA-N 456.735 0.856 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2ncccc12 1796800398 RNBDBXGCYLMUAD-USGNIVHTSA-N 460.494 0.750 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1796841313 UUYNFXDVYZUOMH-RDGPPVDQSA-N 475.351 0.158 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798577685 MJVUCDIMGSOEMM-WJMWBRGCSA-N 482.589 0.899 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799062118 UBXQTUUALGNXTF-FEJSZKPUSA-N 492.341 0.105 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccco1)C2)NC(=O)NCc1ccccc1 1799094931 KJZCRSVDMLZQAV-RMFSNUHRSA-N 483.525 0.398 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)(C1)C2 1800699495 OETZBDZNGDRUIG-COZCDLTHSA-N 457.955 0.623 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnccc1C(F)(F)F)C2 1801010767 VCEQVUCLXMLESI-VPTLXERWSA-N 485.507 0.996 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)c(C#N)c1)C2 1801012426 FUPMDIKUMSLFOH-CWPLJXCYSA-N 492.374 0.897 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801012494 KOIDROCJDNDRBV-UPHUGPLXSA-N 459.547 0.205 50 20 JCGD COCCOCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801017925 AGKFIXPXXZZHSE-MIFYACCESA-N 457.351 0.076 50 20 JCGD Cc1ccn(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1804622642 CQHYOPCMFUUQNN-UTKZUKDTSA-N 462.514 0.605 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CCN2CCOCC2)[C@@H]1c1cccnc1 1806951037 LSMYQAYAYCUNJM-XLAYELQVSA-N 495.584 0.944 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C2CC(O)C2)[C@@H]1c1cccnc1 1808410291 UKDIWRPHXAWRIL-VGAYCEGGSA-N 452.515 0.992 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1810324977 LDLOVORFYNIZSQ-ZJBJCVSYSA-N 468.562 0.751 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)C#CC(=O)O)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1812877607 MHHSPHHQRHQEJP-YKSBVNFPSA-N 492.536 0.522 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](N)c2ccccn2)n[nH]1 1817336737 OYWCCRFJNDMUFA-PKOBYXMFSA-N 463.502 0.809 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817478802 HYVQODXUHPNZBD-HKUYNNGSSA-N 455.324 0.700 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1)c1n[nH]c2c1CS(=O)(=O)C2 1817683487 ZXIWONPFMONDAO-CHWSQXEVSA-N 456.912 0.467 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCN(C(C)=O)CC2)n[nH]1 1818967754 YLFHIZZNRCIVOI-RDJZCZTQSA-N 454.959 0.820 50 20 JCGD CN1CCCC[C@@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793913 VBHFBJOYKWAKGV-MLGOLLRUSA-N 457.560 0.852 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cnccn1)CC2 1819793953 WBPHFGFPCFCEFT-NSHDSACASA-N 452.500 0.400 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cn2ccncc2=O)n[nH]1 1821658115 OWGDTPPSNRRXSS-OXVLKEGXSA-N 479.501 0.793 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)C(=O)C(=O)O 1824673204 BYXQNBUXAIKCMF-LDWIPMOCSA-N 451.274 0.289 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@H]1CCc2nc(NC(=O)CNC(N)=O)sc2C1 1828317531 HKBILCDWYARMHB-ONGXEEELSA-N 474.971 0.856 50 20 JCGD CN1CCN(C2(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1828923954 GJQFLUCBQRERRJ-QFIPXVFZSA-N 497.644 0.698 50 20 JCGD CC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(O)O)C2)C1 1829219158 JELAXKNDYRGQOD-KKSFZXQISA-N 453.923 0.767 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CN)C2)C1 1829341119 XHYMJWFQCDNWCK-DYESRHJHSA-N 452.939 0.651 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1830535242 KDPOYQMWGQZDLT-QRWLVFNGSA-N 483.363 0.299 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cn1 1830538442 FVBVFJCYBORIII-XOBRGWDASA-N 484.347 0.969 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1830544416 XMYRXLATDNOYHR-ZHRRBRCNSA-N 495.418 0.871 50 20 JCGD O=C(c1cnc2cc(Cl)ccn12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724518 XXMUZYCSNYRNQJ-BEFAXECRSA-N 457.314 0.657 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnnc(Cl)c3)CC2)CC1 1833892338 LAGJCPOLDAXRMR-UHFFFAOYSA-N 465.986 0.688 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCOc1ccccc1)CCO2 1834833165 LCDSGMIMJBWWAY-QHCPKHFHSA-N 462.547 0.285 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cn4cc(Cl)ccc4n3)C2)C1 1835928386 NOKRVRCYSUFEHE-QHCPKHFHSA-N 498.732 0.051 50 20 JCGD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(C)n1 1836058883 GBJGCUORLHMCGL-UHFFFAOYSA-N 464.375 0.877 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cnc(OCF)cn3)CC2)CC1 1837306793 WIBXFDTUFGXAMK-UHFFFAOYSA-N 486.309 0.388 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H]3CCN(C(=O)OC(C)(C)C)C3)CCO2)C1 1838505455 FUNFVERMHGZZIB-JKSBSHDWSA-N 489.997 0.954 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccnc4c3OCO4)CC2)CC1 1838524367 OZMLFDGWMLMLRQ-UHFFFAOYSA-N 475.546 0.796 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)[C@H](C)O4)CCO2)C1 1838589206 MZYAAOKUXVQURH-KHJUTWJGSA-N 481.933 0.730 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)cc3F)CCO2)C1 1839005226 GDZMLBSRHCBDBS-QFIPXVFZSA-N 475.452 0.347 50 20 JCGD COCc1oncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200254 FCDXEQQWHYOANH-BBRMVZONSA-N 450.261 0.582 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1839200928 SJYAGEFEBJKMTK-GDIGMMSISA-N 486.294 0.868 50 20 JCGD O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201939 NZELCILMHQSKJJ-HOTUBEGUSA-N 450.074 0.824 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(OC(F)F)cc1)CCO2 1839331300 YVFOTMODVFJQPL-HSZRJFAPSA-N 490.268 0.352 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1 1840156276 PNYJBPWFSLTESZ-XMSQKQJNSA-N 452.935 0.874 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3scnc3C3CC3)C2)C1 1840183577 MTVBSKHPDSOZLD-OAQYLSRUSA-N 465.576 0.464 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4nc[nH]c34)C2)C1 1840184072 PZGDMCDEOUBCSE-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1841474688 LSBFZAKYEZUYTE-RBUKOAKNSA-N 471.363 0.877 50 20 JCGD Cc1cnc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)cn1 1842417957 IQKKWGRWTRJFOT-UHFFFAOYSA-N 451.531 0.948 50 20 JCGD O=C(CCS(=O)(=O)c1ccccc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013279 BOWYTRGZXJJVKG-UHFFFAOYSA-N 456.329 0.047 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2O)C1 1843825647 ZPAXVQWWXBUUIG-SJORKVTESA-N 481.594 0.181 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CCCC13CN(C(=O)CCC(=O)NN(C)C)C3)C2 1845863501 CXQWHGNITYUXNH-MRXNPFEDSA-N 474.562 0.199 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1 10159694 ZNWLOXLRAKUDDK-UHFFFAOYSA-N 486.510 0.019 50 20 JCGD CCOc1ccc(-n2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2C)nn1 23686734 MQFUXHHIUOUYEI-UHFFFAOYSA-N 473.515 0.695 50 20 JCGD O=C(NCc1cccc(S(=O)(=O)N2CCCCC2)c1)NNC(=O)c1ccc(-n2cnnn2)cc1 726272238 GQIGGSCQQYUCQU-UHFFFAOYSA-N 484.542 0.981 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc3c(c2)OCO3)CC1 727942958 OGVQZHXOYKRSOW-UHFFFAOYSA-N 450.473 0.882 50 20 JCGD C[C@@H](C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1)N1C(=O)NC2(CCCC2)C1=O 728213567 AFKGBBKMAIQKRR-HNNXBMFYSA-N 478.575 0.319 50 20 JCGD O=C(COC(=O)c1ccn(-c2ccc([N+](=O)[O-])cc2)n1)NNC(=O)[C@H]1COc2ccccc2O1 728334324 XROVDINEACCQEI-GOSISDBHSA-N 467.394 0.925 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cnc3c(c2)c(O)nc(=O)n3C)cc1 728502809 QMRJXDOAYIHMLO-NSHDSACASA-N 463.472 0.210 50 20 JCGD O=C(COC(=O)Cn1nc(-c2ccc(F)cc2)oc1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 749724017 CPWJIZISYBEJJZ-UHFFFAOYSA-N 459.346 0.555 50 20 JCGD C[C@@H](O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)OCC(=O)NNC(=O)c1ccccc1 776971712 HCHRLFKVISUVHB-QVKFZJNVSA-N 485.518 0.872 50 20 JCGD NC(=O)Nc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 863950079 RDVUFVQKTKZBIG-UHFFFAOYSA-N 475.527 0.592 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cnn3cccnc13)N(S(C)(=O)=O)CC2 913476747 UQANMQABEXEXBD-MRXNPFEDSA-N 488.526 0.457 50 20 JCGD O=C(CCCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)NNC(=O)[C@H]1COc2ccccc2O1 915806215 JCTBWTIGCDKDQR-RTBURBONSA-N 484.465 0.132 50 20 JCGD O=C(NC[C@H]1Cc2ccccc2O1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916515931 COLWZVINTLEHCA-QGZVFWFLSA-N 460.512 0.655 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2)cc1 917387530 ZHAGNJGYYSFBLW-UHFFFAOYSA-N 498.565 0.009 50 20 JCGD COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 917720649 YENATBWMJLMQFE-UHFFFAOYSA-N 484.556 0.205 50 20 JCGD Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)cc1 917733242 NMGBXAHLMUIEEO-CQSZACIVSA-N 488.565 0.507 50 20 JCGD CC(C)(C)NS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 919684795 IIUDMCVFYMDHFW-UHFFFAOYSA-N 460.578 0.340 50 20 JCGD CS(=O)(=O)c1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2ccccn12 921165011 FLQSLBRJRNMUOB-UHFFFAOYSA-N 491.551 0.597 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cn2ccccc2n1 1778475338 JSFWHGWTERBJRB-HYBUGGRVSA-N 462.315 0.455 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CC34CCCN3CCC4)CCO2)C1 1779032576 NQKNACWCVBNTSX-HSZRJFAPSA-N 456.547 0.147 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1779293924 GZHQLQZYKZPNRJ-SPLOXXLWSA-N 464.595 0.674 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C/N=C/c1ccco1)C2 1779372256 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CC(C)(C)OC(=O)N[C@H](CCO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1784196719 KGHRFLOTIQVGIL-RMEBNNNOSA-N 451.923 0.776 50 20 JCGD C[C@@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)n1cnnn1 1784592439 MWBMRIGLRAGJAX-NJSLBKSFSA-N 471.946 0.196 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS(=O)(=O)N3CCCC3)[C@H]2C1 1787506181 OOPZMLJIAMJFNX-ULQDDVLXSA-N 461.657 0.243 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)(Cl)Cl)C[C@@H]21 1788609782 JSYCFDPGTFNCCH-XDTLVQLUSA-N 464.737 0.649 50 20 JCGD COc1c(Cl)ccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789339901 SGDYIURIIUBIQX-ZVZYQTTQSA-N 473.722 0.331 50 20 JCGD CC(=O)N[C@@](C)(C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccccc1F 1789966268 HYCTXJFNCZUFBN-PZBJXUGBSA-N 469.941 0.756 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnncc3C(=O)O)C[C@@H]21 1790960344 CCZVFXRWGDXVHI-HJPIBITLSA-N 455.309 0.942 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1 1791064680 CQJONFUYROKGPE-LNWTYNMOSA-N 470.368 0.220 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(N4CCOCC4)n3)C[C@@H]21 1791253655 DTOHYVLOFANFLY-DWRORGKVSA-N 466.966 0.765 50 20 JCGD COc1ccc(F)cc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791376876 YDTCZSQZUMFEHI-BUKVSMQUSA-N 470.306 0.350 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1 1792005082 ONXBZKAZRMKYLS-IHPCNDPISA-N 459.547 0.611 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792979058 SARMYAHHHYZPDS-SVZOTFJBSA-N 491.969 0.022 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1793468215 HYQHBPSUTFUGPO-YVSFHVDLSA-N 489.013 0.870 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1794405049 QEBGLHXQJUYBHH-BAESOJJISA-N 478.340 0.520 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(Br)c1F)C2)c1ccc(B(O)O)cc1 1795735823 FSZRABFUWIRXBR-HBCWATKFSA-N 491.122 0.785 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3cnco3)c1)C2)c1cccc(B(O)O)c1 1795739929 RUHJKBUEUQXNIB-HATOLVCRSA-N 461.283 0.538 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)C1 1796191342 AWMWBDVEDGJNOP-REPLKXPHSA-N 471.363 0.875 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2 1796393099 OKVCLPJMWVCOAY-KYHPRHEASA-N 473.643 0.967 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(O)[nH]1 1798177519 MXWXQZYHRMQDNX-OPDFLTKYSA-N 457.915 0.451 50 20 JCGD N#Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(Cl)c1 1799749412 RXKVMOUNCIPDGC-CWPLJXCYSA-N 453.691 0.408 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F 1800333420 QYFMMOPERGRNIE-XBHGAPDLSA-N 478.452 0.526 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2 1800975321 MMQALEGHWMCVEI-NPJQDHAYSA-N 463.959 0.370 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)c1ccccn1 1801466701 BJYMFRLJJOKBIY-KDCMMGCKSA-N 452.515 0.909 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(c3ccccc3)(C1)C2 1802217442 VBWKELBNAXNTOQ-LJAOBULASA-N 460.339 0.692 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C2CC(O)C2)[C@@H]1c1cccnc1 1803044570 YWHRDSUBXIVCEY-GYUCPTMGSA-N 452.515 0.992 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360352 AKMSDCIBKMQKCH-KKSFZXQISA-N 462.271 0.201 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1807368534 UXMATBVTHWVZFT-MJGOQNOKSA-N 451.288 0.034 50 20 JCGD Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1 1807534366 XEPJXVUGUJVGOR-UWJYYQICSA-N 465.344 0.484 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C(=O)NCC(C)C)[C@H]1c1cccnc1 1808417533 LBMULNVPRUBHCM-PDSIDNGESA-N 481.557 0.994 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303501 TZKHNUPTRPTQBV-MDYRTPRTSA-N 477.529 0.328 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813020596 DZKJOIXJBGZJGP-CWKRKGSWSA-N 491.353 0.836 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813072298 AFUKQPITSVBYFL-GWJPWWOOSA-N 495.584 0.674 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813089845 AJXNHANHTAETFJ-IHPCNDPISA-N 457.361 0.195 50 20 JCGD COc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1 1816610284 VFBHXXUFZMDJJO-KRWDZBQOSA-N 450.264 0.508 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817474923 JCOWXMYUJIBEPV-GUYCJALGSA-N 458.280 0.957 50 20 JCGD COCCn1nccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1818248229 DWFQYGKBJRZASE-GOSISDBHSA-N 466.307 0.552 50 20 JCGD COc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1OC 1821794923 SLKSTHXNDHQWKI-CQSZACIVSA-N 482.327 0.775 50 20 JCGD C[C@H](O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551137 KCZYOXUDSPYCNP-LUQKVYGDSA-N 453.923 0.419 50 20 JCGD N=C(N)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1828974644 PXRSSSZFGJOWMT-JXFKEZNVSA-N 468.917 0.456 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830157282 RVBBXJATKLRRLU-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n(C)n1 1830535844 UOAPFRMFSDDPIR-UGSOOPFHSA-N 459.341 0.530 50 20 JCGD CCn1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c2ccccc21 1830723922 UVWKHQXWVVYJTM-UTKZUKDTSA-N 450.923 0.726 50 20 JCGD O=C([C@@H](O)CCl)N1CCO[C@@]2(COCCN(C(=O)C3(C(=O)Nc4ccccc4)CC3)C2)C1 1830724783 CDCGVHRARHNVOD-UWJYYQICSA-N 465.934 0.461 50 20 JCGD CC(C)(C)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549224 HUPLUTFBPYVXAY-AOMKIAJQSA-N 491.029 0.963 50 20 JCGD Cn1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)n1 1832549423 NVMDWPRZKUWHGZ-JTSKRJEESA-N 499.996 0.551 50 20 JCGD COc1ccc(OCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1833186686 USMMSYZYIJACFS-UHFFFAOYSA-N 495.385 0.639 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncn(-c4cccc(F)c4)n3)CCO2)C1 1833354074 LSNODSYSGSUDAC-UWJYYQICSA-N 481.912 0.730 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(=O)[nH]c1C 1833390360 WDZZNXXWFORYCF-ADLMAVQZSA-N 457.325 0.240 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)n(C)n1 1833439171 NEABSEPWJLNFNI-SCLBCKFNSA-N 459.341 0.530 50 20 JCGD Cc1cccnc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833575796 MCJDBDBNFMMDGA-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1 1836337473 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CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1839146301 MXTWCYQKKJWWPN-YJYMSZOUSA-N 454.936 0.843 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c1 1839477133 YPVLJRIJPINULM-CRAIPNDOSA-N 466.890 0.834 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cc(C)on3)C2)C1 1839965413 XTIVETNXSVVPEG-AUUYWEPGSA-N 487.351 0.343 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840030734 VFOKAQBKTFOQST-LRDDRELGSA-N 453.355 0.132 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccc(F)c34)C2)C1 1840154710 DCRNGQKXIYAUBJ-YWZLYKJASA-N 454.886 0.797 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COCCNC(=O)OC(C)(C)C)C2)C1 1840154979 LZIOIKQYWWLYEV-HRAATJIYSA-N 493.985 0.238 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4cnccc34)C2)C1 1840184331 HDCVDKJZBJFZGD-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840189814 MSTODTGYUOVCJX-ORAYPTAESA-N 459.330 0.460 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1841580217 LJTRWSQNYGRAAB-KGLIPLIRSA-N 481.015 0.650 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(N3CCOCC3)cn2)C1 1842265684 ZEWTXCILECFEKZ-WPWMEQJKSA-N 479.541 0.869 50 20 JCGD COc1nn(C)cc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038474 GVLPZBYVINXFMA-UHFFFAOYSA-N 469.546 0.592 50 20 JCGD Cc1cc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)n(-c2cccc(=O)n2C)n1 1846384645 QFQHQVLXTLWEJI-UHFFFAOYSA-N 469.546 0.069 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CN2CCN(C(=O)OC(C)(C)C)CC2)C1 1846968079 FRLJQZPLKGNFMU-UHFFFAOYSA-N 480.610 0.116 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)COc1ccccc1)c(=O)n2Cc1ccccc1 10161351 SEOKQNOGJDWHBD-UHFFFAOYSA-N 476.493 0.654 50 20 JCGD CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc21 15248456 XRRDVJNUIVOYOM-UHFFFAOYSA-N 466.541 0.469 50 20 JCGD CC1(C)CN(CCNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CCO1 726262743 NRLFTSFELLTEPA-UHFFFAOYSA-N 497.618 0.081 50 20 JCGD COc1cc(C(=O)NNC(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)cc(OC)c1OC 726277103 IHCKAHRGHKKNEP-OAHLLOKOSA-N 451.524 0.599 50 20 JCGD O=C(CSc1nnc(-c2cccs2)n1C1CC1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 728518780 YJIQOVMCTVYTDG-SNVBAGLBSA-N 456.575 0.951 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C/c1cncc(F)c1)c(=O)n2Cc1ccccc1 729310523 MPYFLWARYGHANB-CMDGGOBGSA-N 491.483 0.823 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1Br)c1cnn[nH]1 729456117 RNEINJMJXRWPLB-VIFPVBQESA-N 473.309 0.099 50 20 JCGD C[C@@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)C[C@@H](C)O1 729507000 LSDHSKLAVVMAFG-IAGOWNOFSA-N 478.575 0.354 50 20 JCGD CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(O)c(CN2CCCCC2)c1 730571948 ZEJJDXQYHOCVBP-UHFFFAOYSA-N 460.560 0.803 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)COc2ccccc2O)cc1OC 730778743 LUZFUCSYSWJQKZ-UHFFFAOYSA-N 453.473 0.304 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)N1CCOCC1 745996163 PEXNHWAHVAHYFE-AWEZNQCLSA-N 495.421 0.922 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1 759794784 UGYFSTPKEBHVCT-ZDUSSCGKSA-N 454.530 0.360 50 20 JCGD Cc1nnnn1/C(=C\c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 818374964 GIMDBUBAGATGPT-LZOLKVDOSA-N 482.428 0.649 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)cc1C 844255583 WPTBRMDEAWYSFC-UHFFFAOYSA-N 466.541 0.692 50 20 JCGD COCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)c1C 897557298 JOPVUQAAAQCIRL-NNVROAHOSA-N 492.598 0.533 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN(C(=O)Cc2ccccc2)C1)NNC(=O)[C@@H]1COc2ccccc2O1 914803786 IJAGQJALJXFHOW-NQIIRXRSSA-N 481.505 0.998 50 20 JCGD CCOC(=O)NCCC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 915259759 VMUXUXMDTPPUGA-OAHLLOKOSA-N 486.547 0.236 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1 916648995 GQLVZZABCSYBNM-IBGZPJMESA-N 487.538 0.925 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCN2C(=O)NC3(CCCC3)C2=O)cc1OC 918058576 ZTNPAGARKWNXTN-UHFFFAOYSA-N 462.459 0.263 50 20 JCGD O=C(NNC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1)N[C@H]1CCS(=O)(=O)C1 919889371 LPKQDPAVLSOFCU-AWEZNQCLSA-N 477.524 0.379 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cccn1C)N(S(C)(=O)=O)CC2 920597905 BTMHYYFPYIBFRI-INIZCTEOSA-N 450.517 0.752 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778055356 ORZAVSVHJQEXAJ-QFIPXVFZSA-N 484.589 0.866 50 20 JCGD Cc1cc2nnc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)c(C)n2n1 1778556172 PHQFODDIDYFWBA-STXHMFSFSA-N 450.927 0.468 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1778720908 UFEGWANEOFISKT-NRFANRHFSA-N 469.527 0.460 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccn3cn1)C2 1779372284 DQSXGVUNMRWKFB-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)ccn3C)C2)C1)NC(=O)NCc1ccccc1 1780103593 IWQPTJLXJZHDQW-RUZDIDTESA-N 496.568 0.175 50 20 JCGD CC(C)(C)n1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)nn1 1780192857 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)[C@H]2C1 1789768343 DAZAFBGIPFCBEN-PRYFDBBFSA-N 498.584 0.501 50 20 JCGD Cc1ncc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)s1 1791734548 LKXFWXFPQMSBRU-KFLKEAKISA-N 470.555 0.757 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cccc(Br)c3n1)C2)[C@@H](O)CCl 1792983855 QZGWKYVWWDCIRY-JLUCKKNBSA-N 471.739 0.900 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1793248186 SJKHOQFHAOZLNF-KRXQYRFLSA-N 490.561 0.213 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncnc1)C2 1793880962 MEVCFAWZVKAPON-FZKCQIBNSA-N 453.927 0.812 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1cncn1)C2 1793882555 MJEAUGICHAVPNQ-IVSAIRAKSA-N 470.958 0.390 50 20 JCGD CC(C)(C)OC(=O)N1CCn2cnc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)c2C1 1797314693 HMKRPHNURZXZIE-YALNPMBYSA-N 497.980 0.437 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc(C)c1C(=O)O 1801012973 OYAQOAKQRHSXFM-UPHUGPLXSA-N 460.531 0.578 50 20 JCGD C=CCNC(=O)/C=C\C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1802480285 BVEBOZMIEUOVHH-CTUFNNTOSA-N 477.525 0.258 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1(O)CCC1 1807359136 FJKLCKOPZMNYKD-BSIFCXSSSA-N 451.332 0.632 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364913 UWQRSNWPIXZGJL-NTKDMRAZSA-N 484.325 0.526 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(=O)c2ccccc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365571 VQBZBMZURUEJAI-IRLDBZIGSA-N 457.295 0.964 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1808290778 AURXXPHFHCRBTQ-AZOIQLNYSA-N 456.330 0.876 50 20 JCGD O=C1Cc2cc(C(=O)NC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)ccc2N1 1809683018 BGCNFKGMKIYUGO-YADARESESA-N 484.321 0.889 50 20 JCGD COC(=O)CSCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810294266 JBQSUBHLGOCWKK-FOIQADDNSA-N 486.554 0.306 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CSCC(=O)O)[C@@H]1c1cccnc1 1810305263 JVHOVHMCXNZQCS-AUUYWEPGSA-N 472.527 0.218 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc2nccn12 1812169769 VAUSVBZQIUPXDA-SIKLNZKXSA-N 484.325 0.746 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1812774229 NCQLASJDZRCKHY-YXWQFLTLSA-N 466.336 0.859 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1812864682 JZPAGTCEDJOBGO-NORZTCDRSA-N 452.309 0.423 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1812950089 KRQJLZWKIYRGET-PBEJRMEISA-N 496.373 0.994 50 20 JCGD O=C(Cc1ccc(O)cn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813496969 YIWKCKMHFIOVHH-FDDCHVKYSA-N 460.299 0.424 50 20 JCGD O=C1CCc2ccc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)nc2N1 1815341270 VKJFITXCAPUDBY-OAHLLOKOSA-N 491.338 0.642 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cccc(=O)n1O 1816146884 UKTLOZMWMSNFJM-MRXNPFEDSA-N 451.248 0.108 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Cl)CC3)N1 1824807731 BVYUXKIUIKLCON-CBRVECNMSA-N 489.982 0.770 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1nnc3ccccc31)CC2 1826082829 DIJTZHWOAKACOU-CYBMUJFWSA-N 470.559 0.873 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCCC2=O)CC1 1826727723 YAVFAPVTFYYNGT-IBGZPJMESA-N 456.547 0.541 50 20 JCGD CN(C)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551064 HEDDTUDPCWELGH-AUSIDOKSSA-N 480.993 0.990 50 20 JCGD Cn1nncc1C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828641994 QMMDVSIJQMEYJC-PGRDOPGGSA-N 490.948 0.481 50 20 JCGD CC(=O)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829300614 GZNHSGWQFONOGI-GCJKJVERSA-N 480.949 0.174 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830737994 JNTZZQUTEYJLQA-QFBILLFUSA-N 495.381 0.413 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@@H]1OCCc3ccccc31)CCO2 1831249171 FNTMKVGZIIIREL-OFVILXPXSA-N 488.585 0.520 50 20 JCGD O=C1C[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CN1Cc1cccs1 1832750531 XQFVFPFUBVYNHJ-LUQKVYGDSA-N 485.990 0.153 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1833212418 DEIHQBRCZQAWBR-HBGVWJBISA-N 495.020 0.337 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833312884 KGXBDWRDIMIPNC-GUDVDZBRSA-N 455.983 0.913 50 20 JCGD Cc1cccc(CCC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1833743472 ZPDZXYISNWKDKR-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)cn1)CCO2 1834477189 LKINZWUDQSBBPU-QVGKIPNLSA-N 472.477 0.425 50 20 JCGD Cc1c[nH]cc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835165228 QRXLBGMPOXITSF-UHFFFAOYSA-N 453.547 0.821 50 20 JCGD CN(C)C(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1835436283 SRTSPGXUMRWUMA-NAVGAYGYSA-N 462.453 0.416 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1 1835932109 OCLXYUSURYUOFG-BKMJKUGQSA-N 478.354 0.242 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccccc1C(=O)OCCO 1836119221 NZYYPVWNVUFDNO-FQEVSTJZSA-N 481.977 0.621 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1836215750 NDITVFYJPKALRR-PJSUUKDQSA-N 496.388 0.617 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)C=CC3=O)CC2)CC1 1836673571 GYQQWKVJZXQNHG-CQSZACIVSA-N 470.364 0.941 50 20 JCGD O=C(NCCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc[nH]1 1837147213 NPRNMTOUHSCNEM-UHFFFAOYSA-N 496.373 0.127 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cc[nH]c4c3)C2)C1 1837459165 KNLSBCJJSFSBMA-XMMPIXPASA-N 478.509 0.550 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)n1 1837656258 YJKWUIXYBCJWFA-VFNWGFHPSA-N 499.406 0.774 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)n1ccccc1=O 1837689083 MZQXQMFUVGIIFG-QIIPPGSGSA-N 460.300 0.556 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn(-c3ccccc3)n1)CCO2 1838746426 FADNCAICEBMWOY-XMMPIXPASA-N 484.557 0.315 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1839144989 PXSMARSUTMDZBP-KSFYIVLOSA-N 464.950 0.964 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202549 JIECONGLEXWKEQ-DOTOQJQBSA-N 461.288 0.262 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)CCO2 1839395865 IXOZBEIWNMSGLT-VWLOTQADSA-N 490.325 0.140 50 20 JCGD COC(=O)C12CC(C(=O)N3CCOC[C@]4(CN(C(=O)[C@H](C)Br)CCO4)C3)(C1)C2 1840036567 OIIVMLTYWCIPOB-KSBHDHOUSA-N 459.337 0.570 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1840787792 QQHAZQZRVNQCGW-UWJYYQICSA-N 453.923 0.058 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CC3Cc4ccccc4C3)CCO2)C1 1840932187 XTNSAKYTMSUTSW-AREMUKBSSA-N 493.564 0.560 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2 1843415412 FZZJGQIITOVQMO-ZVHZXABRSA-N 472.527 0.436 50 20 JCGD C=CCOC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1846365744 STKOBKTXDJKZQA-GJZGRUSLSA-N 488.969 0.595 50 20 JCGD COc1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)cc(OC)c1OC 1847976085 GFAOEDUCPJKBNP-ROUUACIJSA-N 483.525 0.769 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1 15639617 ANXQPJAHOSJALV-ZDUSSCGKSA-N 497.517 0.688 50 20 JCGD COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2=O)cc1 726522792 WFCYCRHTUUDQEF-HNNXBMFYSA-N 459.528 0.798 50 20 JCGD COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2cccn2C)c1 726541237 TZSVVYGHLVAVPB-UHFFFAOYSA-N 459.322 0.787 50 20 JCGD Cn1cccc1C(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1 726541480 ZICRCZBZKYAXTD-UHFFFAOYSA-N 455.456 0.883 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCc3nnc4n3CCCCC4)nc2)CC1 727606734 DFBCJQNXNRTJCY-UHFFFAOYSA-N 491.622 0.595 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)C1 729275708 QNFVTDBUAFGYGD-MJBXVCDLSA-N 460.578 0.052 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1 729276175 YINJPHXOZNGTCO-GFCCVEGCSA-N 480.996 0.603 50 20 JCGD NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2O)cc1 730780266 SFOVMVJDNMENBN-GKUQOKNUSA-N 452.467 0.722 50 20 JCGD O=C(NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1)C(=O)N1CCCC1 748246525 BZDMEFCKYABKKD-CYBMUJFWSA-N 458.924 0.181 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(Cl)ccc3O)c2)CC1 802585564 IFLILTZDVHAULS-UHFFFAOYSA-N 480.930 0.973 50 20 JCGD COC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 912521622 MKOHHDIESMQWNR-UHFFFAOYSA-N 485.525 0.682 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)c1ccc(-n2cnnn2)cc1 913156080 RGEVFUZDBPWSRF-UHFFFAOYSA-N 491.917 0.411 50 20 JCGD COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2c(F)cccc2F)cc(OC)c1OC 913415361 YOSWLUOIKBTDQP-UHFFFAOYSA-N 459.427 0.730 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CN2CCCNC2=O)c1 915260408 IVFCSODPMHWFGI-UHFFFAOYSA-N 461.500 0.672 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 920341993 LIBMLTYDSMBLIT-UHFFFAOYSA-N 451.461 0.531 50 20 JCGD Cc1nc[nH]c1CSCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1778910883 IWBOPBUIXVUKHD-OAQYLSRUSA-N 473.559 0.094 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)N(C)C(C)=O)CCO2 1780097783 JWSPATFSYQEOHE-RCDICMHDSA-N 476.486 0.830 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C1(C)COC1)CCO2)NC(=O)NCc1ccccc1 1780968839 KCCPRKFJXFQXOJ-QHCPKHFHSA-N 459.547 0.199 50 20 JCGD CO[C@H](C)[C@@H](C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)N(C)C(=O)OC(C)(C)C 1781079976 XSOIVYHOAAVTJX-YUWJWYLASA-N 477.986 0.686 50 20 JCGD O=C(c1cc(=O)nc2cccnn12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781335005 TUKNTMBVQJIFSB-RHSMWYFYSA-N 454.256 0.224 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2 1781900130 MBOMEMWOCDJRIC-BBEGDGIKSA-N 481.351 0.719 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1782037947 KJRIDOVKIABLRK-XMMPIXPASA-N 481.509 0.619 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1783352635 JRFHBIOLRIOODT-APWZRJJASA-N 457.413 0.770 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1783352687 QWTBCPKXXXVMDM-BFUOFWGJSA-N 464.320 0.707 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1783535702 GFMNYXOOJMAWJW-SJCJKPOMSA-N 457.281 0.370 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)C1CC1 1783685485 NZGHSXPQLKDZBJ-HJWJTTGWSA-N 459.971 0.965 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(F)c(N(C)C)c(F)c1)CCO2 1783934411 GEJBALDQALTRTG-QFIPXVFZSA-N 467.517 0.847 50 20 JCGD CC#C[C@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccc(O)cc1 1784018527 SCCCLSWYJIKDKH-FQRUVTKNSA-N 476.338 0.713 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1C 1784841415 NASMXINVEPLZRT-RRPUWOKSSA-N 466.343 0.519 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1785658130 XDYWMKHFRCHNGS-QHCPKHFHSA-N 471.489 0.519 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nn3)C[C@@H]21 1787508451 JJYSMYDWCGCNTR-YPMOQXHOSA-N 473.921 0.857 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C[C@@H]21 1788611409 ZNVSVGHDVZBANP-XERREHJYSA-N 490.524 0.377 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)nc4cccnn34)[C@H]2C1 1789198094 ZMVIXXYBNATPJE-YXWQFLTLSA-N 478.347 0.714 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1790586039 DAHHGHKMYNJJTN-YOPIWALVSA-N 471.327 0.870 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnccn3)[C@H]2C1 1791658294 MHQIQEKMIYAWSQ-ZCQORZAUSA-N 467.530 0.523 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C 1793248803 DQYSJSBIZIDUAQ-YVSFHVDLSA-N 469.583 0.273 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)cncc1Cl)C2)c1cccc(B(O)O)c1 1795736683 APRLFRMNEWTACG-IVWMJMPLSA-N 464.114 0.585 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)c1ccc(B(O)O)cc1)CC2 1795737029 UFPOBTDWZHKFBR-MTXNFPGFSA-N 478.354 0.383 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cnc[nH]1)NC(=O)NCc1ccccc1 1796772532 JTIGMDMRCPUKRC-FNLKRUPLSA-N 453.547 0.937 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccco1)C2)NC(=O)NCc1ccccc1 1799094877 FVGGSALFIMHIDB-GMQQQROESA-N 485.541 0.249 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c([N+](=O)[O-])c1 1799479793 DJESFFNYRWFBFW-UYNJTKMTSA-N 484.469 0.638 50 20 JCGD COC(=O)C1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN(C)NC(=O)NCc2ccccc2)CC1 1799869191 LAKWWIONXHLRKJ-REPLKXPHSA-N 471.558 0.924 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2 1802339662 GESBOOBQSCTRBS-IPPNXFFKSA-N 481.594 0.370 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C2 1802344158 PGBGTRSIMZKXHE-YYAJDYIMSA-N 483.610 0.662 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CNC(=O)C(O)O)[C@@H]1c1cccnc1 1802923412 OYKFVUYMVJIWEV-KSSFIOAISA-N 458.427 0.545 50 20 JCGD CN1CCCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1803173356 ZLHNOBOORBXQAQ-BVSLBCMMSA-N 450.348 0.565 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnc(OCF)cn1 1805030963 KKJTUUCBVFAVFA-DYESRHJHSA-N 479.277 0.491 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)C1 1805383926 QJEKHSFYPLJUJY-INIZCTEOSA-N 478.453 0.979 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC2(CCCN(C(=O)CN3C(=O)CNC3=O)C2)CC1 1806584099 SOERXVSBLXBOLA-HNNXBMFYSA-N 499.996 0.902 50 20 JCGD O=C(CCN1CCCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1806644988 FKNUTXKXDUUSJU-URXFXBBRSA-N 464.375 0.957 50 20 JCGD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc2nccn12 1807363215 BESZXZZRELKBAV-SIKLNZKXSA-N 484.325 0.746 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CNC(=O)Cn2cnnn2)[C@H]1c1cccnc1 1807611489 SRYMCAUDTHVFKL-HRAATJIYSA-N 494.468 0.921 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1810565375 OQIMVUNOSPCOFX-OTWHHZRWSA-N 497.556 0.373 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1 1813072863 HHYKSBVAXPENGB-YCFUHTNOSA-N 456.547 0.295 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)/C=C/c2cnc[nH]2)[C@@H]1c1cccnc1 1813301057 PKVVLPCXGGJVQE-HXOPIXBZSA-N 460.498 0.836 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3c(c2)CNC3=O)[nH]n1)c1cccc(B(O)O)c1 1817476030 AIZIVIBLAIPJFF-HXUWFJFHSA-N 473.298 0.953 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cn4ncccc4n3)sc2C1 1818466411 PGHMBYJHHWJTAB-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)N1C[C@H]2C[C@@H]2C1 1819290629 YPDANBCUYREUTJ-OYRIPWCXSA-N 451.336 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCOCC1)CC2 1819795185 JMWZMWLUUFDZQE-ZDUSSCGKSA-N 473.559 0.090 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nn[nH]c1C(F)(F)F)CC2 1819798089 VEHUYLOVJHMBSN-SSDOTTSWSA-N 495.447 0.818 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1C(N)=O)CC2 1819800431 OPQFXOQPSFKFIH-NSHDSACASA-N 479.522 0.780 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824395714 GJPFPSSRHWZREQ-HNAYVOBHSA-N 458.563 0.833 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCCC2=O)CC1 1826727724 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Cc1c(F)ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1N 1834775470 FMYOUUKFVFXZEM-UHFFFAOYSA-N 482.365 0.895 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc4[nH]ncc34)CC2)CC1)c1ccc(B(O)O)cc1 1834797833 BTROVQWTOYKXAY-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1 1835645623 OXCFJNFTERNPMF-WBMJQRKESA-N 463.373 0.406 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3c3ccccc3)C2)C1 1835939865 LHHKPJRPQMDKAD-WRALFONMSA-N 464.327 0.240 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)NC(=O)CO3)CCO2 1836992771 PQMYDHGDHVEQNW-JOCHJYFZSA-N 477.590 0.939 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1837116055 RDUSWXUFONGQTN-INIZCTEOSA-N 454.600 0.435 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1 1837461307 UDBRZEMMWDKDEZ-SQJMNOBHSA-N 495.536 0.149 50 20 JCGD CC#CC[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1837612759 LODZIECLNMDHLO-SHQCIBLASA-N 490.365 0.634 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3csc(N)n3)CC2)CC1 1837893255 JEJAYWGFMFIQSZ-UHFFFAOYSA-N 452.581 0.711 50 20 JCGD COc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccn1 1837919112 GERZBBVZEHDCPR-UHFFFAOYSA-N 467.331 0.696 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1838401961 DQNQNIOLXXYEKD-NRFANRHFSA-N 457.644 0.487 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1cccc(Cl)c1 1839043409 WZSJJCVGXFVHDY-WAOWUJCRSA-N 488.368 0.573 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1839142988 IBRJCTPTACCCGQ-HNAYVOBHSA-N 459.952 0.573 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1839384756 PVARDQOBUDAIPY-VLIAUNLRSA-N 463.959 0.551 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)c12 1839556739 NXWRXPBKMGOAJV-HRAATJIYSA-N 451.907 0.846 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](Br)Cc4ccccc4)CCO3)C2)O1 1839801591 RJELGBCVTSAUGI-XGHQBKJUSA-N 496.358 0.557 50 20 JCGD C/C=C(\C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839820210 APXYAJUZHXKMBV-ZVUKBESYSA-N 473.574 0.755 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)c3ccc(OC)cc3)C2)C1 1840149655 WPCAVOQUWRFCET-BBTUJRGHSA-N 456.923 0.439 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1 1840154059 JVYFVRUBYIUSJI-VFNWGFHPSA-N 479.921 0.764 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(F)cc(F)cc4[nH]3)C2)C1 1840184610 XEPMIOFGCYNHDJ-QHCPKHFHSA-N 493.511 0.889 50 20 JCGD C[C@H](Cc1ccco1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185176 LYQWLXIDECEPAB-VGSWGCGISA-N 450.536 0.288 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)n1 1840338223 OIRBVKYXCCYKED-RUZDIDTESA-N 496.568 0.400 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)CC2CC2)C1 1842769482 ZZWPEHSXVMKLJM-FQEVSTJZSA-N 485.390 0.806 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CN1CCCC1=O)C2)NC(=O)NCc1ccccc1 1845038780 SBMVKROYUATZMP-UHFFFAOYSA-N 456.547 0.158 50 20 JCGD CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc21 14847364 IYMJRILBPQVPMG-UHFFFAOYSA-N 492.579 0.868 50 20 JCGD COC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1 109067790 WXVQAVPNJODVJM-UHFFFAOYSA-N 458.493 0.837 50 20 JCGD NS(=O)(=O)c1ccc(OCCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1 726066921 FRACBADBJHIITP-UHFFFAOYSA-N 455.876 0.761 50 20 JCGD O=C(Cn1nc(-c2ccccc2)oc1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 726071644 LAMQRVVZJFUGLQ-UHFFFAOYSA-N 471.495 0.749 50 20 JCGD COCCCNC(=S)N(C)NC(=O)CCNS(=O)(=O)c1ccc2c(c1)OCCCO2 726077253 SKIVCDDQBKFCFZ-UHFFFAOYSA-N 460.578 0.390 50 20 JCGD CC(C)Oc1ccc(NC(=S)NNC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 727497378 OLWYEGQQEPJSQP-UHFFFAOYSA-N 459.532 0.629 50 20 JCGD CC(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1F 728846353 XBGHNGIPBKLMAL-UHFFFAOYSA-N 464.523 0.980 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 728958659 DQUKXQDCJLBNAM-UHFFFAOYSA-N 492.562 0.045 50 20 JCGD O=C(COC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)NNC(=O)[C@@H]1COc2ccccc2O1 730620425 IJXJGEMEGDYLSA-QRWLVFNGSA-N 497.460 0.341 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1C 906478220 MAXPQOKURNICTI-UHFFFAOYSA-N 460.512 0.264 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)c1 916267388 HZUCTSIBQPSVRV-UHFFFAOYSA-N 461.548 0.036 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnnc4ccccc34)C2)C1 1777726439 ZZXVZHQDJPIFLN-HSZRJFAPSA-N 461.482 0.386 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778095417 ZTJFUQVCCCVLCK-VYXVWEACSA-N 479.603 0.748 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)OCCO3)C1 1778443843 SFFZYBUBHYTWBM-PXDATVDWSA-N 495.536 0.898 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1 1778594165 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N=C(N)NCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783021818 COTVMZFDOUHAQB-DNVCBOLYSA-N 452.353 0.306 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COCCOCCOCCOC)C2)C1 1783685343 AHSHGELJDHHEKE-XLIONFOSSA-N 450.960 0.530 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936965 MQKZVZHPDRBADX-HOYKHHGWSA-N 489.573 0.504 50 20 JCGD O=C(Cc1cccnc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785164330 VYDAYWGUMKWDLN-WDSOQIARSA-N 457.723 0.251 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)C3(C#N)CCC3)C2)C1)NC(=O)NCc1ccccc1 1785367500 SIVUHWSHAWJBTL-DEOSSOPVSA-N 468.558 0.856 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CCN1C(=O)OC(C)(C)C 1785741431 XESQAFWLTMSZQH-LLJLJFOGSA-N 495.621 0.835 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786407717 NMZKAVNPRYKESG-ULQDDVLXSA-N 465.385 0.821 50 20 JCGD CN1CCc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)ccc21 1786979662 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CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1814124317 QKPDRWZQDWQPEB-BVSLBCMMSA-N 466.347 0.386 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](N)Cc2cccnc2)n[nH]1 1818072704 RJCNNGRRKPXSBE-PKOBYXMFSA-N 477.529 0.679 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1824462341 RKNKFVBTHNGOGG-WMZOPIPTSA-N 473.640 0.307 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)c2cccnc2)CC1 1825090119 PHPKREAYCMUYNC-OAQYLSRUSA-N 493.568 0.743 50 20 JCGD C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)n1ccccc1=O 1826087702 JMWCUMUSXVXVGO-UONOGXRCSA-N 460.560 0.851 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)C(F)(F)F)CC2 1826089666 KZSWTRFVLORXJR-SECBINFHSA-N 464.470 0.107 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)C=CC3=O)sc2C1 1826314637 DBINBVGOSWSZGZ-ZVYABZQBSA-N 483.510 0.114 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOCC2)CC1 1826716292 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CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1831644182 QKTQJPKKDMCZFH-OXJNMPFZSA-N 473.979 0.963 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnsn3)C2)C1 1832549231 INFNATWCOKAARM-ORAYPTAESA-N 489.982 0.740 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(=O)oc3)C2)C1 1832549532 TYMRSSACSJNAPW-AOMKIAJQSA-N 499.948 0.842 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnc[nH]3)C2)C1 1832549706 YOGCYONGYYREHY-HRAATJIYSA-N 485.969 0.541 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)oc2ccccc12 1835937498 ZVIHHNVGBIERCP-VWLOTQADSA-N 478.310 0.805 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939277 JSMVBEKUNZEDDY-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD CN[C@H](CC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1)C(=O)O 1836412331 FFASLZINBPFORA-HIFRSBDPSA-N 451.337 0.311 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)CCO2 1839080549 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Cc1nc2ccccn2c1C(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 725911113 XKTGOKPLCRAMGM-UHFFFAOYSA-N 463.541 0.729 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC2CCN(c3ccc(C#N)cn3)CC2)cc1 727605627 RLQDEYLZQPCZOR-UHFFFAOYSA-N 485.570 0.882 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3c(=O)n(C)c4ccccc43)cc2)CC1 728215403 ZGTBRBIKJOPHAY-UHFFFAOYSA-N 458.544 0.419 50 20 JCGD CCCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728330616 OJXJFJCGXFQBLT-GOSISDBHSA-N 477.495 0.983 50 20 JCGD O=C(CSc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 728378256 QPPGHMNGLLBIBL-ZBFHGGJFSA-N 497.574 0.937 50 20 JCGD CCN(CC)CCN1C(=O)C(=NNC(=O)[C@H](C)NS(C)(=O)=O)c2cc(Br)ccc21 728434570 MXWFIGASXPLMJW-LBPRGKRZSA-N 488.408 0.896 50 20 JCGD O=C(NCCS(=O)(=O)N1CCOCC1)NNC(=O)c1cc(F)ccc1Br 728748383 VBUQZAIQLWBVEB-UHFFFAOYSA-N 453.290 0.194 50 20 JCGD CCn1c(CCC(=O)NNC(=O)c2cccn2C)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 747599138 NYPBEWGMYSOJHT-UHFFFAOYSA-N 488.570 0.809 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNC(=O)NCc1ccc(F)cc1 821892842 UTKBVQJSHKHURX-UHFFFAOYSA-N 456.522 0.985 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)s1 838732278 OKQNSCTZSLXZQW-UHFFFAOYSA-N 478.560 0.899 50 20 JCGD C[C@H]1CCCCN1[C@H](C)CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 916448915 SWJCWPPFAMMOSZ-DLBZAZTESA-N 453.613 0.907 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)nn1 1778092699 LLKKFQLOUSSVIL-TUWUPGADSA-N 483.529 0.747 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(F)c1 1778289154 RTTJPQDFULNZGV-DEOSSOPVSA-N 485.516 0.909 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn4ccnc34)C2)C1 1778580278 YBBZVVPUAHRQTN-LRULAXNGSA-N 463.498 0.912 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1778978098 CQKAGOKPTBJFRG-NLFFAJNJSA-N 487.601 0.736 50 20 JCGD O=C([C@H](Br)Cc1ccccc1)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1779095601 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JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)CC3(O)CCC3)C2)C1)NC(=O)NCc1ccccc1 1784825851 NXDFXSGMEGNYMY-DEOSSOPVSA-N 473.574 0.468 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)c3ccc[nH]3)[C@H]2C1 1785249516 ZLGIZWLYAHLZRW-BQFCYCMXSA-N 450.612 0.966 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785544955 FQNKZNPXXFMKRZ-HZPDHXFCSA-N 454.401 0.913 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785576125 HEUWUPQPYUICDL-UZUQRXQVSA-N 479.578 0.106 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1 1785623818 PAJQZUOOPFRQNX-ARGWCVDVSA-N 493.964 0.693 50 20 JCGD O=C(CCOc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1786411183 GDTLUGXMVLLVIA-NYVOZVTQSA-N 452.316 0.429 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccc(Cl)cc4nn3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979922 PJYATCIRZWUART-BPXKWBHBSA-N 494.744 0.870 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)[C@@H](O)C1 1787449844 YBHPCINCRVRDJU-OJFNHCPVSA-N 463.934 0.728 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(O)C(F)(F)F)C[C@@H]21 1787506556 GMHSYTDYCYBQQN-ZMFAOSFKSA-N 473.452 0.413 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)nc1 1788611692 RFVNXGGXDCSZEK-NDXORKPFSA-N 466.542 0.615 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)nn1 1789101400 GIZCSCNQOQHWKR-ARQYOALSSA-N 469.502 0.213 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1790266657 LNFUSCJMXVJCLB-HZCDGDGTSA-N 454.911 0.854 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C[C@H]2C[C@H]21 1792266046 UOXSENMKLCBZTA-SCAKLKGDSA-N 471.982 0.964 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc1 1792983512 LFDQURCRJDCQCA-HIRMHNASSA-N 458.964 0.212 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cc1O)C2)c1cccc(B(O)O)c1 1795739694 BPXGFQZQSJZMAB-HBCWATKFSA-N 489.131 0.352 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796191034 QNQPOVODFHAMKS-FCGDIQPGSA-N 475.351 0.158 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCNC2=O 1797323654 ODEFIZFKNQXVMH-RHQBZFHZSA-N 458.346 0.456 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@@H](F)Br)C3)CC1 1797706101 AMMCFQWRCJVBNP-XJFOESAGSA-N 454.362 0.987 50 20 JCGD O=C1CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)Cc2ccccc2)=NN1 1800436330 VYINEWCSEJTRAH-BASYENTBSA-N 463.332 0.458 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)c2ccco2)[C@H]1c1cccnc1 1802522470 GYJWLPAOWNSPMA-YSGRDPCXSA-N 464.482 0.726 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1803016750 YCAWOKUIMGIGBZ-HHXXYDBFSA-N 471.396 0.405 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)c(C)n2n1 1807364296 TXIPFHLQUOOTJU-WMZHIEFXSA-N 499.340 0.449 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n(C)n1 1807369412 IZPJWASSFOMJSA-UTKZUKDTSA-N 463.303 0.137 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)C1 1807952011 UQWUIRKWDVZCSE-PJVZLEMVSA-N 496.992 0.915 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@@H]1c1cccnc1 1808416072 DFBSRINBOHQXHZ-TYXIVBLQSA-N 463.502 0.513 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)CC2)C1 1809970038 ZOWPXTOCTPITLZ-PZJWPPBQSA-N 467.375 0.612 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cc2cnccn2)[C@@H]1c1cccnc1 1810295704 VTIFERMHHKTCJT-IIBYNOLFSA-N 460.498 0.432 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1810324968 LDLOVORFYNIZSQ-AQOAWAETSA-N 468.562 0.751 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1 1813071649 WBFVNNHDGBUPAJ-NTKDMRAZSA-N 472.590 0.863 50 20 JCGD O=C(CCN1CCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1814265418 OPOOIHDEALHUIP-REWPJTCUSA-N 450.348 0.567 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nncn3c1)CC2)c1cccc(B(O)O)c1 1815356381 GPZXTXIYUZAMEE-HNNXBMFYSA-N 462.300 0.405 50 20 JCGD O=C1COc2ccc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)cc2N1 1815357109 YRDRLSZPRBZJPY-OAHLLOKOSA-N 492.322 0.693 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)CC1 1818814114 SHPWQBSMTAUBIU-CABCVRRESA-N 461.972 0.673 50 20 JCGD CC(C)(NCCC#N)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819796133 ZWWLHNGTOYDJJI-LBPRGKRZSA-N 470.559 0.649 50 20 JCGD C[C@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1820073926 SRMQADHMKLDQCI-VXGBXAGGSA-N 469.531 0.295 50 20 JCGD Cc1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn2[nH]cnc(=O)c12 1820117576 KNFVQFSIVWGQBN-SFHVURJKSA-N 489.301 0.354 50 20 JCGD O=C(c1cccc(=O)n1O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050810 ZJNRARHBNVDBGS-LJQANCHMSA-N 453.304 0.313 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCNC2=N)CC1 1827680643 BFOQELKHUPGDLP-BWJYWGHISA-N 470.578 0.580 50 20 JCGD O=C([C@@H](F)Cl)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H]3C[C@H](O)CN3)C2)C1 1829056576 NFUFQXDBTKHZSM-VDVULAQNSA-N 482.940 0.696 50 20 JCGD CC[C@@H](Br)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(O)O)C2)C1 1829316076 SWPRDIUYPYXENA-IIBYNOLFSA-N 498.374 0.923 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830535476 OYQPDVURHTXFIM-SUMWQHHRSA-N 467.382 0.380 50 20 JCGD O=C(c1ccc(C(F)(F)F)nc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725097 LDTGYMLLAXLOKK-CXAGYDPISA-N 451.829 0.770 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1C 1832405333 LNABHGMFFCADCZ-DEOSSOPVSA-N 460.575 0.675 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832880179 AONHTRCRUMALIH-YWZLYKJASA-N 485.379 0.765 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccco3)CCO2)C1 1833048965 XKCYPBDRKWPPRT-VAHWYXDJSA-N 471.514 0.803 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3C(=O)OC(C)C)CCO2)C1 1833394144 OOZPIEWHLDERCX-VGSWGCGISA-N 483.949 0.971 50 20 JCGD O=C(C[C@H]1CCCCO1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833680836 RPIAPEKSZWDMIJ-JOCHJYFZSA-N 457.380 0.511 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccccc3F)CC2)CC1)c1ccc(B(O)O)cc1 1834797875 GRPOTEFGRAHJNW-UHFFFAOYSA-N 467.350 0.933 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c4cnccc34)CC2)CC1)c1cccc(B(O)O)c1 1834801078 JJLUGYOUPLFDOY-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1 1835048317 NFRGJLZMRXHFNK-VNSNFZHPSA-N 485.516 0.959 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)C1=NN(c2ccccc2)C(=O)C1 1835134585 JVHBDUCHTXMRPV-FQEVSTJZSA-N 475.977 0.951 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1835596091 NODMTVAMLWDAGZ-RSDPBLMXSA-N 492.529 0.964 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(=O)oc3)CC2)CC1 1835737035 SLEVUDOBGQJJNM-UHFFFAOYSA-N 468.514 0.137 50 20 JCGD CN[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)C(=O)O 1835763975 OOXJWUFRHWJUHQ-KTIAIDQTSA-N 492.479 0.391 50 20 JCGD O=C(c1nc2ccc(C(F)(F)F)cn2n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836289923 OUNNODUWTCZAQF-UGSOOPFHSA-N 491.854 0.418 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)N1C[C@H]3C[C@H]3C1)CCO2 1837279185 NULWEDALXSFCFB-SUFIHLRJSA-N 458.397 0.814 50 20 JCGD O=C1CC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)=NN1 1837366402 UKYRPGCMMMQYGO-KKSFZXQISA-N 493.358 0.325 50 20 JCGD CC(C)Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)n(C)n1 1837457959 YMLUSYQHHWVWSB-XMMPIXPASA-N 499.572 0.001 50 20 JCGD O=C(c1cccc(C(F)(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837928690 RFIWCOPZRBGDAJ-DYVFJYSZSA-N 451.829 0.770 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3c(O)cc(O)cc3O)CC2)CC1 1838394573 LUPCUSTWYOWLOD-UHFFFAOYSA-N 499.524 0.728 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)n(C)n3)CCO2)C1 1838835009 GZPRIEICCGTFAD-ACJLOTCBSA-N 459.341 0.672 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3Cl)CCO2)C1 1838867641 MMZGWMHOVHOAGN-JOCHJYFZSA-N 473.917 0.722 50 20 JCGD C[C@@H](CC(N)=O)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839741828 DDLBTNOIOQLWOA-SLXWPLRWSA-N 476.480 0.840 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1 1840033119 UYWOUPFVKWGJSX-FPDPHYFHSA-N 466.376 0.941 50 20 JCGD O=C([C@@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1840037442 AGGVGDOYUAVUDI-LJQHDNKASA-N 451.882 0.887 50 20 JCGD O=C(CCc1cnc2[nH]ccc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840079756 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CCN2C(=O)C=CC2=O)C1 1841756620 KPTWQIVPPALJRB-AWEZNQCLSA-N 468.938 0.637 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cc(CO)on1)C2)NC(=O)NCc1ccccc1 1845039129 HXLFYKVWHYWYTJ-UHFFFAOYSA-N 456.503 0.330 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cc1ccc(F)cc1)c(=O)n2Cc1ccccc1 10099066 QDASOFPMWHZHFF-UHFFFAOYSA-N 478.484 0.957 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)Cn2cnc3c(cnn3C)c2=O)c2ccccc2c1=O 10412051 JNLCIZDXMDFIIZ-UHFFFAOYSA-N 464.486 0.491 50 20 JCGD CCCC[C@@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12 14044539 RXKWUQYYUCJXJQ-MRXNPFEDSA-N 482.522 0.982 50 20 JCGD CCCC[C@@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 22193014 UHHMUVSBVNEGDO-QGZVFWFLSA-N 482.526 0.721 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1 726276777 ZMUZJMRUTQCABC-KRWDZBQOSA-N 490.538 0.323 50 20 JCGD COc1cc(C(=O)NNS(=O)(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc(OC)c1OC 726765321 ZIVHNSBYURPPOV-UHFFFAOYSA-N 485.540 0.876 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 728952473 ZNJWZANSFJRTLB-UHFFFAOYSA-N 490.565 0.103 50 20 JCGD O=C(NC[C@H]1CN2CCC[C@@H]2CO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 729620440 YKKZMRVSKAYPQY-SJORKVTESA-N 451.549 0.278 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)[C@@H](C)N2CCOCC2)c1 729623367 KMPIDQFSERPBNP-JKSUJKDBSA-N 455.581 0.770 50 20 JCGD Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 729756103 MDLIGRUXRRXRNI-MRXNPFEDSA-N 469.454 0.364 50 20 JCGD CCOC(Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)nn1)OCC 748557530 MIJNDYIWHDXGEV-UHFFFAOYSA-N 480.547 0.537 50 20 JCGD CSCC[C@@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 749174240 OHTGNUJBTNGXAD-WMLDXEAASA-N 479.584 0.604 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccccc1F 821719118 QBFAFXWXYADHLR-DEQJRXDXSA-N 483.543 0.980 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(S(N)(=O)=O)ccc1F 825151150 ZPVBSWZDVKSBMQ-UHFFFAOYSA-N 459.839 0.753 50 20 JCGD O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)CCN1CCN(c2ccccc2)CC1 856532232 ZEDAVCQBOQVUOY-UHFFFAOYSA-N 459.572 0.715 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1F 913155390 ATJIESIBYXSPEQ-UHFFFAOYSA-N 461.479 0.907 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)NC1CCCCC1 913449259 PGHDEMHEQLPNQT-UHFFFAOYSA-N 465.576 0.963 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCCn1cccn1 916376823 KLIGBPWXYBDQJV-UHFFFAOYSA-N 464.548 0.257 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1 916649365 LXWMCWHERVDRIE-UHFFFAOYSA-N 466.516 0.773 50 20 JCGD CCn1c(O)nc2cc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc2c1=O 916745883 SNGKMQISHLDEQQ-UHFFFAOYSA-N 485.522 0.981 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)cc1 916830560 HANKPCPNOAXJAF-QGZVFWFLSA-N 460.512 0.852 50 20 JCGD O=C(CN1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 917132158 JGZWKSZKDMRKGD-UHFFFAOYSA-N 472.483 0.123 50 20 JCGD C[C@H]1Cc2ccccc2N1S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919885859 OJIQABQRFCZLQI-WMLDXEAASA-N 492.579 0.958 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C/c2ccc(C(N)=O)cc2)cc1 920030197 UHXMAPMVZYMYQT-BESKYLIDSA-N 461.478 0.888 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CCCN(S(C)(=O)=O)C1 920239976 KCDKCNLIXUOUKD-YPMHNXCESA-N 463.354 0.971 50 20 JCGD CN1CCc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)ccc21 1777918617 CNMQSGVSRUZULW-DEOSSOPVSA-N 464.526 0.435 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@](C)(O)CC(=O)O)C2 1778095141 UOSZUZVOBVEWFR-XBRHDNQBSA-N 491.545 0.250 50 20 JCGD Cc1nccn1CCCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034910 WYHXRBGWMFBCCA-QFIPXVFZSA-N 455.519 0.114 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn(C(F)F)n2)C1 1779760435 FCWYYCBETUCXEO-FOIQADDNSA-N 456.494 0.779 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1781852695 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O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1814184673 CKOVSHPGSQEBNS-ZENOOKHLSA-N 456.977 0.547 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[nH]n1)[C@H](O)CCl 1814869841 CYZUVZLEQFBLPY-QWHCGFSZSA-N 456.912 0.467 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343627 FNWMYDVIWVCGCD-MRXNPFEDSA-N 476.327 0.334 50 20 JCGD Cc1cccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815350611 ZXPOBOAZGXEAEZ-KRWDZBQOSA-N 450.329 0.995 50 20 JCGD COCc1oncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817475172 LELHJSDBPOARKV-QGZVFWFLSA-N 453.264 0.844 50 20 JCGD CN1CCN(CCC(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CC1 1819794670 AWGYUYHTSXSSLW-CQSZACIVSA-N 486.602 0.005 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1 1824185173 HGKWPIPKLJUUFH-JCGIZDLHSA-N 451.955 0.814 50 20 JCGD O=C(Cn1cccn1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551980 YQNLTPZSSJRAKY-CVDCTZTESA-N 489.960 0.935 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3ncccn3n2)CC1 1828552645 BWZMNZOQNBBVBL-NRFANRHFSA-N 461.331 0.956 50 20 JCGD CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1828825837 BLBNPOZBXYXRTD-RUZDIDTESA-N 479.342 0.842 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](N)CN)CCN2C(=O)OCc2ccccc2)C1 1829050719 SLUDGSFBMRTONV-LDBYXDLTSA-N 496.406 0.508 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1830540314 PMQUODMTXSSQHB-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD C=CCC(CC=C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1830641082 OIURHMQESZFODD-HSZRJFAPSA-N 457.531 0.524 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1 1831282940 HXAHJMCPNXRZDP-RBUKOAKNSA-N 477.587 0.496 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1 1833313480 IOUWXOGWWIZVTP-FQEVSTJZSA-N 464.994 0.896 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1 1833574170 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CC(=O)N[C@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)C(C)(C)C 1836801035 HBMBHJRPWGJBAZ-JOCHJYFZSA-N 481.638 0.909 50 20 JCGD COc1cnc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cn1 1837572541 UVRYLZHNIKJXOC-UHFFFAOYSA-N 462.551 0.470 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837921045 UZWJFLGSQDIKEX-SFHVURJKSA-N 468.363 0.511 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)[C@@H]1SC(=N)NC1=O 1838100613 WELNIQSTGQVTSO-KUHUBIRLSA-N 496.634 0.160 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnnc3O)CCO2)C1 1838366418 JBCFSLRMPXBKJJ-BTYIYWSLSA-N 499.952 0.384 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCOC3)C2)C1 1838528235 MDIUFKZVJYJMRY-ZHRRBRCNSA-N 477.470 0.627 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(N)=O)CCO2)C1 1839865165 LEAXZXGSRIXXEC-NAVGAYGYSA-N 462.453 0.594 50 20 JCGD O=C(O)C#CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1840044509 KSXSPIYWUDJGAR-LAUBAEHRSA-N 479.327 0.537 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C(=O)OC(C)C)C2)C1 1840150075 GCRRAWSBLCXFDM-JTSKRJEESA-N 483.949 0.971 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(Cl)n3)C2)C1 1840183686 UHVXNNQPNOLZCT-NRFANRHFSA-N 467.954 0.107 50 20 JCGD CSc1ccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840184673 ARZQERDQXREFHX-HSZRJFAPSA-N 478.615 0.780 50 20 JCGD COc1ccccc1CC(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184695 BEUUAPAQDOKSPI-HSZRJFAPSA-N 462.547 0.067 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1C1CC1)CCO2 1840657278 XXTGKHZZJTUMJC-VWLOTQADSA-N 479.537 0.946 50 20 JCGD C=CC[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1840795794 CIGIRXIGRGTEJY-DRSNIGMVSA-N 489.997 0.902 50 20 JCGD Cc1cn(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)c(=O)nc1O 1841925527 FILAXUAJRLBJOW-AWEZNQCLSA-N 483.953 0.593 50 20 JCGD CC(C)[C@@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)N1Cc2ccccc2C1=O 1843010451 QWVUMPUBAKFDEX-QFIPXVFZSA-N 475.354 0.864 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2 1844263582 SJLIAINVYWTWBB-UHFFFAOYSA-N 490.520 0.117 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1 1847144532 BRBOBAWTUXVPMX-UHFFFAOYSA-N 471.363 0.831 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1848098773 XGOLFDWICDKNPK-OWSLCNJRSA-N 496.996 0.791 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1 9931188 XEURCAMKORQYSM-CYBMUJFWSA-N 481.508 0.412 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)c1sccc1S(=O)(=O)NCc1ccco1 725740995 LRYIYNOETMDBBO-UHFFFAOYSA-N 452.470 0.604 50 20 JCGD CC(C)(C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)S(=O)(=O)c1ccc(Br)cc1 726163346 VMBHSSDMKATRAA-LLVKDONJSA-N 482.378 0.519 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3c(=O)cnc4ccccc43)cc2)CC1 728213001 QHOKWZXVVRBMMU-UHFFFAOYSA-N 456.528 0.476 50 20 JCGD O=C(CSc1nnc(-c2ccc(F)cc2)n1C[C@@H]1CCCO1)NNC(=O)[C@H]1CCS(=O)(=O)C1 728378254 QPPGHMNGLLBIBL-HOCLYGCPSA-N 497.574 0.937 50 20 JCGD Cc1nn(Cc2ccccc2)c(Cl)c1C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O 730569118 OEWGNYRAVXKZHF-UHFFFAOYSA-N 461.935 0.928 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)N[C@]3(CCc4ccccc43)C2=O)n1 761119201 IKYVFJRCSSJEIP-NRFANRHFSA-N 471.495 0.078 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1OC 771837206 VKNXBYRIZSQJKQ-UHFFFAOYSA-N 461.500 0.259 50 20 JCGD C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 838616301 FJKDDHWJWBFAKD-CQSZACIVSA-N 477.485 0.712 50 20 JCGD CCn1c(CCC(=O)NNC(=O)c2ccncc2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 865906730 FQBMBJZWSJJQMG-UHFFFAOYSA-N 486.554 0.866 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CS(=O)(=O)C1CCCC1 915808096 LGFPHESEYUVJQW-UHFFFAOYSA-N 487.600 0.145 50 20 JCGD COCCOc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cn1 916513066 SXILBTDVTSJLPQ-UHFFFAOYSA-N 493.542 0.272 50 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3C(N)=O)C2)C1 1781759118 PBCWATWDRDGYJK-OJLHXUGZSA-N 466.498 0.363 50 20 JCGD COc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1F 1783090867 OOGSHRGJWQWKBH-HYBUGGRVSA-N 470.306 0.955 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]2C1 1783964165 LUYQVIDIDZPKRB-AICCOOGYSA-N 468.414 0.325 50 20 JCGD O=C(CN1C(=O)C=CC1=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1784116968 XBZDINDTPOSKJI-HTAPYJJXSA-N 490.354 0.748 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1 1784368726 BKVBAGDDRRSCFO-QAPCUYQASA-N 456.341 0.072 50 20 JCGD O=C(Cc1ccc(Cl)s1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785108048 SHXXMTBKJIYCPD-WBAXXEDZSA-N 462.764 0.917 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CCNC(=O)c3ccccc3)C2)C1 1785333721 ZFWXQHOQGLRYQX-QHCPKHFHSA-N 459.547 0.009 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3cc(C)cn3)C[C@@H]21 1787508505 ZMDIXKSAKNOEBK-DKAZWIMESA-N 469.546 0.866 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H](N)c3cccnc3)C[C@@H]21 1787508927 MZKDKJZIUBUPTD-AJDFGASCSA-N 481.557 0.585 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CSCN3C(=O)[C@@H]3CCC(=O)N3)[C@H]2C1 1790696085 PTRUIKZWXSEKHR-NYXISSTPSA-N 487.022 0.164 50 20 JCGD CCOc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cnc2c1cnn2C 1792976919 ODPJOLRYPSMRAK-NOXHYTERSA-N 451.911 0.170 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cccc(N(C)C)c1 1793858843 UYESCGAOSUXIBW-GPVSGQMNSA-N 461.563 0.094 50 20 JCGD Cn1ncnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1794567651 TXBJMCCYJKXFRN-CRWXNKLISA-N 456.931 0.150 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CC[C@@H](N)C(N)=O 1796086333 FGWFOPUXDAANQO-UMPJEAMMSA-N 461.475 0.365 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cc2n(n1)CCCNC2=O 1797322602 BIOYDCVIYXWTRZ-DRXBFXEBSA-N 454.325 0.005 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1csc(C(F)(F)F)n1 1798258041 YSICDLWTZGYOQH-JJLQDPRZSA-N 469.250 0.359 50 20 JCGD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c([N+](=O)[O-])cc1O 1798440023 UUVIBDTZWBJRDD-CLLJXQQHSA-N 484.469 0.873 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncnn1C)C2 1798522620 FGGNEOSSCKYJFW-FVCICTRLSA-N 458.431 0.166 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)n(-c2cccc(=O)n2C)n1 1799346085 ARMLBAWMDXIOMA-JGTCGTHISA-N 496.337 0.773 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2 1799683487 FOIZBCYTODDZSM-DYNNSRMTSA-N 454.351 0.655 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc1 1800431985 IZHFFJMYALMJQQ-LORHWOILSA-N 458.964 0.212 50 20 JCGD CCc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1Br 1801012935 GKAAVDZFTMKXRT-IVWMJMPLSA-N 499.410 0.321 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1F 1801974974 SUJIETDTRPZYBK-VTEUUUEMSA-N 459.453 0.409 50 20 JCGD CC(C)c1nc(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)no1 1807369275 DRZDILNTWKWUFB-GCJKJVERSA-N 477.330 0.830 50 20 JCGD NC[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccc1 1807370398 COELZMFXOBJNBD-OEMFJLHTSA-N 472.354 0.824 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)N1C[C@@H]2C[C@H]2C1 1810160787 BNLBQGRZCTYLMD-BYWRUVHUSA-N 456.591 0.801 50 20 JCGD CC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1812616860 BVQPLHXKIYPOOZ-MXEBZLGASA-N 453.503 0.358 50 20 JCGD COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1812690184 NLGTZYGAHIPKBB-MAUKXSAKSA-N 466.498 0.353 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)n1ccccc1=O 1813074916 WONARVCPVOHTPR-HFJQGTKSSA-N 468.558 0.883 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1814124315 QKPDRWZQDWQPEB-BAGYTPMASA-N 466.347 0.386 50 20 JCGD O=C(CCCn1ccnc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361577 KMXSRXZEHABZPQ-INIZCTEOSA-N 453.333 0.726 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1816014500 JCWFTELSRDPMSE-HNAYVOBHSA-N 450.308 0.928 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1817187345 YGMAMJUFCQYKKT-IRXDYDNUSA-N 465.344 0.014 50 20 JCGD CCOc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nn1 1817476300 APROMZUBTRYXTP-GOSISDBHSA-N 464.291 0.898 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)[nH]n1 1818113217 FTFGSKXBFHGDLX-PXGVHXGZSA-N 454.491 0.672 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1cc2n(n1)CCCNC2=O 1818910266 LXMCRZIQMPTKPI-TVQRCGJNSA-N 452.924 0.299 50 20 JCGD Cc1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)c(=O)[nH]c1C 1825443111 IPVAOMWGTIOGMB-IBGZPJMESA-N 481.557 0.932 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)Cn2ccccc2=O)CC1 1827096477 JMFFLFKXDPLMRA-OAQYLSRUSA-N 451.332 0.462 50 20 JCGD CNc1nsnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1829756137 SXNJXUVKTKKOPB-CVEARBPZSA-N 452.364 0.886 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830725625 LCVAJNMKNDZGPX-CKFHNAJUSA-N 484.377 0.175 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)C1 1833308867 BGQNKMVMFLZTFC-MJGOQNOKSA-N 485.390 0.141 50 20 JCGD Cc1nn(C)c(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1F 1834028535 WORVOVQNRDEQJC-UHFFFAOYSA-N 471.342 0.046 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@H](O)c1ccccc1 1834582497 GYBKKAGBGCGVEW-HSZRJFAPSA-N 465.359 0.285 50 20 JCGD CCc1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1834801212 QRFSYMDFDNLJBF-UHFFFAOYSA-N 470.404 0.884 50 20 JCGD CCOc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)nn1 1834823639 ANGBOXAAZNTNEN-GOSISDBHSA-N 457.325 0.730 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccn2ccnc2c1 1835573134 DAYYGXBTWKOLNY-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C3(c4cccc(Cl)c4)CC3)C2)C1 1835930326 GRJCTUWTBFJPCA-XMMPIXPASA-N 498.772 0.822 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CN(CCO)CCO)CC2)CC1 1836673263 DXHQJWDUTYGAHU-INIZCTEOSA-N 478.428 0.303 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1 1837457722 NKQBQLQCXYQONM-HSZRJFAPSA-N 471.489 0.137 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)c1 1837460071 RYSVCOKZPGHXJL-DEOSSOPVSA-N 467.526 0.686 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)N1C[C@@H]2C[C@H]2C1 1837921179 JGHSYVQMZDTZKV-HOJAQTOUSA-N 469.391 0.319 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838414166 DGEXHUWIZSUQGW-BFUOFWGJSA-N 499.387 0.857 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1838605179 RWDAQURLDGVJOD-IBGZPJMESA-N 486.312 0.552 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)cc3F)CCO2)C1 1839005225 GDZMLBSRHCBDBS-JOCHJYFZSA-N 475.452 0.347 50 20 JCGD O=C(Cc1cc(Br)ccc1O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839137013 TUSSYMHJBNDCAJ-QFBILLFUSA-N 491.766 0.753 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1839149332 CECJBAHUNUDXGC-LRAJWGHMSA-N 490.985 0.229 50 20 JCGD O=C([C@@H]1Cc2ccccc2CN1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199857 XBROGSNPYATYMZ-ZWOKBUDYSA-N 470.339 0.848 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)O1 1839801590 RJELGBCVTSAUGI-WWMYMODYSA-N 496.358 0.557 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1840035332 NHILAZGYLUTPLJ-BUXKBTBVSA-N 499.387 0.979 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840036675 PWMLWNMCBMLWGL-APWZRJJASA-N 481.384 0.296 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)C2)C1 1840150663 OQWDXFPMPDCIBL-NMMYMHLASA-N 493.988 0.745 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1 1840153072 CAYYWXCWJDZOBL-UWJYYQICSA-N 451.907 0.254 50 20 JCGD O=C1CSc2ncc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cc2N1 1840190024 ZFOHKCMMJHZKHH-SFHVURJKSA-N 475.354 1.000 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2(CNC(=O)OC(C)(C)C)CC2)C1 1841095233 SUNRHCVBTWRVCY-UHFFFAOYSA-N 451.568 0.868 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841618764 VHJLESYDHYWKDP-KRWDZBQOSA-N 479.603 0.217 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1841775315 LIOYMPWPRNGGGC-QHCPKHFHSA-N 471.363 0.973 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013258 ZQGQUHSZMUQMPK-QHCPKHFHSA-N 471.363 0.973 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1)C(=O)NC1CC1 9889280 IGBCDUQHRCFBGQ-UHFFFAOYSA-N 462.450 0.532 50 20 JCGD COCCCn1c(=S)[nH]c2cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)ccc2c1=O 9931803 LMRDFPHIGBSDPM-LBPRGKRZSA-N 454.530 0.291 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)ccc2Cl)C[C@@H](C)O1 15639685 IGDINWIXSYZJQL-SCRDCRAPSA-N 493.991 0.334 50 20 JCGD CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1 16786201 NWBCLHLOJZTHGG-HNNXBMFYSA-N 457.574 0.836 50 20 JCGD Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 21439305 WRNGHNUXOGHTIK-UHFFFAOYSA-N 465.495 0.995 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(CC(=O)Nc2ccc(F)cc2)CC1 725871706 KNLJBDUNKYTIBL-UHFFFAOYSA-N 462.507 0.614 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@H](O)CN1C(=O)c1ccc2c(c1)CCC2)NNC(=O)c1cccs1 725996017 ANUIVVQOCDDFKH-IRXDYDNUSA-N 457.508 0.817 50 20 JCGD CC(C)(C)NC(=S)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 726141864 OREYJUJMBBJFGM-ZDUSSCGKSA-N 485.053 0.715 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CCN1CCCC1=O)N(S(C)(=O)=O)CC2 727849178 UYNQYFKHHGCOPS-INIZCTEOSA-N 482.559 0.113 50 20 JCGD CCOC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)ccc1F 728502846 RKKKZEYVDSSLRN-UHFFFAOYSA-N 479.895 0.927 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)Cn2cnc3ccc(Br)cc3c2=O)n1 728726319 XSXROYPVPRYXOH-UHFFFAOYSA-N 494.327 0.857 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)NC1CCCC1 744052637 MMNNDEBCSTWQAV-IFCKCIONSA-N 472.589 0.653 50 20 JCGD C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C[C@@H](C)O1 751206660 KUGOBFRVUPOQMV-ZIAGYGMSSA-N 464.500 0.269 50 20 JCGD O=C1CCc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)ccc2N1 761373900 XZVDQXLLWAHINL-UHFFFAOYSA-N 458.496 0.667 50 20 JCGD CCn1c(=O)n(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc21 792737553 HPWOXELENGZMRB-GOSISDBHSA-N 454.439 0.354 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)/C(=C\c2ccc(F)cc2)n2nnnc2C)n1 818191353 YSJBTYXNWSCXMC-VIZOYTHASA-N 459.463 0.817 50 20 JCGD COc1ccc(CC(=O)NNC(=O)Cc2ccc(F)cc2)cc1S(=O)(=O)N1CCOCC1 913156191 PBFQSRNFFYKGMH-UHFFFAOYSA-N 465.503 0.788 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccc(F)cc2)o1 915189680 XBNCGRYKCRXUQR-HNNXBMFYSA-N 483.474 0.975 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2)ccc1Cl 915789098 JSOFZVOKZJBGKV-UHFFFAOYSA-N 460.921 0.117 50 20 JCGD C[C@@]1(CCc2ccccc2)NC(=O)N(CC(=O)OCC(=O)NNC(=O)c2cccs2)C1=O 918004540 GRXWCSFUEZRKNG-NRFANRHFSA-N 458.496 0.996 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1 918137718 BIUZCMIPZMWIHR-UHFFFAOYSA-N 450.452 0.618 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnnc1O)C2 1778092698 LLBYYGLZBSWQLR-MIBZKUIYSA-N 469.502 0.444 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1778788504 GORJDOFUBVGAMK-WTKXUXAGSA-N 478.452 0.766 50 20 JCGD Cn1ncc2c(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cccc21 1779032553 SRAOYACBCVKJFH-QHCPKHFHSA-N 463.498 0.329 50 20 JCGD CC(C)O[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779174648 AQOBBYLEVKHHLF-DVECYGJZSA-N 475.590 0.976 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)ccn1 1779693290 UNBWQWXQMBXFKM-AUSIDOKSSA-N 452.515 0.830 50 20 JCGD COC(OC)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780095004 BOTSZSXNUXBNLS-HXUWFJFHSA-N 451.432 0.583 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)CCO2)NC(=O)NCc1ccccc1 1780968891 IRHQEMZFBGSYDV-HSJYVMOXSA-N 471.558 0.055 50 20 JCGD Cc1cc(CC(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)no1 1780969570 OMSXXGQWMUZULW-DEOSSOPVSA-N 484.557 0.702 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1781998584 DHDOSSSCBBUJPZ-IDHHARJASA-N 494.452 0.955 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1782671407 WHMKLPUSXANORK-XAYKYTGQSA-N 457.300 0.720 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1 1783880236 GVENTLBPFQSWFE-NQIIRXRSSA-N 480.986 0.156 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1C[C@H]1c1ccc(F)cc1 1783885871 RQXIRFLFVXIDDE-CZIXKKEKSA-N 466.318 0.903 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(Br)cn1)CCO2 1783934712 LADYXODANWYUTK-LJQANCHMSA-N 468.352 0.661 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783948355 LROGMBXDCIRHRK-GOSISDBHSA-N 456.286 0.926 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccnc3)[C@H]2C1 1785169049 IEXUMBVSUJVORB-HJWJTTGWSA-N 467.364 0.822 50 20 JCGD CCn1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786179570 WOIOCFLQEQFEPE-ONTIZHBOSA-N 497.600 0.843 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C[C@@H]21)c1cccc(B(O)O)c1 1786983731 XVDWXBCXCSPCSO-HMNCIZAVSA-N 477.326 0.153 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cn1 1787251433 ZXOYDHHFHHTONK-QCEMKRCNSA-N 492.367 0.910 50 20 JCGD Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(C(F)(F)F)o1 1787483716 YXYWILIFNBTLMY-BPUTZDHNSA-N 481.236 0.589 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(=O)n3C)C[C@@H]21 1787508738 KDBPXCUQNJFQGU-GDJYOZILSA-N 468.514 0.113 50 20 JCGD COc1ccc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610193 OMPDUXRKARCRGQ-JHVJFLLYSA-N 467.526 0.909 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1 1789923528 SAQNWYNIZKGVCJ-SMSYFYOWSA-N 496.374 0.932 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)[C@@H](C1CCOCC1)C(=O)N3)C2)[C@H](O)CCl 1792981902 ZAHHEEGYLQUQHU-CULFCCOHSA-N 491.972 0.952 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1793865925 JRJCKVNQIRVXKA-BASYENTBSA-N 472.546 0.946 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1-c1ccccc1)C2)c1ccc(B(O)O)cc1 1795734494 QTLMINKIVCWETD-JHDGKUDLSA-N 471.322 0.945 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C(F)(F)F)cc1)C2)c1ccc(B(O)O)cc1 1795734718 MIWBYEDAQFNGMK-UPHUGPLXSA-N 476.260 0.831 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(O)C(F)(F)F)C2 1796439498 HVIHFHZMDJYAIZ-XFNFXYANSA-N 459.425 0.023 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](N)Cc1cccnc1)C2 1796892367 YIZKAIOLDFIBTI-RTOSZMOLSA-N 451.531 0.724 50 20 JCGD Cc1nc2sccn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797751515 BZOBDSHLOIBRLF-YWVIFJGQSA-N 469.527 0.220 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N(C)C)nc1 1798262290 MQABHCLEAWSSPV-KEMUROEHSA-N 467.530 0.485 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)nc1)C2)NC(=O)NCc1ccccc1 1799097211 IQJKWFNKGQMCKE-HATOLVCRSA-N 484.532 0.770 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H]2CCC(=O)N2C1 1799146100 LOGRRHLQTOSFOY-ZBRRTKQMSA-N 484.557 0.111 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2 1800639428 VXYLWQSYCYMBRZ-LMWOUKEDSA-N 474.377 0.862 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnc2[nH]ccc2c1 1800844839 JJGPPFMNSYRCGP-UPHUGPLXSA-N 477.525 0.397 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801011829 IYFMSXVETHWSKM-HBCWATKFSA-N 467.954 0.710 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]13C[C@H]1CCN3C(=O)OC(C)(C)C)C2 1801013107 VMAAQACICDNYBY-PSCDBPSGSA-N 493.605 0.349 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c(C)c1 1801912030 STLIPCKPICYYKJ-UPHUGPLXSA-N 460.531 0.358 50 20 JCGD Nc1ncc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1 1807365305 UIVIFAYHNDUMPR-MAUKXSAKSA-N 451.317 0.434 50 20 JCGD CC(=O)N(C)CCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810293327 CQZAAVMGNJNXFU-LAUBAEHRSA-N 467.530 0.268 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@@H]1c1cccnc1 1810295697 VRMZQQGDPBLYEV-LAUBAEHRSA-N 460.498 0.432 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCC3(CCCN(C(=O)[C@@H](F)Cl)C3)CC2)n(C)c1=O 1810899694 UKZDWJYZIQAUFI-OAHLLOKOSA-N 468.917 0.199 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1 1812353226 MDFJZGJPBQGATL-ZHRRBRCNSA-N 471.518 0.035 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813071577 UVOWTFBSXYTLNV-OXJNMPFZSA-N 457.535 0.516 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccccc2C(N)=O)[C@@H]1c1cccnc1 1813072305 FCCGSKHBVHCWBJ-VGOFRKELSA-N 466.542 0.873 50 20 JCGD Cc1c(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn2[nH]cnc(=O)c12 1813074662 UXPOJWGKIWQZOT-JTSKRJEESA-N 494.556 0.419 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1 1813075267 ZSMCJFTWKQLTOU-SQGPQFPESA-N 465.576 0.038 50 20 JCGD Cc1cc(C)n(CCC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1813304859 GKKSABBROUGIGQ-ZJSXRUAMSA-N 475.358 0.985 50 20 JCGD CCOc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1 1815343594 CKVDSNQYUITAJB-AWEZNQCLSA-N 467.316 0.551 50 20 JCGD COCCOCCOCCC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361699 NLELOVWWSFMIBM-KRWDZBQOSA-N 491.375 0.118 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1n[nH]c2c1CS(=O)(=O)C2 1815851277 PBLACAQZDMZTIF-RDDDGLTNSA-N 459.937 0.120 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3nncn3c2)[nH]n1)c1cccc(B(O)O)c1 1817476551 WQRCAKCSXBNLJG-SFHVURJKSA-N 459.275 0.752 50 20 JCGD COCCn1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n1 1818260314 ZNNWFBQTMFYLBO-SFHVURJKSA-N 481.517 0.871 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1 1824188533 SMQFJBGKLDZBFH-BBWFWOEESA-N 489.013 0.975 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nn[nH]c1C(F)(F)F)CC2 1826088713 KGIIOVZPXWKXGM-MRVPVSSYSA-N 474.469 0.879 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)CC2 1826088886 RCJARVUMXCVLPY-APPDUMDISA-N 484.579 0.271 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CC[C@H](O)CC3)sc2C1 1826341270 RWSLVOCHQXKTLF-AVGNSLFASA-N 458.544 0.919 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)N1C[C@@H]2C[C@H]2C1 1828809503 NPNWRFOLCHAJJH-SPAWWWTRSA-N 453.392 0.940 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)NC=O)CCN2C(=O)OCc1ccccc1 1829228091 QSURVYUNONVFIY-HFJQGTKSSA-N 494.976 0.827 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1cc3ccccc3n1C)CCO2 1830435321 XUEPJVUPHTWRHK-VWLOTQADSA-N 485.585 0.550 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1830538387 DYOKTTZEQWMVSY-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1 1830539426 GRVVUYOYNDSDJI-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830543652 XNDCBEIIORGBJJ-KXBFYZLASA-N 461.353 0.983 50 20 JCGD COc1ccc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)[nH]c2c1 1830727786 FGZSBKIRWJDNTH-GHTZIAJQSA-N 451.907 0.846 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCCC(=O)OC(C)(C)C)CCO2 1830803934 RYKDJCHWBLMURQ-HSZRJFAPSA-N 484.594 0.328 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1831192752 HTIYTWMOEVJNCR-BEFAXECRSA-N 462.385 0.780 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CC(N)=O)CCO2 1831610403 ZIHULXUYFPKXCQ-JLCFBVMHSA-N 492.485 0.102 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ncc[nH]3)C2)C1 1832552057 XBCJCLILQKJEOE-AOMKIAJQSA-N 499.996 0.931 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cn1 1833435441 XXSTUCCUURNDLF-RHSMWYFYSA-N 461.288 0.636 50 20 JCGD CC(C)(C)n1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1833957927 UUXPEFYMZYMAFE-UHFFFAOYSA-N 481.406 0.817 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4cnccc4[nH]3)CC2)CC1)c1ccc(B(O)O)cc1 1834798590 NQVCYPCWWLWEHK-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccn4ccnc34)CC2)CC1)c1cccc(B(O)O)c1 1834799947 HRAALVYNRNOTFE-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n[nH]1 1834799961 IRDJWMKGEACROX-UHFFFAOYSA-N 453.352 0.151 50 20 JCGD Cc1cc2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)[nH]c2cc1C 1835930698 VBKTXXSZXSMPJM-RUZDIDTESA-N 492.341 0.243 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3csc4c3CCCC4)C2)C1 1835937389 SRFFQSHHLKMKLY-DEOSSOPVSA-N 484.383 0.691 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1Cc3ccccc3O1)CCO2 1836648698 HLFUISJLZBZDOH-XFXZDEKRSA-N 495.536 0.581 50 20 JCGD COc1cnc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(F)c1 1837321024 GCVDAZKDVJEOJA-UHFFFAOYSA-N 485.321 0.835 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sccc3Cl)C2)C1 1837459186 LVEKUWJBKJBIOO-FQEVSTJZSA-N 479.946 0.784 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1 1838479772 DQMFRBTVZXXCFO-KPZWWZAWSA-N 456.293 0.664 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)CC2)CC1 1838786216 MCAIHGFFYKTPQS-WOJBJXKFSA-N 483.997 0.709 50 20 JCGD Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1838940257 SXUQBXDVFSJHKS-HSZRJFAPSA-N 453.499 0.377 50 20 JCGD O=C(c1cn2ncccc2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201442 XVOPNTNGPTUWLD-PBHICJAKSA-N 456.272 0.490 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(NC(C)=O)c(O)c3)CCO2)C1 1839473486 BIWDESYOZJQMAO-KKSFZXQISA-N 469.922 0.674 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1 1839583908 CQCCZEBEZPPUCO-YJYMSZOUSA-N 455.353 0.762 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(CCOC)n3)C2)C1 1839964257 LDPQRYLKVDXUSR-BEFAXECRSA-N 473.368 0.773 50 20 JCGD CC(C)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1840001032 PMELYRNWYBPTFY-SANMLTNESA-N 480.370 0.803 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)c(O)c3)C2)C1 1840149478 QNTWNLZYFUKSIK-KKSFZXQISA-N 456.923 0.654 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3CNc4ccccc4O3)C2)C1 1840153003 AQBUXYDKUIMHKX-JLHGSKIFSA-N 467.950 0.960 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1 1840184914 FPHFLSLNAUCZCH-HSZRJFAPSA-N 462.547 0.447 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1841414925 RTQQLZVUDAYZOE-NRFANRHFSA-N 463.343 0.782 50 20 JCGD CCc1nn(C)c(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1Br 1843011003 FFUNODJINXMMOX-UHFFFAOYSA-N 475.152 0.556 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](Br)Cc1ccccc1 1848073388 BPVVSMSUWPHKNU-FHWLQOOXSA-N 498.443 0.925 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1 9746391 KLEUXTSUJGEBAC-UHFFFAOYSA-N 487.498 0.912 50 20 JCGD CC(=O)N[C@@H](C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 22698731 SCECUEABGOPJDU-KRWDZBQOSA-N 487.582 0.479 50 20 JCGD COc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2ccco2)N2CCOCC2)cc1OC 725873343 YGWGPTLOOZVLHE-MRXNPFEDSA-N 475.502 0.431 50 20 JCGD O=C(COC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1 728333603 KCQKUGHIWYLYLE-YLJYHZDGSA-N 467.478 0.751 50 20 JCGD COc1ccc(CCN2C[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cc1OC 728846018 UHAMSOYERQWROS-LJQANCHMSA-N 496.568 0.949 50 20 JCGD CS(=O)(=O)c1ccc(N2CCN(C(=O)NNC(=O)Cc3cccnc3)CC2)c([N+](=O)[O-])c1 728957450 VKRKYLOOBOZRDY-UHFFFAOYSA-N 462.488 0.499 50 20 JCGD O=C(CC[C@@H]1NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O)NNC(=O)C(=O)N1CCCC1 730540294 OJOPYBSENCFUMQ-ZDUSSCGKSA-N 456.286 0.968 50 20 JCGD COCCCNC(=O)NNC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1 745867652 BSQLUTZNYABBFP-HXUWFJFHSA-N 453.499 0.867 50 20 JCGD Cc1cc(/C=C(/C#N)C(=O)NCCS(=O)(=O)N2CCOCC2)c(C)n1C[C@H]1CCCO1 748047952 XPESAHYUZADTKL-QRRJMBGHSA-N 450.561 0.969 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CCc1ccccc1 749852039 XLANVAZABRDROP-SFHVURJKSA-N 467.569 0.548 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1 914981556 NDFHECQYQMMIRK-UHFFFAOYSA-N 451.457 0.227 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCCN3CCCCCC3=O)nc2)CC1 915905712 WZUXUEYNCGDACG-UHFFFAOYSA-N 467.596 0.437 50 20 JCGD Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 916108730 VLUKLTKTJLAFLK-GOSISDBHSA-N 475.506 0.616 50 20 JCGD CCO[C@H]1C[C@@H]1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 916147853 HAGLMKKRLQYBEY-ROUUACIJSA-N 482.541 0.636 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)NCC1CC1)c(=O)n2Cc1ccccc1 916249542 WZNJCLCWVPOFFM-UHFFFAOYSA-N 467.530 0.804 50 20 JCGD C[C@@H](Cn1ccnc1)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916623404 RDFVOLQUAPZWTP-INIZCTEOSA-N 464.548 0.256 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCCCN2CCN(C(=O)OC(C)(C)C)CC2)c2ccccc2c1=O 916641001 RZJYIQBZJHNNEE-UHFFFAOYSA-N 487.561 0.820 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cc2c(cc1F)NC(=O)CC2 917724492 ZPKAOLRYWMBXPG-UHFFFAOYSA-N 469.520 0.935 50 20 JCGD COc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1[N+](=O)[O-] 918129022 ZKTQDWLGVHLUTF-UHFFFAOYSA-N 493.498 0.769 50 20 JCGD CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1 918552338 QDIXQTBDCZNRQV-INIZCTEOSA-N 466.589 0.930 50 20 JCGD CSCC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)CN1CCCC1=O 920827931 ZSMONZMLLKOKLN-QSOAKEGCSA-N 454.574 0.468 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(N4CCCC4)ccn3)CCO2)C1 1779030678 TWYMYAPYBKCSNW-DEOSSOPVSA-N 479.541 0.438 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1n[nH]c2ccc(F)cc12 1779087394 OODRAPIGJMBYLZ-HYBUGGRVSA-N 480.305 0.823 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1779203879 RXVJGAVSDCKHCE-HSZRJFAPSA-N 497.464 0.997 50 20 JCGD Cn1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c(C(F)(F)F)n1 1779710153 QAYDFZWIWHZDTN-DYESRHJHSA-N 494.279 0.560 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1779901222 LHSXBACVMQLJPJ-DYESRHJHSA-N 453.923 0.683 50 20 JCGD CSc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1O 1780151212 IIHFDLPJNLKLKJ-JOCHJYFZSA-N 471.539 0.870 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ncccn3n1)C2)[C@@H](F)Br 1780773734 UYUYJXCWHMJPPZ-PSTGCABASA-N 455.288 0.942 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ncccn1)CCO2)NC(=O)NCc1ccccc1 1780968830 FVAJDABJGVDGQB-QHCPKHFHSA-N 467.530 0.266 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nn1C 1780970588 XVPHYSKADQALRT-XMMPIXPASA-N 483.573 0.518 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1 1781771461 AVMGKAJMYUQOTP-HXUWFJFHSA-N 451.455 0.550 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1782768595 YDHVFFXIIUDFOF-YCRNBWNJSA-N 451.612 0.746 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1783349916 WBLZNTKDNJOHIE-KBXCAEBGSA-N 454.325 0.302 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1783554855 UFZZWLQSMXUJRC-ALGWMNEGSA-N 481.557 0.284 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1783972616 ZNLNIUDVHIEKLI-GLCFDMNSSA-N 451.549 0.064 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@H]21)[C@H](O)CCl 1784091938 FHJGHDXAZWSMPH-SPGJAERMSA-N 451.867 0.664 50 20 JCGD COc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1F 1785298510 GTYFCDDJEINDDP-QFIPXVFZSA-N 457.462 0.590 50 20 JCGD Cn1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]32)n1 1785872082 SAGNUPBKLWUJJP-AJNGGQMLSA-N 470.958 0.541 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(F)(F)F)CCC3)[C@H]2C1 1786757351 RQRYMQMOBMITMV-XIRDDKMYSA-N 454.254 0.692 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cc(F)c3F)C[C@@H]21)c1cccc(B(O)O)c1 1786986467 DEQMBQLXJOCLPH-IXDGSTSKSA-N 462.233 0.691 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(C)nn(C)c3C)C[C@@H]21 1787508142 IKQIDSLGFACXFJ-VPOFNPCUSA-N 483.573 0.693 50 20 JCGD N#Cc1ccccc1OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611400 XGIBWXBUXDDJPA-LRQRDZAKSA-N 478.509 0.229 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)no1 1788669780 SVPRAXZNRMMCEV-YDHLFZDLSA-N 457.325 0.478 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)[C@H]2C1 1790176732 DNEFLLCHJHMVCE-YGJAXBLXSA-N 478.384 0.983 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)C[C@@H]21 1790693832 PEXMTVGOUMUUQS-OKKJGQSOSA-N 487.463 0.450 50 20 JCGD CCOc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1OC 1791152212 GUMCDAGSFJSZFA-PTLVVNQVSA-N 496.369 0.610 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)[S@@](=O)c1ccccc1 1791293935 PNBUSZYJFKBBTK-PLONXWACSA-N 478.615 0.535 50 20 JCGD COc1cccnc1CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1794302286 BRAONXIVGRGVPV-MUJYYYPQSA-N 452.515 0.973 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3ccccc3c1)C2)c1ccc(B(O)O)cc1 1795732395 AKWOGBDSQGUDLA-BRTYFSMRSA-N 458.323 0.966 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)C(F)(F)F)C2 1796893571 IDKSEJXHPSLYGS-OHTJZTCPSA-N 456.425 0.437 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(F)cc1F)C2 1797748593 KXLBKRVICSOWLC-GAKFLWOGSA-N 471.464 0.880 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#Cc1ccc(Cl)cc1)C2 1797748692 USQKBFLAVRECQU-VPTLXERWSA-N 467.913 0.593 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl 1799276119 GVANQVPVDVNJQS-APPZKNGHSA-N 454.351 0.655 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)cc([N+](=O)[O-])c1 1799730091 TXRKYIROIVKBKQ-UYNJTKMTSA-N 484.469 0.638 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1800229851 ZULPBTPYZCWPGB-LHGZKFJMSA-N 463.491 0.272 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(O)cc1Cl 1800903923 IUKBRYHFXHWXFQ-GAKFLWOGSA-N 485.928 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]13C[C@@H]1CCN3C(=O)OC(C)(C)C)C2 1801013104 VMAAQACICDNYBY-NVHIMHAJSA-N 493.605 0.349 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCS(C)(=O)=O)NC(=O)NCc1ccccc1 1803266454 UBDQFARWBNWTPF-REPLKXPHSA-N 479.603 0.406 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@@H](O)c1ccccc1 1806802443 VKFCIDRZLMWECZ-PUHATCMVSA-N 459.311 0.815 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365708 LWGLXNMWXAZBRD-OKNGYXHYSA-N 450.304 0.121 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375960 WQOVGLCEHFJWTB-KNQAVFIVSA-N 496.373 0.996 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnc2ncccn12 1809331122 QBDNOASSOMTRJV-GHTZIAJQSA-N 470.298 0.438 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1C 1811142380 RWBFZGKYWFIRMP-PGRDOPGGSA-N 461.331 0.691 50 20 JCGD NC(=O)c1ccccc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1811279114 IQAYOXNPMOXYDX-AVRDEDQJSA-N 472.310 0.494 50 20 JCGD COC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1812688265 SYHMSTFSZFUUEZ-MJGOQNOKSA-N 451.288 0.034 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCN2CCOCC2)[C@@H]1c1cccnc1 1813069922 BPGUCRFQRRLREA-WMZHIEFXSA-N 460.579 0.183 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=N/O[C@H]2CCCCO2)[C@H]1c1cccnc1 1813074713 WAIYHNJDKIELPM-SBGDMHTPSA-N 474.562 0.989 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1 1813075011 YSMIDNMEIGOZEQ-QRWLVFNGSA-N 469.502 0.262 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(C)(C)C 1817470841 ZHZPAEFUIBHKKU-UYAOXDASSA-N 469.351 0.946 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cn2cccnc2n1 1819040363 OGGYZXYQTGVIDP-SFHVURJKSA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ccccn3n1)CC2 1819797117 LPISKOUEJIIBFT-NSHDSACASA-N 477.510 0.724 50 20 JCGD O=C(Cc1ccc2ncnn2c1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1822496110 IRHNTAXLFMWDCM-INIZCTEOSA-N 476.327 0.334 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)sc2C1)c1cccc(B(O)O)c1 1822621936 GBNWTOYHDWKZFR-USXIJHARSA-N 482.371 0.450 50 20 JCGD CN1CCCn2nc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3cccc(B(O)O)c3)CC4)cc2C1 1824381653 IKRKETRDZNHIQJ-INIZCTEOSA-N 494.386 0.395 50 20 JCGD O=C(c1cccn2c(O)nnc12)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052974 RDWMAZNBFYLFDQ-FQEVSTJZSA-N 477.330 0.662 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059806 JDIWXAAGKQNSJE-FQEVSTJZSA-N 451.332 0.821 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)CC1 1829043125 UBZBWICDWRYGDD-HXUWFJFHSA-N 479.541 0.952 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C#CC(=O)O)CCN2C(=O)OCc2ccccc2)C1 1829334316 HPNQPZQITAYJHU-WZONZLPQSA-N 491.928 0.780 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)nc1)CCO2 1829513075 WPJLUCYAVCIGPV-FQEVSTJZSA-N 453.927 0.178 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830720046 ROZBVXAPFKOTLW-GRXQJBFDSA-N 460.955 0.412 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830737990 JNTZZQUTEYJLQA-APWZRJJASA-N 495.381 0.413 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1)n1cncn1 1832203778 MIHIGMJVHUHNJY-HNAYVOBHSA-N 454.535 0.771 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832880177 AONHTRCRUMALIH-MGPUTAFESA-N 485.379 0.765 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnnc(Cl)c1)CCO2 1833207619 SCIQMHZUCSPROQ-PFRKPPGBSA-N 489.920 0.334 50 20 JCGD COc1cc(C(=O)NC2CCN(C3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CC3)CC2)n(C)n1 1833952901 DOFHITDCBCOGFW-JVWAILMASA-N 498.588 0.748 50 20 JCGD CC(C)N[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(C)C 1834797942 NYXAWGZNFDFACM-QHCPKHFHSA-N 472.439 0.574 50 20 JCGD NC[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Br)Cc3ccccc3)CC2)CC1 1835067227 MNJLOAMCVOOOTP-PMACEKPBSA-N 480.451 0.850 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(Cl)cccn34)C2)C1 1835928121 FDDRRTBHRDPLAF-HSZRJFAPSA-N 498.732 0.051 50 20 JCGD O=C(c1ccc2cc[nH]c2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928346 LVBYFUXZSDNYNO-XMMPIXPASA-N 463.299 0.232 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930499 JWGYKKKVIHFYAA-RUZDIDTESA-N 490.325 0.002 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc4ccccc34)C2)C1 1835936889 ICPWPPWJDDZTDA-VWLOTQADSA-N 491.309 0.004 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1 1835986443 SQFIZNIAMFKQIH-BEFAXECRSA-N 457.369 0.840 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)nn3-c3cccc(=O)n3C)CCO2)C1 1836259832 LYSBXLXTVSIBJK-HXOBKFHXSA-N 491.976 0.967 50 20 JCGD Cc1cnc2c(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](C)Br)C4)C3)cnn2c1 1836949903 HNVRNHOLOIDXCX-IFXJQAMLSA-N 466.336 0.891 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)c(F)c3)C2)C1 1837457775 QQJYVDCAWJUNFR-QHCPKHFHSA-N 489.479 0.276 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cn4ncccc4n3)CC2)CC1 1837919374 JYSKCBSEIIHNKB-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921186 JIDABDKUEVVQNH-QGZVFWFLSA-N 481.362 0.269 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839020268 TXSXSRDDVDWSTB-HSZRJFAPSA-N 462.547 0.528 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839031989 ZFEKVJCSUOICPN-VFNWGFHPSA-N 462.971 0.801 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1[N+](=O)[O-] 1839189559 SORSQSHYVQRGNP-YLJYHZDGSA-N 455.895 0.502 50 20 JCGD O=C(c1ccc([N+](=O)[O-])o1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839197199 LQDCUINZHLVUMN-WFASDCNBSA-N 450.217 0.948 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1839210153 GAIFWHMCDKISOR-ZXYWRSMDSA-N 467.922 0.253 50 20 JCGD CC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839860872 RJJKLWUQEYXKDM-CRAILRFSSA-N 462.453 0.464 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1 1840035351 OCJNHHVVZBFULS-BFUOFWGJSA-N 454.321 0.639 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)Nc3c(C)cccc3C)C2)C1 1840154796 GZBMLWLTQURFPL-JTSKRJEESA-N 467.950 0.952 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1 1840156661 RZFJAAOUZNHIGL-QRWLVFNGSA-N 463.959 0.611 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187401 YEVRLTGEXZWFPE-JOCHJYFZSA-N 482.965 0.792 50 20 JCGD O=C(c1ccc(CCN2CCCC2)nc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011331 SZRPYCPIAKUTPT-UHFFFAOYSA-N 462.359 0.531 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)C[C@@H]2C1 1843012415 NBSQZCIJPJCPIB-CJAUYULYSA-N 483.374 0.831 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)c1cc[nH]n1)C2 1843428800 QKTWJDHEPMJISV-IBGZPJMESA-N 497.361 0.043 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2 1844264446 UAQJUGOVVCJQIH-NRFANRHFSA-N 478.553 0.403 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cccn3c(O)nnc13)C2)NC(=O)NCc1ccccc1 1845038732 MJGWLECSTBCDLZ-UHFFFAOYSA-N 492.540 0.598 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc2c(=O)n(Cc3ccco3)c(S)nc2c1 10138787 XGCIXVFHDMYZDT-GFCCVEGCSA-N 462.509 0.522 50 20 JCGD Nc1nc(CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)nc2ccccc12 10230085 DHUXUIDCFFHQFX-UHFFFAOYSA-N 464.486 0.699 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc(OC)c1OC 14907268 TWJPIDOQFGWIKM-UHFFFAOYSA-N 479.511 0.808 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])o1 25166064 STJJWWVNJRDLMM-UHFFFAOYSA-N 452.445 0.603 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1 725740051 RAEYHVHYUYUREY-UHFFFAOYSA-N 450.542 0.170 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)[C@H](C)N2C(=O)NC3(CCCC3)C2=O)c2ccccc2c1=O 726523624 SASWPYZSZSTXHA-ZDUSSCGKSA-N 454.487 0.992 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@H]1CCCOC1)N(S(C)(=O)=O)CC2 727849314 XLJYKHJDNHEDKR-GOEBONIOSA-N 455.533 0.527 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1 728205635 UXYYYDQRBDTJJX-HNNXBMFYSA-N 464.548 0.695 50 20 JCGD C[C@H](C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)N1C(=O)c2ccc(Br)cc2C1=O 728386640 ZRXPYNQYMJWOCE-RKDXNWHRSA-N 458.290 0.016 50 20 JCGD O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)C1CCN(c2ncccn2)CC1 728943689 BLMGJAKNUZHHML-UHFFFAOYSA-N 472.550 0.668 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(-n2cnnn2)c1)c1cccc(S(=O)(=O)N2CCCCC2)c1 743731496 XPKABYWKUXEICE-UHFFFAOYSA-N 491.555 0.460 50 20 JCGD CC(C)[C@@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)N1CCCC1=O 748552027 BAFPDPSICOAUHP-NRFANRHFSA-N 480.587 0.435 50 20 JCGD C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)CNC(=O)c1cccs1 751209321 OTESPQHBCQIJTI-OAQYLSRUSA-N 455.496 0.624 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1nn(-c2ccccc2)cc1O 789852849 YALHVXXEAHTRCT-UHFFFAOYSA-N 487.494 0.479 50 20 JCGD NC(=O)[C@@H]1CC(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)=NN1c1ccc(F)cc1 913200723 NOGGJGGJHJFIBW-INIZCTEOSA-N 461.837 0.904 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)NC3CC3)cc2)c1 913465462 CDIQNXLLWDGTSQ-UHFFFAOYSA-N 494.595 0.771 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N(C)C)o2)c1 914846293 GHHSVOOIFHWTPU-UHFFFAOYSA-N 472.545 0.635 50 20 JCGD COCCN(C)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 916582145 OOJTXKVBWKBRCU-UHFFFAOYSA-N 455.581 0.774 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1 916830773 WCEKEDXPIITURK-UHFFFAOYSA-N 466.541 0.406 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCc2cccc(CN3CCOCC3)c2)c2ccccc2c1=O 918223565 JIRZDHBCBGPSCR-UHFFFAOYSA-N 450.499 0.910 50 20 JCGD CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1 918548914 COCJJGMCZGYFGJ-SFHVURJKSA-N 451.593 0.408 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)N[C@@H]1CCS(=O)(=O)C1 919883076 AIVRVLMNUPCUPP-CQSZACIVSA-N 478.980 0.258 50 20 JCGD CCOC(=O)C1CCC(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1 921118859 ZSIZGTCEDXJZAM-UHFFFAOYSA-N 468.580 0.766 50 20 JCGD COc1ccc([C@H](CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)NC(C)=O)cc1 921173784 RMPFTTFZCBXZEX-FXAWDEMLSA-N 471.466 0.793 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cncn4c3)C2)C1 1778691891 VRLUXQWXDZLUHI-LRULAXNGSA-N 463.498 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3[nH]ncc3c1)C2 1779372225 DACHBCDJPFCGNC-WZONZLPQSA-N 478.513 0.398 50 20 JCGD O=C(c1cc(=O)nc2cccnn12)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1780059723 GFADUPYIWXJEIK-RHSMWYFYSA-N 454.256 0.224 50 20 JCGD CC[S@](=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968911 QVRPSRHHMBDGFY-NHOCJEJCSA-N 493.630 0.321 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nn1C 1780970585 XVPHYSKADQALRT-DEOSSOPVSA-N 483.573 0.518 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C#N)(C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1 1781168168 WLBGQIVEMFOFHK-KSFYIVLOSA-N 484.981 0.957 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781335512 UEZYESRMFXSVHO-BXUZGUMPSA-N 454.343 0.367 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cn1 1782209410 NEDBTFXTUMFREE-NTKDMRAZSA-N 475.590 0.910 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CSCC(=O)O)C1 1782222529 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JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)[S@@](=O)c1ccccc1 1786983742 RKGBIBOGCQWZGP-JOIMRNKESA-N 484.383 0.156 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4C3)C[C@@H]21)c1cccc(B(O)O)c1 1786985124 MZZVWONBOKYWLW-WMIMKTLMSA-N 462.355 0.765 50 20 JCGD CCn1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)cc1C 1787508663 NKQFGJBABAIPJO-XWOIHUEZSA-N 469.546 0.939 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(S(C)(=O)=O)CC3)[C@H]2C1 1788111352 SNYSJNMFACAMOS-FPXQBCRKSA-N 484.446 0.874 50 20 JCGD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)[C@H]1SC(=N)NC1=O 1788141386 WHOCEIMBAXIJKF-SCLBCKFNSA-N 480.355 0.917 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788148025 WYZTZKGKXPKLNO-HXUWFJFHSA-N 453.304 0.265 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Nc3cnccn3)[C@H]2C1 1788628325 TXMQBNPYPNBYGN-JTWFQAASSA-N 482.545 0.391 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1)n1cccn1 1789726559 AAWYCOUHJYOBEU-QESAQDPVSA-N 497.600 0.770 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C[C@@H]21 1789871459 AKICQJHFRZZHFK-NGOJXBLDSA-N 475.329 0.973 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1793533846 WZMPYAAFBILJAD-VEFWNMNGSA-N 466.564 0.086 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCn1c(=O)oc2ccccc21)c1ccc(B(O)O)cc1 1794254939 YNACIBHFUVZKQA-REPLKXPHSA-N 463.299 0.616 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795115097 IJGXUMCZKKYSKP-XCCSTKFXSA-N 450.330 0.204 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cnnc3)cc1)C2 1796440113 DSUDTOQXAAWDHW-MXXHGQMLSA-N 490.524 0.605 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796445753 IVLNKPVGFMKCRZ-PUCRAGRTSA-N 485.541 0.465 50 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CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(-c3ccccc3)ns1)C2 1801013410 UAPJJKASHPLNFF-HGKCTWBKSA-N 472.571 0.781 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1804096964 ZNFIADIIYGFZAO-DETPVDSQSA-N 452.309 0.423 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCC3(CCCN(C(=O)[C@@H](O)CCl)C3)CC2)CC1 1805524297 OUYFSRMJWAJAMY-INIZCTEOSA-N 450.001 0.489 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC2(CCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)CC1 1806699274 DYIMSMZZLZWOQC-INIZCTEOSA-N 478.453 0.979 50 20 JCGD N[C@H](CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccnc1 1807370566 GWNJMWMKTGPEAG-FJIJXJHWSA-N 473.342 0.566 50 20 JCGD Cn1nc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c2c1CCC2 1807374830 JORCSCYCMCCGPC-MBSDFSHPSA-N 473.342 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1 1809237486 ZRUWKGMVBSMSMF-YJBOKZPZSA-N 486.496 0.151 50 20 JCGD COC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810299268 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CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)[nH]n1 1822415233 XCHIGTPYHYIRKK-INIZCTEOSA-N 456.507 0.809 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826089611 HLBVTQPSKYINSW-UONOGXRCSA-N 487.586 0.642 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)CC1 1827048584 WHAHQUQBYXESDZ-KRWDZBQOSA-N 472.550 0.024 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)CC1 1829621381 MKCJXVVDXPXZII-SFHVURJKSA-N 483.573 0.696 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1830450317 QASHPNFITGGDPD-IQGLISFBSA-N 482.342 0.249 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1830538121 WHFJHUJUAAWLGM-QFBILLFUSA-N 462.385 0.196 50 20 JCGD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830678681 BUIRAVVHDIOZLQ-QFBILLFUSA-N 476.313 0.847 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1830698356 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Cn1c(=O)c(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)nc2ccccc21 1833310347 RGGQREFRJDTVJP-IBGZPJMESA-N 475.977 0.718 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)[C@H]1SC(=N)NC1=O 1834821596 OOXPKFJJXWOHSD-PPHDSNJXSA-N 477.381 0.030 50 20 JCGD Cc1cccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835927560 SSKLEKAHPQOSBK-VWLOTQADSA-N 466.343 0.378 50 20 JCGD Cc1ccc2[nH]c(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2c1 1835936839 GDXJPAWYSVTWOR-RUZDIDTESA-N 477.326 0.540 50 20 JCGD Cn1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n1 1836058661 PSZPGELGPPVILM-JTSKRJEESA-N 499.996 0.551 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1 1836196980 KFEDMJMYJYNKRD-UHFFFAOYSA-N 484.517 0.420 50 20 JCGD C#CC(=O)N1CCC(N2CCC(NC(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1836344075 VFBWOROYTNLUIC-UHFFFAOYSA-N 454.575 0.537 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1 1836413762 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C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830734042 ZSLSVYDPEWDGNY-LTMIRXACSA-N 497.976 0.605 50 20 JCGD CCOC(=O)N(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)Cc1ccco1 1830737871 JKZZUSYYAXJRMG-UTKZUKDTSA-N 487.937 0.294 50 20 JCGD CN1CCCn2nc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)cc2C1 1831043084 JUAIOTOQVGGSGY-DEOSSOPVSA-N 493.417 0.946 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CS(=O)(=O)CC)CCO2)C1 1831341110 HRWHKJHGPQGADA-XJKSGUPXSA-N 455.371 0.051 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833028263 MULCNTOBONPYHS-CGSMKXTHSA-N 468.938 0.467 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1 1833399892 IWIJWAYYAHFRBP-RHSMWYFYSA-N 494.339 0.246 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccc(N2CCOCC2)n1 1835197592 ICKJFXPSPIZTRY-HXUWFJFHSA-N 480.009 0.703 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2c1 1835930639 RAJPJDLLGKZSIF-VWLOTQADSA-N 493.325 0.240 50 20 JCGD Cc1ccc(OCCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835933786 DICPOLDRCRYKPI-RUZDIDTESA-N 482.342 0.214 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1 1837458791 CMNVBKWZIRRJCS-HSZRJFAPSA-N 497.487 0.084 50 20 JCGD CCc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)s1 1837459608 STGGVCOWFFTZKN-NRFANRHFSA-N 474.543 0.088 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)n1ccccc1=O 1837689085 MZQXQMFUVGIIFG-SIIHOXLZSA-N 460.300 0.556 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3nccc4nc[nH]c34)CC2)CC1 1837920429 XVCWRVIYXBYSQO-UHFFFAOYSA-N 477.330 0.564 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cc1)CCO2 1838960329 IMHYEIVNHCHTJW-OAQYLSRUSA-N 452.939 0.783 50 20 JCGD CO/C=C(\C)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054170 JMMYHJYHVWTSKA-KOZCBZIKSA-N 489.573 0.339 50 20 JCGD C[C@](O)(C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)C(F)(F)F 1839198662 MKTBHOWCUZMIRT-JIMOISOXSA-N 451.211 0.447 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)ccc1C 1839402612 XHMIGHINIVNABO-WIYYLYMNSA-N 453.923 0.623 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc2N1 1839607982 DDRSZLQYAAQLRZ-UWJYYQICSA-N 451.907 0.241 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3N1)CCO2 1839734925 CSKJPBYVWXNNTA-BOETVACASA-N 494.552 0.614 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1840154283 RHPJHURWTHLCCH-MEBBXXQBSA-N 455.821 0.147 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1 1840154850 HTTLSWJTJURURI-UWJYYQICSA-N 453.898 0.950 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3ccc(C)cc3)CCO2)C1 1840905512 KPLMFEFEKHBNPT-AVRDEDQJSA-N 467.950 0.435 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2nc3ccc(C(F)(F)F)cn3n2)C1 1843155235 HVGKMRZJYXMTPA-UHFFFAOYSA-N 473.220 0.559 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(n2)OCCO3)C1 1843313350 XBPPBMCQXCXYRL-AFUMVMLFSA-N 452.471 0.804 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCC13CN(C(=O)c1cnccc1C(=O)NN)C3)C2 1845862726 IZHXAAVBZQKGMK-HNNXBMFYSA-N 495.540 0.138 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)c2ccccc2C1=O 1848086736 OZBOZVRMFSXGBS-OALUTQOASA-N 476.493 0.187 50 20 JCGD O=C(COC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NNC(=O)c1cccs1 10733630 KEXZIECSDCIMOF-UHFFFAOYSA-N 453.498 0.387 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2ccccc2)C1 16163920 YFKIPXHOGCIRCJ-MRXNPFEDSA-N 464.500 0.697 50 20 JCGD C[C@@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)C1=O 25438951 VFQMWPRROGDDNQ-FQEVSTJZSA-N 452.406 0.030 50 20 JCGD CCCn1c(CCC(=O)NNC(=O)CN(C)C)nc2cc(S(=O)(=O)N3CCCC3)ccc21 727761633 UZIKIZLDHMDHEQ-UHFFFAOYSA-N 464.592 0.872 50 20 JCGD O=C(NNC(=O)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)C1CCN(c2ncccn2)CC1 728960466 ZHZVTPPEUDVKEJ-UHFFFAOYSA-N 498.569 0.201 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O 729274947 HXSYAUJJCQGCRT-ZDUSSCGKSA-N 458.496 0.224 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)cc1 729275482 OQHLTUZJXISJDQ-CYBMUJFWSA-N 496.567 0.066 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCCN(C(N)=O)CC2)cc1 729361217 DILKGBZRGWOXHE-LGMDPLHJSA-N 465.514 0.954 50 20 JCGD Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1O 788024439 YFHJFVQLIVNBPD-AWEZNQCLSA-N 471.491 0.693 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)n(C)c2)c1 912979383 NXFAZQWNFHGUDO-UHFFFAOYSA-N 458.518 0.377 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2F)c1 913148733 AHLWFXLXOLGEQM-UHFFFAOYSA-N 486.547 0.596 50 20 JCGD Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C 913466280 RPXXXZFIJKHQFQ-UHFFFAOYSA-N 468.557 0.293 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 915187897 QZVMJXQGHBCBKN-UHFFFAOYSA-N 487.581 0.498 50 20 JCGD O=C(NNC(=S)NCCCN1CCOCC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1 916006081 SIOZFYNRAUPNJC-UHFFFAOYSA-N 491.639 0.996 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1)N[C@H]1CCS(=O)(=O)C1 919883229 BXZAUYUDZIVENR-KRWDZBQOSA-N 484.600 0.094 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N[C@H]1CCS(=O)(=O)C1 919883286 BYHDXPMHBFZYCZ-VIFPVBQESA-N 485.371 0.565 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919886621 VLFBNNFUMUPBRO-LLVKDONJSA-N 466.969 0.502 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc3c(c(C(=O)O)c2)OCCO3)cc1 919954642 PCDYBISMLBORNZ-UHFFFAOYSA-N 499.523 0.095 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)NCc1ccco1 920858358 QGBSCKSYHOXHER-HNNXBMFYSA-N 456.908 0.997 50 20 JCGD C[C@@H](OC[C@@H]1CCCO1)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 920999495 PVQYDEZQOYPXTM-AEFFLSMTSA-N 469.560 0.372 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc(C(F)(F)F)cn1 1777800887 HNXIHMOWRDNRRH-WIYYLYMNSA-N 492.263 0.617 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(OC)c1 1779032825 XDPOZLQKVJPQSO-QHCPKHFHSA-N 469.498 0.460 50 20 JCGD CNC(=S)NCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779034764 HCWXFHYVWLGGNV-VBKZILBWSA-N 492.042 0.432 50 20 JCGD CC(=O)NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1780055173 IZPBYLGLVWIYTA-DENIHFKCSA-N 476.486 0.784 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1780199998 DYYZEXRELZRNOZ-SFHVURJKSA-N 456.286 0.926 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(C)c1)C2)NC(=O)NCc1ccccc1 1780559054 XOOKSKCJNOOAPD-PXDATVDWSA-N 497.600 0.894 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)NC=O)C1 1780723725 DRKUDPJLTAYWMM-JSVDNDDVSA-N 476.486 0.782 50 20 JCGD CC[C@H](C)[C@@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968214 CGSMHUBSQHSLPQ-SNYIIPAISA-N 475.590 0.570 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2)NC(=O)NCc1ccccc1 1780969800 PZKBQOUHTPXUOW-IBGZPJMESA-N 473.908 0.994 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1)NC(=O)NCc1ccccc1 1780970129 RWKICNGBDPHAQQ-UROCCOEBSA-N 481.557 0.599 50 20 JCGD COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c([N+](=O)[O-])c1 1781411959 IFZSNTQBTAKARD-HSZRJFAPSA-N 498.496 0.288 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1782969087 RHOULOCTTGUPGO-JOCHJYFZSA-N 471.250 0.100 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1785568854 LXNXCMMNDVRBGF-HSZRJFAPSA-N 490.561 0.434 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1c[nH]c2nccc-2c1Cl 1787347053 FJKASRYHFMVKOT-JVPBZIDWSA-N 482.733 0.755 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CC(=O)N4)[C@H]2C1 1788261792 WTWSJNQFXIJPSJ-DCPHZVHLSA-N 478.509 0.087 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c(O)n1 1788609992 KOGVPNQJCMRJPA-KKXDTOCCSA-N 454.487 0.001 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3c[nH]c4ncccc34)C[C@@H]21 1788611292 RLEUYNGHECVZRE-NDXORKPFSA-N 491.552 0.788 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNCP(=O)(O)O)C[C@@H]21 1790694442 QCLXYVUAAAYINO-JLBONTIYSA-N 498.423 0.576 50 20 JCGD CO[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1791318577 APRKMBYBFYKCPV-GTAWCEEGSA-N 461.563 0.347 50 20 JCGD COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1C 1791889066 HLXZYFCZRMWAFX-ZRCAFCQKSA-N 467.526 0.909 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1792005535 YEUNXYPLAZRKRE-NDXORKPFSA-N 480.525 0.551 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734079 BERPJSOQZLBJOJ-OPMZPASUSA-N 460.299 0.135 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1795964633 UNZAPXLVONFAKJ-XEMDLRDOSA-N 451.332 0.576 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccc(C)cc12 1796271488 BQJXZHFGBOGQRR-BMDFQBGOSA-N 477.525 0.980 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](N)Cc1cccnc1)NC(=O)NCc1ccccc1 1796846682 QOOCBFZYLJLIMJ-BJESRGMDSA-N 493.612 0.936 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cn2ccc(Br)cc2n1 1797314961 HVHWOLIOBJWBSA-YHYOWMERSA-N 471.739 0.900 50 20 JCGD Cc1cccn2ncc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)c12 1797754039 QAIJGCBUGNUMKU-CCWDJLKJSA-N 463.498 0.158 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(C)[nH]n1 1797855181 VMUPNFCNBILCLQ-USGNIVHTSA-N 471.470 0.998 50 20 JCGD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c([N+](=O)[O-])cc1O 1799304656 PNHSHOSXBOGBRW-MUJYYYPQSA-N 469.259 0.554 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799341981 AYZOBXIVSOITMX-NZEXEKPDSA-N 468.320 0.152 50 20 JCGD CC1CCN(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1803387855 KEHFBSGHQHUISZ-XUZZJYLKSA-N 464.375 0.813 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)N2C)[C@H]1c1cccnc1 1808759781 NHDHPEOSEILUTJ-KKEHXXLMSA-N 479.541 0.842 50 20 JCGD Cc1nccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1808763416 MBYYRDHNRWJPBW-OXJNMPFZSA-N 460.498 0.812 50 20 JCGD O=C(COC(=O)C(F)(F)F)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810181303 CWYVIVMIWXYANU-MAUKXSAKSA-N 479.220 0.187 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1 1810293876 DXOYONVQSPTLFZ-XMSQKQJNSA-N 476.298 0.946 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810294136 IOEYCSRLUWXOOR-ALKREAHSSA-N 488.570 0.080 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@H]1c1cccnc1 1810294871 OZEOCMVKJBDWKA-MBSDFSHPSA-N 493.568 0.802 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cncc(O)c2)[C@@H]1c1cccnc1 1810305304 JZAUESPWPJNFHR-FOIQADDNSA-N 461.482 0.814 50 20 JCGD C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCCN1 1810305945 RCDWCOJZKCYOOG-BTCOZLQPSA-N 451.531 0.542 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1810339187 MEDIKRKTNXIPRI-XSLAGTTESA-N 455.895 0.182 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)n1ccccc1=O 1810514703 BEOVFCHMDGFPJE-MONBJTKQSA-N 474.326 0.504 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1nc2ccc(F)cn2n1 1812289113 DRQCMAQJSMHOLM-UTKZUKDTSA-N 488.288 0.577 50 20 JCGD COC(=O)CSCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813068257 KZJRLXLFMQLIRE-HRAATJIYSA-N 465.576 0.367 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1 1818693509 LEOHALNNSUUQMI-LLVKDONJSA-N 473.515 0.210 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOCC2)[nH]n1 1819402027 JFDFJEOEYFGKNH-GOSISDBHSA-N 470.534 0.436 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)COC(=O)C(F)(F)F)sc2C1 1819612658 ZNBZWIVGSYNIJK-QMMMGPOBSA-N 486.432 0.473 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1n[nH]c3c1CS(=O)(=O)C3)CC2 1825997978 DUXSYCWPOFFTQA-PSASIEDQSA-N 473.964 0.774 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828925931 VZLDHGGEPYKFGM-JPYJTQIMSA-N 475.546 0.534 50 20 JCGD CN(C)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828927425 DMPCOUKBQSTLRI-XXBNENTESA-N 480.993 0.990 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)N3C[C@H]4C[C@H]4C3)C2)C1 1830539774 IQHOJUYFRMCRAS-XFEYQPKCSA-N 458.397 0.814 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737264 CSMKKLGGORWIBF-CMBDLQSPSA-N 493.960 0.390 50 20 JCGD CN(C)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549470 QHUAKZFRFJLKDI-MGPUTAFESA-N 462.975 0.137 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)cco3)C2)C1 1832549678 WYQIKUZISUXQSY-KSFYIVLOSA-N 499.948 0.842 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccnc(C)c3)CCO2)C1 1832623115 DVDLCOHQAIBIMW-GQUZIAHASA-N 496.568 0.913 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccn3)CCO2)C1 1833976286 OFLVSJFVYCULFW-JOCHJYFZSA-N 485.453 0.694 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3[nH]cc4c3CCC4)CC2)CC1)c1ccc(B(O)O)cc1 1834798470 ZITXVULPVYGENT-UHFFFAOYSA-N 464.375 0.682 50 20 JCGD Cc1nscc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834799999 NLRWWCIJZQQZRX-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1834846584 VHEDNARNTODSJO-RUZDIDTESA-N 482.342 0.078 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)c3)CC2)CC1 1834987313 YWCZPFASBBDCFH-RWPZCVJISA-N 497.556 0.812 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4)CCCC3)C2)C1 1835926180 HYZKMBDBXCTNTM-SANMLTNESA-N 492.381 0.948 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1OC 1835932170 RDTBYEYHKCMJKF-RUZDIDTESA-N 498.341 0.076 50 20 JCGD Cc1nnc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)s1 1836081764 XOHVFYJXCYUTEG-DZGCQCFKSA-N 451.318 0.536 50 20 JCGD O=C(c1ncn2nc(N3CCOCC3)ccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1836289752 GSQDQPLKSGPCBW-RXVVDRJESA-N 496.927 0.170 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1836656214 QWDRHWCFWBFSJM-NQIIRXRSSA-N 453.923 0.244 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(F)c1 1836689734 PGZSPQOSJFLMGZ-NQIIRXRSSA-N 458.914 0.823 50 20 JCGD Cc1nn(C)c(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1F 1837338511 FNKQCAZAJCJWGU-UHFFFAOYSA-N 466.558 0.853 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837429373 VNNPLNJTPVYXSP-XMMPIXPASA-N 486.450 0.488 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1 1837456900 RVZXKWSKAVZLKW-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CCC3)C2)C1 1837461266 RVSOYUIVFIDYGC-RUZDIDTESA-N 493.564 0.877 50 20 JCGD CN1CCN(C2(C(=O)N3CCOC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)CC2)CC1 1837714887 QWQRBYDYPFTJKW-NRFANRHFSA-N 468.671 0.074 50 20 JCGD Cn1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(C(F)(F)F)n1 1837957903 RVJAIOYIHCWPRO-MLGOLLRUSA-N 454.833 0.109 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1839389457 QEGYBJNKLKXDDM-OWMRDYPQSA-N 484.347 0.998 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1 1839999555 IZOPJVQPDZVZFR-XMSQKQJNSA-N 452.935 0.874 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1 1840032675 HDRXQUFWFCBPFY-KPZWWZAWSA-N 487.307 0.852 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1 1840033123 UYWOUPFVKWGJSX-RRMPHLOHSA-N 466.376 0.941 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1840033847 SFYIBGNZFYJGDJ-BFUOFWGJSA-N 471.352 0.778 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncn3-c3ccncc3)C2)C1 1840150892 SOHPUEFRKWZAPQ-UTKZUKDTSA-N 463.922 0.591 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CN(C(=O)OC(C)(C)C)C3)C2)C1 1840156509 QDHGQLCBVDMPGG-JTSKRJEESA-N 489.997 0.954 50 20 JCGD CC(C)Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)n(C)n1 1840184009 NMWNAPSJYZLRTI-QHCPKHFHSA-N 478.594 0.062 50 20 JCGD Cc1cc(F)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840777051 BSHGUYFBOVEVSA-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CN(C(=O)OC(C)(C)C)C2CC2)C1 1841140989 IUBHGTWYMDIWBE-UHFFFAOYSA-N 451.568 0.962 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1844287062 YRIPSVCKELDHHV-IBGZPJMESA-N 491.453 0.832 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O 9930941 QLOKUISPENUWHN-INIZCTEOSA-N 455.492 0.721 50 20 JCGD O=C(COC(=O)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)NNC(=O)c1ccc(Cl)cc1 11388025 PNFSSVCUVGMYDZ-UHFFFAOYSA-N 460.786 0.849 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)cc1 17114033 ZCKKTAXEDKBFPA-SFHVURJKSA-N 483.568 0.303 50 20 JCGD CCn1nc(C(=O)NNC(=O)CNC(=O)c2ccc(OC)c(OC)c2)c2ccccc2c1=O 17190346 FWMNBVGNZBOTQX-UHFFFAOYSA-N 453.455 0.625 50 20 JCGD CCOC(=O)N1CCC(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 25166603 RBOKYKYIMYMANW-UHFFFAOYSA-N 496.586 0.656 50 20 JCGD O=C(Cc1cccc(F)c1)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 107911180 YWFNXMQCLMIFSW-UHFFFAOYSA-N 462.503 0.730 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNC(=O)OCc3ccccc3)cc2)CC1 728215467 FMUVHTJNZOWRAT-UHFFFAOYSA-N 461.544 0.992 50 20 JCGD CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)[C@H]1c1ccc(OC)cc1 729276110 XDCFBOJFTDWEGS-UCLAIMLFSA-N 468.576 0.860 50 20 JCGD C[C@H](NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)[C@H](C)N1CCOCC1 729624144 SQZVQQDVXIATJM-ROUUACIJSA-N 497.618 0.080 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c1ccc(C#N)cc1 769638779 FYPTZXQGNNOMKQ-UHFFFAOYSA-N 480.886 0.503 50 20 JCGD CN1C(=O)c2ccc(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc2C1=O 811957796 KHBIISNFAYQJPV-UHFFFAOYSA-N 456.480 0.772 50 20 JCGD COc1cccc(/C=C(\C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n2nnnc2C)c1 818027474 UEUACYMECJWBMV-LDADJPATSA-N 460.454 0.696 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 838617629 YCTBFXJZIRDQBJ-LLVKDONJSA-N 489.290 0.868 50 20 JCGD CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1 913445788 MBTKVTCPDPTMAU-UHFFFAOYSA-N 456.571 0.972 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1 913471310 XVWPYGWKAFXCSS-UHFFFAOYSA-N 462.553 0.879 50 20 JCGD O=C(Cc1cc2ccccc2nc1O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915635335 IRVKARUOEPMQOB-UHFFFAOYSA-N 470.507 0.965 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=S)NCCCN(C)C)N(S(C)(=O)=O)CC2 916547218 LGMHYDJIKROYSO-INIZCTEOSA-N 487.648 0.400 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(CCOC)C3=O)c2ccccc2c1=O 916741303 VCKLEVYOZSMNGU-UHFFFAOYSA-N 499.505 0.282 50 20 JCGD COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1csc(N2CCOCC2)n1 917409735 LOUPBZINZQRAIB-UHFFFAOYSA-N 456.502 0.239 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C1=NO[C@H](c2ccccc2)C1 917496043 JDWGLEKWPZWYBA-IBGZPJMESA-N 458.496 0.986 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1 919474538 QPMXUUVVEBATMJ-OAHLLOKOSA-N 471.532 0.602 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CC3(F)F)C2)C1)NC(=O)NCc1ccccc1 1778151257 QTYZRMCRVCTVFY-UTKZUKDTSA-N 465.501 0.818 50 20 JCGD Cn1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c2cccnc21 1778770667 QQQICDCUDSBTLE-HSZRJFAPSA-N 463.498 0.329 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Br)cn3)C2)C1 1779426688 KITIQCDHJZRHOI-FQEVSTJZSA-N 489.330 0.600 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780098129 CSGBIIXRDMEIRQ-YEJXKQKISA-N 462.459 0.488 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1781342327 KYFKZCDLGLVEKJ-KZULUSFZSA-N 454.351 0.896 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)=NO2)C1 1783452041 IVWGXKYJUISPRX-FOIQADDNSA-N 486.953 0.182 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)CCO2 1783538426 VHPVCTFLDBTVAB-KZDUYQQSSA-N 490.395 0.828 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784096539 ZZUUQOJRKZHLFZ-QXKUPLGCSA-N 473.954 0.492 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1785596436 TYEIHVQBJXIJHD-AYCKEJKLSA-N 499.373 0.279 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ncc[nH]3)C[C@@H]21 1787508121 HGKPDWVTWDDOCF-HRZAHRDASA-N 455.519 0.456 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]4C3)c2n1 1791290658 HVMLWXSBLLZDBZ-ZVZYQTTQSA-N 472.546 0.538 50 20 JCGD CN1CCN(c2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)cc2)CC1 1792457501 MFPIPYFVPLFFAP-PIKOESSRSA-N 450.967 0.241 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc2ncccc12 1793328712 YCTTXGRWOUSXLT-MRSFGVLCSA-N 453.543 0.740 50 20 JCGD Cc1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)cn1 1794555930 UXHYNCFXHMQPQM-VTYHHJSWSA-N 481.557 0.334 50 20 JCGD COc1ccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1 1795734179 HWSPASZPIGGVHP-FEJSZKPUSA-N 490.325 0.282 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3cccc(Cl)c31)C2)c1cccc(B(O)O)c1 1795740586 ITOSAMWSLIVECD-YZIUBNRHSA-N 468.746 0.953 50 20 JCGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1)n1cccc1 1799098852 JLFDLUWTQUFAQF-DXKRWKNPSA-N 482.585 0.985 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)C(C)(C)O 1799350331 ORWUTTBCAAPQSN-XVIXHAIJSA-N 496.374 0.931 50 20 JCGD CC(C)COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)ccn1 1801011493 QDNIFODYOSLCRX-OPMZPASUSA-N 461.563 0.693 50 20 JCGD O=C(CCc1cncc(C(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1801235346 SUDDUCORHCQWNX-UPHUGPLXSA-N 491.275 0.616 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1804254638 LRPMYGUMEHXHCR-ACDBMABISA-N 471.363 0.875 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)CCC(N)=O)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807452506 IIFOWIWPLZBPDJ-GBXCKJPGSA-N 495.584 0.699 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1808722862 WFJKWKNUFQXXMT-FXAWDEMLSA-N 456.551 0.947 50 20 JCGD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n(C)n1 1810299949 VSMGHNGSEAJGPQ-UZLBHIALSA-N 462.514 0.755 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1810479851 GUSLXWLLDOBQFX-HGHGUNKESA-N 456.551 0.388 50 20 JCGD COCCOCCOCCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1812933865 SNZFGKRXHAIKEO-HYBUGGRVSA-N 493.605 0.530 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@@H]2[C@H]3COC[C@H]32)[C@H]1c1cccnc1 1813658009 GKHJELMVNJIUGW-IGGMLHCZSA-N 450.499 0.292 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815341454 YXHGFZRFQCYGRY-IRXDYDNUSA-N 465.344 0.014 50 20 JCGD Cn1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c2c1CCC2 1817471837 QVLWRROPVUVBNL-LJQANCHMSA-N 462.319 0.931 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cn2ncccc2n1 1818711269 CSYQMVDNDFTQRI-SFHVURJKSA-N 459.275 0.752 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)N1CCN(C)CC1 1819403941 OHCDYPQWTGSUKA-KXBFYZLASA-N 483.577 0.350 50 20 JCGD CCNC(=S)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1821645762 QANKLDPLEASBJN-CQSZACIVSA-N 452.585 0.259 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(C)C(=O)C(=O)O)n[nH]1 1821712666 DSJIISIUILMYJU-CMPLNLGQSA-N 458.313 0.976 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1825127822 WKHHUNOZCBJHCM-FQEVSTJZSA-N 469.307 0.405 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCNC3=O)CC2 1825999728 UZSCBDJHEWGVIZ-VHSXEESVSA-N 452.924 0.563 50 20 JCGD O=C(c1cn2ncccc2n1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059106 FBLZZCHDAHHNCT-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD O=C(Cc1ccc(O)cn1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059739 IBSBXKVXBCODIT-JOCHJYFZSA-N 451.332 0.943 50 20 JCGD O=C([C@H](O)CCl)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828548265 HIESADYMRHBRJH-CBGDNZLLSA-N 488.368 0.638 50 20 JCGD O=C([C@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1 1828970498 IMNSAYOOTWHTOJ-HLLBOEOZSA-N 450.349 0.947 50 20 JCGD C[C@@H](O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1829329779 UOKWNJIAXHOMKS-KOSHJBKYSA-N 489.573 0.192 50 20 JCGD Cc1nn(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c1F 1830535378 NDHOKTOFTYJMLV-SGTLLEGYSA-N 461.332 0.969 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1830539581 ILQPJGFZVNVOFI-VLIAUNLRSA-N 498.378 0.118 50 20 JCGD CN1Cc2ccccc2C[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830725583 KCSXTGUWIOIOKN-XQBPLPMBSA-N 451.951 0.099 50 20 JCGD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726867 UWWOCEQRESWWKH-FXAWDEMLSA-N 455.895 0.584 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)CC1 1831900700 UDLLLXNMEPRAPJ-OAHLLOKOSA-N 463.501 0.658 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](NC(C)C)C(C)C)CCO2 1835898405 SQRWXTYYLQUNQJ-OEKZIPHDSA-N 490.605 0.599 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccc3F)C2)C1 1835925914 AMAPKOVEXCWCSX-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD COc1ccc2cc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)[nH]c2c1 1835930684 UITCDOFRCOJGJX-RUZDIDTESA-N 493.325 0.240 50 20 JCGD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931821 DDPLWRZSCDHJEC-SSYAZSBWSA-N 456.348 0.263 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c(O)c1 1836247024 NRWFZZPSKVHDRN-UHFFFAOYSA-N 475.590 0.959 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(F)c1 1837460206 XMMHEKBZJCUPLD-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1 1837491332 NDBGYKCDJVBWDK-WINMZROPSA-N 499.568 0.275 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CCN3CCOCC3)CC2)CC1 1837815918 OKJZFJPKTFQLNP-UHFFFAOYSA-N 488.589 0.020 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccncc1Cl)CCO2 1837888524 YAHCBHHAINBKAA-WGLQLPMYSA-N 488.932 0.939 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)CC2)CC1 1838267137 IFOJLFPWVCURFL-IBGZPJMESA-N 494.054 0.910 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cn2[nH]cnc(=O)c12 1838471531 VHOCWRLWIWIXHV-NRFANRHFSA-N 477.594 0.253 50 20 JCGD O=C(Cn1ccncc1=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1838648801 JNYLVAJVPVGOCO-QGZVFWFLSA-N 459.316 0.932 50 20 JCGD CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)on1 1838776563 VRXXXZKMNVFAQR-JOCHJYFZSA-N 472.502 0.180 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nc2nccn12 1839202784 PHSBUWPYDUFRPZ-KDOFPFPSSA-N 470.299 0.798 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3onc4ccccc34)C2)C1 1840184816 CKSOEQVNKGFOGZ-QFIPXVFZSA-N 459.503 0.271 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)c3ccco3)C2)C1 1840185022 JITIXVVRJIEOQI-LJQANCHMSA-N 458.462 0.201 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2 1840260471 OTDSLCSBBFVJAV-YKSBVNFPSA-N 458.559 0.546 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(F)c1F 1840701020 UKHZEZZXORYYSA-QHCPKHFHSA-N 474.269 0.337 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(C(=O)N(C)C)c3)CCO2)C1 1840789291 AQIBKJKKENJRFQ-XMSQKQJNSA-N 467.950 0.712 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3ccc(C)cc3)CCO2)C1 1840905514 KPLMFEFEKHBNPT-PGRDOPGGSA-N 467.950 0.435 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1841081792 PNGAQOUGDNUYLB-BVZFJXPGSA-N 499.373 0.067 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012243 SEXGGUGOAHJZIM-UHFFFAOYSA-N 452.276 0.471 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)ccc12 1843013523 UNYVFXDOKNNJMM-UHFFFAOYSA-N 476.298 0.322 50 20 JCGD CN(C(=O)OC(C)(C)C)c1cc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)n(C)n1 1843463381 UPMOFQGWPQFQOW-UHFFFAOYSA-N 497.361 0.602 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@@]21C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265379 WYMHULBPPHHZJI-OWJWWREXSA-N 484.557 0.902 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265615 WJNKGDRSZWFHHG-YOEHRIQHSA-N 490.536 0.850 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)COCCOCCOCc2ccccc2)C1 1846258031 DBERYFPNXXOCQG-UHFFFAOYSA-N 496.369 0.433 50 20 JCGD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 12800178 QHSVYLIMIVZTJY-ZDUSSCGKSA-N 483.572 0.425 50 20 JCGD COc1ccc(NC(=S)NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)cc1F 727498795 KODPUKZLXHIEAM-UHFFFAOYSA-N 469.476 0.407 50 20 JCGD CN(C)C(=O)Cn1cc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)nn1 729298334 BUFXXRNBYLBOSE-UHFFFAOYSA-N 474.481 0.199 50 20 JCGD C[C@@H](COCC(F)(F)F)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 743340748 AQGGGHWKWKKLMU-AWEZNQCLSA-N 496.508 0.938 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1 751212115 PALKSJCHBWAJQR-UHFFFAOYSA-N 454.892 0.909 50 20 JCGD COc1cc(Br)c(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)cc1OC 751282638 PQFRIWPAXOGWFL-UHFFFAOYSA-N 462.278 0.799 50 20 JCGD C=CCNC(=S)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C\c1ccccc1 825123409 QQYSIAZCEVBGOQ-UZGISAJGSA-N 460.603 0.061 50 20 JCGD O=C(COC(=O)CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1 834572349 UZKVXVQFVLDIAH-NJBZPOFQSA-N 489.506 0.497 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 912852200 PSIIZTYGQJBITM-KCQAQPDRSA-N 481.600 0.648 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 912852201 PSIIZTYGQJBITM-UMVBOHGHSA-N 481.600 0.648 50 20 JCGD O=C(NCCOc1cccc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916634232 ABCSRKCNQKZURP-UHFFFAOYSA-N 466.491 0.870 50 20 JCGD O=C(NCc1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1csc(N2CCOCC2)n1 916648160 YRKJCHXMJWQZAT-UHFFFAOYSA-N 494.599 0.908 50 20 JCGD Cc1ccc(C(=O)NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c(O)c1 918337135 CZSBGIPNCPMYKE-UHFFFAOYSA-N 474.539 0.775 50 20 JCGD Cn1c(=O)c2c(ncn2CCC(=O)NNC(=O)c2ccc(F)cc2Br)n(C)c1=O 918340428 PUODKMMHNODZFQ-UHFFFAOYSA-N 467.255 0.187 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cccc(OC)c1O 919755674 RFEHCZZDSXQJKS-UHFFFAOYSA-N 465.484 0.505 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCN2C(=O)c3ccccc3C2=O)cc1 919788329 JGSPJKJZKADBHK-UHFFFAOYSA-N 473.511 0.242 50 20 JCGD COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)cc1 919884539 HWGXFSAVMVSHSM-OAHLLOKOSA-N 496.567 0.651 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1 1779028092 DDBBVIILRUZFEG-NRFANRHFSA-N 458.906 0.420 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(F)cncc1F)C2 1779372678 VSRXHQZCGLOEIV-VGOFRKELSA-N 474.468 0.800 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780059745 HAJALRPCXNFTKZ-MOPGFXCFSA-N 454.314 0.769 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)csc2n(C)c1=O 1780924858 WDXGAVONMRFXKP-IFXJQAMLSA-N 472.926 0.206 50 20 JCGD CO/C=C(\C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968309 IMXKXQGEXMTWCK-KEWFZMHCSA-N 459.547 0.713 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)C1 1781115305 PXEUMSWAFCSAPG-QJNYJZHLSA-N 494.358 0.735 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782789323 QXBOPPAPGQWOOB-SJKOYZFVSA-N 457.281 0.370 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CSCN3C(=O)[C@@H]3CCC(=O)N3)C2)C1 1782873295 MLLOJSFCSZPWMR-CJXDPKRBSA-N 472.995 0.014 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1783580002 IFVAILBJUKYYGR-PLNSCZHZSA-N 487.981 0.175 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)CCOC1 1784091989 BRQDYOYZNDFNAS-DQKQSUEQSA-N 475.970 0.250 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)CCO3)C2)C1 1785726376 ZYQMZDCSQUQZNQ-MRUHUIDDSA-N 475.970 0.706 50 20 JCGD Cc1ccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1 1786979453 KSNJDPFWEHQDJU-NYVOZVTQSA-N 452.316 0.347 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3F)C[C@@H]21)c1cccc(B(O)O)c1 1786985262 WTGWPPYPJGRCHO-LRQRDZAKSA-N 458.270 0.481 50 20 JCGD O=C(NC1(c2ccc(NC(=O)c3nc4ncccn4n3)cc2)CCC1)c1ccc(B(O)O)cc1 1788996608 OLBFDTXBHDXAGO-UHFFFAOYSA-N 456.271 0.866 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1n[nH]c2c(Cl)cccc12 1790339734 NDAKVHBXIGBPPE-FNHZYXHNSA-N 482.733 0.803 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791195176 FAKGXDOILGJWNT-QRFRQXIXSA-N 499.354 0.660 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4sccn34)C[C@@H]21 1791255579 VNCVFEUXVBQHEY-XPCVCDNBSA-N 454.936 0.603 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCCNC(=O)C2)n1 1794842257 DETKWQRPNWHRPV-YVSFHVDLSA-N 463.966 0.914 50 20 JCGD O=C(CC[C@H]1CNc2ccccc2C1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1795648130 GTAGWKDRDPIIHJ-CCIIEHSASA-N 477.370 0.634 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795741300 SSJOVCIPUZOEHA-HCBXPFHNSA-N 454.307 0.588 50 20 JCGD O=C1CCc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)nc2N1 1796105783 SVJYBLRGAQXJEX-BAESOJJISA-N 455.284 0.860 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(F)(F)F)n1C 1796712647 SCGFVPZOUSLKPK-IVWMJMPLSA-N 459.469 0.620 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2sccn12 1798412490 ZGSRWZZRYJCZSX-OHTBPHCPSA-N 469.361 0.990 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1798736430 SYJMDJHQYTUKDZ-UPHUGPLXSA-N 454.336 0.223 50 20 JCGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1)N1C[C@H]2C[C@H]2C1 1799097242 KZXNBVWLHMUWCE-SVKQTEAVSA-N 498.628 0.262 50 20 JCGD C[C@@H]1C[C@@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097535 OGXQRMZWWUTIJB-AOBCARNWSA-N 457.575 0.968 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C3)C2 1800325363 RCTOJKBBMGNANM-HGKPHOSTSA-N 456.902 0.746 50 20 JCGD O=C(CCc1c[nH]c2ccc(F)cc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800841921 PRJDOGBZVFBZKD-MRSFGVLCSA-N 479.317 0.823 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2 1800974987 DFQGJZFPMRYVSF-NPJQDHAYSA-N 462.975 0.072 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)C1 1801018214 SDCJWABOENRTME-RJAOAUJVSA-N 466.362 0.752 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C 1802152353 YFUMNKWZGTTYAG-AIUMHDJVSA-N 491.383 0.128 50 20 JCGD COC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1806377131 KGWWAPMPAJKENH-FOIQADDNSA-N 454.487 0.353 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(c2)CNC3=O)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361811 UFPZCNRQEOBVBL-WMZHIEFXSA-N 484.321 0.638 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807372390 DWSWHNFTWGOVKN-SIKLNZKXSA-N 465.315 0.590 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808205393 XHPOSIIUQPZMNU-QMMLZNLJSA-N 479.371 0.108 50 20 JCGD O=C(NCC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)c1ccco1 1809966551 CORYAPYCABMFHM-UHFFFAOYSA-N 453.304 0.234 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810248812 OBCBBVUYVZVJFL-GIVPXCGWSA-N 451.332 0.654 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(=O)oc2)[C@@H]1c1cccnc1 1810297111 AMHCXOCWCUUZJI-MGPUTAFESA-N 462.466 0.667 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810526529 BSFJTWPACVPVRF-AKCHCHLHSA-N 465.514 0.090 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)n[nH]1 1814799727 VLFMUFLWBOIPQZ-CVEARBPZSA-N 495.581 0.660 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC(c3ccccc3)=NN1)CC2)c1cccc(B(O)O)c1 1815360220 QEPWOTHBKJPYQN-XLIONFOSSA-N 489.366 0.815 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1 1816949732 FIURQEZPNVQTAA-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1 1818111715 CKEOKSSMTZFZFA-BFTFCADCSA-N 470.534 0.868 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCN(C)CC2)[nH]n1 1818112883 SFIPQPIFBUCRQI-DZTFFZQKSA-N 483.577 0.783 50 20 JCGD Cc1nccn1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403678 AIFFCAOMJZMIIO-KRWDZBQOSA-N 451.491 0.919 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4cccnn4n3)sc2C1 1821164854 WFRXGOWPLGRGJA-LLVKDONJSA-N 477.510 0.724 50 20 JCGD O=C(NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccco1 1827053055 UOCGDEGRSBJEGL-FQEVSTJZSA-N 467.331 0.623 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccnc2C(N)=O)CC1 1828923363 GIQRQNZHAGCRCX-IBGZPJMESA-N 479.541 0.726 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)C2=NNC(=O)C2)CC1)NC(=O)NCc1ccccc1 1830165301 BHNITGYOQQZNKV-NRFANRHFSA-N 497.600 0.828 50 20 JCGD Cc1ccc(OCCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1830204629 YJYGJDXTWBBYCA-VWLOTQADSA-N 482.342 0.214 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)NCc1ccccc1 1830674928 FUATUUMXYSIMIQ-VKEZQZQQSA-N 453.898 0.850 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C(C)(C)C 1830728388 SRFBEJHPUGXSQL-WJONJSRFSA-N 492.013 0.982 50 20 JCGD CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737377 DWJZHWCPPDXBGY-ACTFIFLWSA-N 492.013 0.982 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccoc3C1)CCO2 1830940737 VIWQOBRBXPZSLI-MBSDFSHPSA-N 462.547 0.214 50 20 JCGD O=C(Cc1ccc2ncccc2c1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832030949 GJJYJCYAERQPIZ-AREMUKBSSA-N 489.337 0.227 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1 1833399890 IWIJWAYYAHFRBP-PBHICJAKSA-N 494.339 0.246 50 20 JCGD O=C(c1ccc(N2CCOCC2)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1833615519 ZIFYCOCJLZVPKU-XLIONFOSSA-N 456.902 0.523 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1 1834824784 MMNDIYJILZKLCI-GHTZIAJQSA-N 479.375 0.994 50 20 JCGD Cc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835154301 YAJSIVMVULZIFH-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1 1835582054 INWIARNHOBOWCN-QHCPKHFHSA-N 486.504 0.006 50 20 JCGD CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)no1 1835737974 PFWLRCABJULTKM-UHFFFAOYSA-N 469.546 0.735 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccncc3C(F)(F)F)C2)C1 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CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)CCO2 1840219568 SGSVIAPDSLXSMB-WQTXXOFMSA-N 489.997 0.832 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2 1840544290 ZYEHOFJVSWFSIN-UWFXLKAESA-N 450.580 0.786 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1 1842743952 FKRACARLLXEZMN-UHFFFAOYSA-N 456.329 0.047 50 20 JCGD C=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)N(C(=O)OC(C)(C)C)C1 1843012513 VNUBAIRMDKDFGP-IBGZPJMESA-N 469.347 0.749 50 20 JCGD O=C(c1cn2ccc(Br)cc2n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013921 DDMWCQDAZBAVEL-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1nc(-c2ccncc2)no1 110338596 CTKABZAKEXLHAY-UHFFFAOYSA-N 460.472 0.918 50 20 JCGD CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 726527452 DKWYQSPGOGNISG-CQSZACIVSA-N 466.541 0.643 50 20 JCGD COc1ccc(C(=O)N[C@@H](C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2ccccc2)cc1 727105207 VIYCKPAICPYTCC-FUHWJXTLSA-N 460.512 0.684 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(N4CCOCC4)nc3)cc2)CC1 728214935 VCURVGADPDCKKM-UHFFFAOYSA-N 460.560 0.611 50 20 JCGD Cn1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(-c2ccncc2)n1 745839458 WSRSYNKAFHBCDY-UHFFFAOYSA-N 498.565 0.897 50 20 JCGD CCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)c2ccccc2c1=O 749838415 OMIFKPRJNNZEAB-UHFFFAOYSA-N 469.932 0.871 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2c(C)noc2C)c1 767155572 ZIDOOZHMCRHERI-UHFFFAOYSA-N 487.560 0.061 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1cc(Cl)ccc1O 802599904 CTBFMQJAZCWKKS-HNNXBMFYSA-N 489.959 0.588 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1CC(c2ccccc2)=NO1 915133965 ZWYMSWHKHCBDAT-OAQYLSRUSA-N 486.550 0.981 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CCOC[C@@H]1CCCO1)N(S(C)(=O)=O)CC2 915639450 HYWSGWZGDFDZDG-WMZOPIPTSA-N 499.586 0.686 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C2)C1 1778174852 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1810832726 YYTJTGZVOPQONU-YWZLYKJASA-N 464.482 0.799 50 20 JCGD Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c(O)n1 1811481872 RRDOHMXROQKRSH-WIYYLYMNSA-N 460.299 0.804 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1811498546 CFYCFTXSYMISPX-QSJFSLAZSA-N 456.927 0.530 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813415502 FFRKWTXMGGLSCA-YKSBVNFPSA-N 475.358 0.674 50 20 JCGD Cc1c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn2[nH]cnc(=O)c12 1815343831 QYSWVIPTOPHBGA-CQSZACIVSA-N 492.326 0.007 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccnc(Cl)n1)CC2)c1ccc(B(O)O)cc1 1815344418 YSVZZNMYNDRCPC-GFCCVEGCSA-N 457.708 0.806 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)c3nc[nH]n3)sc2C1)NC(=O)NCc1ccccc1 1816032579 SDPNOCMDCZYMFC-AWEZNQCLSA-N 483.558 0.833 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1820110408 BRNJOECJFGDATR-RYUDHWBXSA-N 473.559 0.672 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2)N1CCN(C)CC1 1822692977 SEGABMZBQINMQL-ZIAGYGMSSA-N 486.602 0.003 50 20 JCGD O=C(Cc1ccccc1O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825299579 IZPXQJIOGZOREM-INIZCTEOSA-N 451.313 0.997 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNCP(=O)(O)O)CC2 1825446658 HMJKHEGGAAUBAW-BDAKNGLRSA-N 469.298 0.953 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@](C)(O)CC(=O)O)CC2 1826090154 XGINHZBBPSRZTJ-WLRWDXFRSA-N 455.537 0.044 50 20 JCGD COCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828549033 UKDKQSGLDGYQME-LAUBAEHRSA-N 453.923 0.685 50 20 JCGD CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1828889233 XWSFKFCWOGCZQD-DEOSSOPVSA-N 465.315 0.452 50 20 JCGD CC(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1830010660 NDZSXDRBMCLNFH-KKSFZXQISA-N 477.986 1.000 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cn1 1830538440 FVBVFJCYBORIII-VBKZILBWSA-N 484.347 0.969 50 20 JCGD O=C(c1ncccc1Br)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731295 ISISUVUNCBNGJJ-CXAGYDPISA-N 462.728 0.514 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3CCOC[C@@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)(C1)C2 1830735563 IFQFYXKVTFCXRR-ZSVWIGLLSA-N 487.981 0.490 50 20 JCGD COc1cccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834048735 UJIWHTAPBOYODM-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD CN(C)c1ncc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)o1 1834096968 GOUUYNMLLGLILE-UHFFFAOYSA-N 484.561 0.238 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)c(F)c3)CCO2)C1 1835140018 NENYCLWRDYWQPD-QHCPKHFHSA-N 489.479 0.276 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)c3ccco3)CC2)CC1 1835734324 ALIVNWAHYWLYJI-FQEVSTJZSA-N 470.530 0.197 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)COc3ccc(O)nn3)CC2)CC1 1835837620 OEMWASGRHGJMDB-UHFFFAOYSA-N 465.627 0.984 50 20 JCGD Cc1ccccc1NCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1835865037 ARLXNSWJNKZSBM-XMMPIXPASA-N 482.541 0.176 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1835930262 FVWKLNDSDVJXFM-QHCPKHFHSA-N 498.732 0.051 50 20 JCGD CC(C)Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n(C)n1 1836336792 RTTCIOREBGINIF-DEOSSOPVSA-N 499.572 0.001 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1 1836669719 GFYQUTZYHVQTHA-ZDUSSCGKSA-N 473.368 0.568 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cnn3cccnc13)CCO2 1836844817 MHBJZJNRGCGPLE-SFHVURJKSA-N 452.309 0.584 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc12 1836914821 MGRJWTKMBDWTFL-RUZDIDTESA-N 477.326 0.540 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1837078502 BVRGJUQKXNORFC-HNNXBMFYSA-N 494.452 0.499 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)CCO2 1837292700 JVAAKJHHOCVFDV-VQTJNVASSA-N 482.331 0.963 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1837716054 YSGXSPGTTCRROM-HXUWFJFHSA-N 465.558 0.790 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 1837920318 ZHRYQSXVYHFYDH-UHFFFAOYSA-N 497.313 0.906 50 20 JCGD CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)no1 1838124662 BKGLBCJXARAPEV-NMWDDECMSA-N 472.502 0.441 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)CC1 1838300659 XGLHXJTXNBSYMG-LJQANCHMSA-N 491.402 0.840 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C(=O)Nc3cccnc3)CC2)CC1 1838394178 ZVFZJCVUSKOIPJ-UHFFFAOYSA-N 495.540 0.331 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@]3(C)CCCN3)C2)C1 1838528064 CTPPYCNAHUDYFQ-DHIUTWEWSA-N 490.513 0.732 50 20 JCGD O=C(c1cnnc(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198128 UZZUUQFZWFVEJX-DOMZBBRYSA-N 451.680 0.891 50 20 JCGD O=C(c1nc(O)n2c1CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200637 NAPGBBOEVMGGNJ-RDTXWAMCSA-N 475.315 0.686 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839388683 ZLPBRVULGGTSQM-SJKOYZFVSA-N 456.323 0.090 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H](O)CN3)C2)C1 1839743926 FHJWVUWLKUHLHU-KIMVMUHBSA-N 476.480 0.051 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1840034509 NXPLMVLAZURCLP-KUHUBIRLSA-N 466.336 0.512 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1 1840035702 AWWVVMWLWXXUPS-IERDGZPVSA-N 482.375 0.965 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])C2)C1 1840154120 LWOAMWPAONKOJK-UWJYYQICSA-N 484.937 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3cccc3)CCO2)C1 1840461295 LOQRCGXHAWSTTD-HSZRJFAPSA-N 470.530 0.037 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1 1840645836 PZEKNKKLAZSKJR-VLIAUNLRSA-N 468.348 0.887 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CN(C(=O)OC(C)(C)C)C3)CCO2)C1 1840869004 ZFBKBHHDUSXRFH-JTSKRJEESA-N 489.997 0.954 50 20 JCGD C[S@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841348433 RIQMLSBIKLNLLB-HBOFSXGPSA-N 466.000 0.451 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1 1841350142 JRKNTLLZIAUKKR-JKSUJKDBSA-N 467.954 0.978 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841354299 ROKKRNCZWQXLET-OAHLLOKOSA-N 464.371 0.812 50 20 JCGD Cn1ncc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1C(F)(F)F 1844263726 NQFIXWPOCKTRLP-UHFFFAOYSA-N 451.409 0.568 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c1F 1844698229 GIJFDZQXNVSGBI-UHFFFAOYSA-N 454.263 0.813 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@@H](N)c1ccccn1)C2)NC(=O)NCc1ccccc1 1845038839 ZZXSUGNQBLOCCN-NRFANRHFSA-N 465.558 0.631 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCO)NC(=O)OC(C)(C)C 1847641662 YXDTXPUSDFLEBN-WUVWTDDWSA-N 490.561 0.598 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 15524828 LMPNOWYOYSWLRD-UHFFFAOYSA-N 481.552 0.327 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)COc3cc(C)cc(C)c3)c2)CC1 15878814 LAUATWLRGNJITE-UHFFFAOYSA-N 488.566 0.996 50 20 JCGD C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1=O 22873382 OSGZVRHLDHGCPH-HXUWFJFHSA-N 476.490 0.347 50 20 JCGD O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 23697152 TWKHKILYLYJYRB-JTQLQIEISA-N 457.306 0.131 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)COc1ccc(F)cc1 25257332 PHHKQOISOLLFAG-UHFFFAOYSA-N 467.475 0.882 50 20 JCGD NC(=O)NCCC(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1 726070423 KLEXLYFKDUFQAB-UHFFFAOYSA-N 467.935 0.737 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1 729277012 RCNLPKHCXULHIS-GXFFZTMASA-N 461.338 0.139 50 20 JCGD C[C@@H](C(=O)NNC(=O)CNC(=O)c1ccco1)N1C(=O)c2ccc(Br)cc2C1=O 751205153 XQNCTEYKKJDMDT-VIFPVBQESA-N 463.244 0.604 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)cc1 849366006 ITPBHCJBYOWDPS-UHFFFAOYSA-N 491.570 0.655 50 20 JCGD Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 916277948 BJXNXPIWGACLPC-UHFFFAOYSA-N 497.599 0.233 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1 916513655 JHKGKFGRAFYSKS-UHFFFAOYSA-N 463.535 0.995 50 20 JCGD O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1)N[C@@H]1CCS(=O)(=O)C1 919883139 AZABFNPMNIOQOJ-CYBMUJFWSA-N 470.504 0.758 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2F)c1 921295194 HZKKKPRVNIFOEK-UHFFFAOYSA-N 479.533 0.103 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091213 LUTCRUVKSROQRO-TUWUPGADSA-N 485.545 0.690 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)CCN3CCOC3=O)C2)C1 1778154849 OERCUJLZISPGHH-BTYIYWSLSA-N 488.969 0.791 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1778165952 HRETZMZNWIAHJA-JLTOFOAXSA-N 465.348 0.953 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1778716139 PQQMLALAHIHZMV-NRFANRHFSA-N 454.317 0.141 50 20 JCGD O=C1COc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)cc2N1 1779048696 BUYYLETYDJEGFP-PXDATVDWSA-N 493.325 0.139 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1Cc3ccccc3N1)C2 1779374669 XRVISGUPRHYTAC-BPYKYCOYSA-N 478.553 0.849 50 20 JCGD CCCOc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1780836464 KYBZODAJIGEMKH-DEOSSOPVSA-N 452.316 0.913 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C2)C1 1780923486 LEPZJJMKWCPNKE-QHCPKHFHSA-N 470.281 0.820 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968129 AWPPVXBSBPNYAB-RUZDIDTESA-N 497.600 0.827 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334596 PZHZBCDIRWCVQL-UMCXVIDHSA-N 494.358 0.877 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1781338167 WBROIQOFFPBRJX-IFXJQAMLSA-N 478.384 0.877 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2)C1 1781340968 AEARHPHUBGIQEQ-IQUTYRLHSA-N 478.384 0.875 50 20 JCGD CN1CCCn2nc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)cc2C1 1781428569 CXVFJCQWFNKDKX-WAOWUJCRSA-N 453.971 0.446 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(N4CCOCC4)c3)C2)C1 1781737357 OCVBIBASRYVALH-XMMPIXPASA-N 473.574 0.340 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(C(=O)N(C)C)c1)C2 1782214920 ZZGXQQYTUQITIW-CJFMBICVSA-N 487.601 0.889 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2)C1 1783534673 NDGHWLRADHGASX-VBHSOAQHSA-N 464.357 0.485 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)C(C)(C)C)[C@H]2C1)NC(=O)NCc1ccccc1 1784023628 ABWNMMUWNZPOCJ-XWUOBKMESA-N 489.617 0.719 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3C(=O)c4ccccc4C3=O)C[C@@H]21)[C@H](O)CCl 1784085005 AOZSUVNZFZMBQT-RUGDWHBFSA-N 463.918 0.252 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1784243373 DCFQOEJMZHUUJI-RUZDIDTESA-N 465.359 0.509 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc([N+](=O)[O-])ccc3F)[C@H]2C1 1785006042 LFWGOFWGQSQGRM-FNHZYXHNSA-N 479.509 0.629 50 20 JCGD CCn1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)n1 1786170884 GCWJPRNWSYDNSM-ONTIZHBOSA-N 497.600 0.843 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc4ccccc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786979600 BSNQDUVVNVNDRO-BUKVSMQUSA-N 460.299 0.217 50 20 JCGD CCc1nn(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1Cl 1786980132 MIXLDNDOGDDKFQ-ZVZYQTTQSA-N 474.754 0.223 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Br)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786983861 BVUNAERZMNNCPE-SZMVWBNQSA-N 488.147 0.431 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)ccc12 1787149459 BQIMJJFQIGJUAQ-ONIAQPFYSA-N 478.933 0.704 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1 1787443586 MPXMAZUIBJQFLX-YYFQZIEXSA-N 451.923 0.776 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787507567 FCKFHEMQGGKWHX-BCDTYFSXSA-N 458.519 0.140 50 20 JCGD COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(F)c1 1788202097 JJSPIGJISXISMM-HARLFGEKSA-N 484.333 0.740 50 20 JCGD Cc1nc2ccncc2cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1788290012 SLWLTCLADQNLHC-LRQRDZAKSA-N 468.558 0.905 50 20 JCGD Cc1ccn2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)cnc2c1 1790485499 RYBRAESFKALHQD-CUWPLCDZSA-N 462.315 0.230 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3C(=O)C=CC3=O)C[C@@H]21 1790958120 IYHMGSRUTDUJCW-XQLPTFJDSA-N 456.337 0.455 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCNC4=O)C[C@@H]21 1791055992 LHAPOHRCMVKPDN-DVZHBHJUSA-N 468.352 0.393 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3C(=O)Cc4ccccc4C3=O)C[C@@H]21 1791249827 QPBGDKFWKWZRKQ-FFGOWVMKSA-N 491.972 0.835 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1792202110 SJZLJKASZHWLGS-QAETUUGQSA-N 459.971 0.823 50 20 JCGD CCCC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1C 1795735317 ZAJLWXOHPUTTJQ-IRJINJETSA-N 493.369 0.930 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccc2nc[nH]c12 1796237912 QXUIQBPCKWDNEH-DPFJGUDESA-N 464.486 0.295 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1Cl)C2 1797754306 QWHYQCKYOUWAEM-JSVGYJQLSA-N 473.917 0.275 50 20 JCGD COc1ccc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797754486 YXLOTWSKWHHDLH-DBWKPXFBSA-N 473.917 0.864 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799865668 HBMBROGPFXGFJY-RSPOEFSDSA-N 493.630 0.652 50 20 JCGD Cn1c(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cccc1=O 1805308170 GEAFPRAYPRNWPP-GCJKJVERSA-N 460.299 0.094 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCN2CCOCC2)[C@@H]1c1cccnc1 1806957712 YVTWGUIZXOEVTP-CVDCTZTESA-N 460.579 0.183 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374761 JAGLJKGYYKTYKU-AUSIDOKSSA-N 473.342 0.928 50 20 JCGD COc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1807376786 XXBVMADGDKMQNF-XMSQKQJNSA-N 460.299 0.798 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807376864 WXYHSXMSGJSFHQ-ACIOBRDBSA-N 473.342 0.046 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)Cn2cncn2)[C@@H]1c1cccnc1 1807595034 DMEQQTFSVQBZAD-FIAMHUAMSA-N 463.502 0.513 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1)[C@@H](F)Br 1808682092 YTOMEDVWFCKSPV-JCURWCKSSA-N 453.268 0.703 50 20 JCGD O=C1Nc2c(C(=O)NC[C@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)cccc2C1=O 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O=C([C@H](O)CCl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C=CCN1)CCN2C(=O)OCc1ccccc1 1829039838 JRSNHLCENBQEBY-YYDVJCTNSA-N 476.961 0.566 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(N)=O)CCN2C(=O)OCc2ccccc2)C1 1829476895 ZRVSAUZUIDUXSM-VGOFRKELSA-N 495.964 0.361 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)C#N)CCO2)NC(=O)NCc1ccccc1 1830060812 UGBJMOPKWXXRKB-XMMPIXPASA-N 486.573 0.339 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830363523 ABTBZYJZTVZYPJ-VLIAUNLRSA-N 463.959 0.551 50 20 JCGD N#Cc1cccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1830460189 DBNXOPCAGRNVLL-VWLOTQADSA-N 492.536 0.260 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1830535086 IQMXDJQXQNIFTB-GUYCJALGSA-N 474.312 0.279 50 20 JCGD CC(C)(Cc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830551579 KIFQEPMKPPJCTP-AREMUKBSSA-N 480.370 0.705 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1831236453 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CC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2 1835642059 HGABCWWBDOOULJ-ZOCZFRKYSA-N 477.002 0.702 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@H]1ON=C(c2ccccc2)O1 1835673812 IZABCCJATQHCBJ-XMSQKQJNSA-N 464.950 0.892 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccccc4)no3)C2)C1 1835931666 WTAPMKDZBZAQBY-VWLOTQADSA-N 491.309 0.405 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCO1)CCO2 1836218570 MPENIPGFEKXJLQ-GCKMJXCFSA-N 475.970 0.754 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837319787 HTDMBMNPNQXRSL-HZMBPMFUSA-N 461.231 0.332 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921174 JAUJUJCVDSMXFW-NWJFTTBMSA-N 487.362 0.508 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1 1838395464 UOKYPNYDXPPAAJ-PMOLBWCYSA-N 457.531 0.190 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838501478 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O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1 1842744012 MAKVGVSNAMSNSK-UHFFFAOYSA-N 456.329 0.047 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1csc3c1c(=O)n(C)c(=O)n3C)C2 1846363599 RNQJTBLEQVUIPX-CYBMUJFWSA-N 468.963 0.298 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1846534438 OJHDKSWGBJYTOI-GJZGRUSLSA-N 455.943 0.649 50 20 JCGD CCn1c(=O)c2ccccc2n(CC(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)c1=O 16364929 MMZPJAKWMZESLB-UHFFFAOYSA-N 488.884 0.850 50 20 JCGD COCCn1nc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)ccc1=O 24586339 DTYAEYRICOILNA-UHFFFAOYSA-N 474.481 0.666 50 20 JCGD COc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCOCC2)cc1 726083774 LOOGTEDNQGWPIB-QGZVFWFLSA-N 461.544 0.890 50 20 JCGD O=C(CN1CCN(Cc2ccc3c(c2)OCCO3)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 727238899 HSFPXIIVQXBEOD-UHFFFAOYSA-N 455.471 0.945 50 20 JCGD CCCS(=O)(=O)Nc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 728345890 TZHCBOJRAPDZBV-GOSISDBHSA-N 477.495 0.983 50 20 JCGD NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1 729230565 NIJZLARMEIADSL-GOSISDBHSA-N 454.487 0.454 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)COc2ccccc2O)c1 730781118 FBBMOFFATGOUOR-UHFFFAOYSA-N 478.527 0.319 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)cc1 744877262 BOFXFXOPXATFFR-IBGZPJMESA-N 473.555 0.747 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(-n2cnnn2)cc1)c1ccc(S(=O)(=O)N2CCCC2)cc1 747406539 BLCLETBWYQNQES-UHFFFAOYSA-N 477.528 0.070 50 20 JCGD COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 751294794 RYRNIIYNHZBFLC-UHFFFAOYSA-N 489.554 0.837 50 20 JCGD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)NNC(=O)c1cc2c(s1)CC[C@H](C)C2 807137332 IGNNFCMQMULTTR-JSGCOSHPSA-N 456.590 0.853 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)cc1 913455141 MXIYQXPUJAYPKD-UHFFFAOYSA-N 467.301 0.825 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN(C)S(=O)(=O)c1ccccc1 915008155 OHIDMCXBNFRDCG-UHFFFAOYSA-N 469.903 0.974 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)NC[C@@H]1C[C@@H]1C)c(=O)n2Cc1ccccc1 916640670 OXEQXTNHLMMOAH-RDJZCZTQSA-N 483.529 0.041 50 20 JCGD N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 916649138 JJGLDASGEPLRSO-GOSISDBHSA-N 487.538 0.925 50 20 JCGD CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)c1ncnc2[nH]cnc12 917902077 KQBXQGUYQFFTBC-UHFFFAOYSA-N 472.531 0.425 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)Cn2cc(C(N)=O)c3ccccc32)cc1OC 919569277 WVXPEGZTIMGLMM-UHFFFAOYSA-N 454.439 0.762 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)NNC(=O)NC1CC1 920766537 QXKCSWISMHADBB-UHFFFAOYSA-N 457.940 0.446 50 20 JCGD CCCn1nc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@H](C(N)=O)C2)c2ccccc2c1=O 934081201 UGBXIBDGQSZBBZ-SFHVURJKSA-N 461.482 0.688 50 20 JCGD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)c1n[nH]c2c1CCCC2 1317768154 VKRMFSRSBCHDPC-UHFFFAOYSA-N 453.546 0.375 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1snnc1C1CC1 1778364739 WKFNOQCWTOVATA-VGOFRKELSA-N 470.360 0.537 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1 1778665512 SLTMSBDQXVKHOC-JOCHJYFZSA-N 468.706 0.653 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C[C@H](O)CN1)C2 1780055097 AETQKUJQKUHIOE-VSCJKUSUSA-N 490.513 0.370 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COCCO)C1 1780763623 HMOCXDPUGGRMQL-GCKMJXCFSA-N 477.986 0.641 50 20 JCGD O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780947332 CTIJWFJKKFAUHQ-QHCPKHFHSA-N 482.733 0.582 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C13CC(C1)C3)CCO2)NC(=O)NCc1ccccc1 1780969239 JGEHMNYBEDFZKU-TVNWEXPRSA-N 455.559 0.963 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cocn1)CCO2)NC(=O)NCc1ccccc1 1780969929 OCSSWOCOMPVQJN-QFIPXVFZSA-N 456.503 0.464 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1csnn1)CCO2)NC(=O)NCc1ccccc1 1780970516 ZMXNBFQNVNXIFF-OAQYLSRUSA-N 473.559 0.328 50 20 JCGD COc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc(OC)c1OC 1784846146 GKDNMSYENCCSAM-FPXQBCRKSA-N 470.950 0.834 50 20 JCGD CC(C)(C)n1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cn1 1785618916 YHTHITIQRCEMHU-VDGAXYAQSA-N 454.336 0.225 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3coc([Si](C)(C)C)c3)[C@H]2C1 1788592282 NFPPMHHIZXLYAD-SZMVWBNQSA-N 464.639 0.791 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)N1CSCSC1 1788680912 QHDHKKJJRLWUFU-XIVBQZFQSA-N 479.433 0.003 50 20 JCGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)cn2[nH]cnc(=O)c12 1789177159 NDLYCNBICQAHMI-JURCDPSOSA-N 466.336 0.708 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)cc4nn[nH]c34)[C@H]2C1 1789285852 WFKHVUXUPWHDOA-NUTKFTJISA-N 477.953 0.578 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCS3(=O)=O)[C@H]2C1 1790750067 GSLQJUPDZDYYAC-YTFOTSKYSA-N 451.383 0.717 50 20 JCGD Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(C)n1 1791495520 BOWOQQCPKOZEJE-NYVOZVTQSA-N 480.569 0.923 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3ccc([N+](=O)[O-])cc31)C2)[C@H](O)CCl 1792974815 DSIPEMFLWCAABF-QOIYZWAUSA-N 450.879 0.739 50 20 JCGD Cc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1793919972 PFSGVZWUUSFUNK-UPHUGPLXSA-N 452.515 0.225 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccc2sccc2c1=O 1794044722 LAISLYKWEPRZAW-ZFHGCVPZSA-N 453.948 0.906 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CNc2ccccc21 1795618851 SSEXDWCDUYKIRR-HXFPYSNGSA-N 450.499 0.098 50 20 JCGD C[C@H](Sc1cccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795738738 DHXNWYHSYHCDPF-AMVTXUCVSA-N 460.386 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CCC3(CC1)OCCO3)C2 1798443197 XAPSOFMZLFVMQY-BJWYYQGGSA-N 457.531 0.870 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCOC1=O)C2 1798521295 AGZMFGDBLRTEKH-HBCWATKFSA-N 476.442 0.176 50 20 JCGD CCC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)COC1 1800386615 HBGFMMQJMCKOTC-CEQLMSFQSA-N 473.574 0.349 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cc1)C2 1801011100 BDMFISQZEBRNIP-BBIADKPPSA-N 473.574 0.099 50 20 JCGD COc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1807363757 FPDKLDHJZYRGMR-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD Cn1cc(CCC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1807431234 YWYHPMXONDJHTB-XMSQKQJNSA-N 476.541 0.766 50 20 JCGD CN1CC(C(=O)N2CC[C@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@@H]2c2cccnc2)C1 1807451857 GSVHZHRIPIRXCG-QPPBQGQZSA-N 493.612 0.995 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CCC4(CCCN(C(=O)c5cccc(B(O)O)c5)C4)CC3)cnc2s1 1809978755 NRZMYIOBFUQMLZ-UHFFFAOYSA-N 494.382 0.903 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(=O)Nc2cccnc2)[C@@H]1c1cccnc1 1813072221 CFFBDTDRUKZXSN-DYESRHJHSA-N 467.530 0.494 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@@H]1c1cccnc1 1813074447 RFSCWDKVVRHMQB-KBXCAEBGSA-N 472.468 0.139 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1 1814795231 IVDNQEFLMJVIMA-IHRRRGAJSA-N 459.931 0.887 50 20 JCGD CCn1nc(C)cc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354635 OCJLXUAMGHVFKI-HNNXBMFYSA-N 453.333 0.887 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ncn(C)n2)[nH]n1 1818111408 JSBPQHYNVVRHJH-ZWGXDWAISA-N 452.479 0.978 50 20 JCGD CCCNC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1824403332 LEXQKISOHMYVDS-OAQYLSRUSA-N 457.380 0.906 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(C(N)=O)cc1)CC2 1826092246 VYQRHHJOXQHLCO-AWEZNQCLSA-N 458.544 0.841 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(C(N)=O)cc3)sc2C1 1827506442 KUQCSMJHZDNNSX-AWEZNQCLSA-N 458.544 0.841 50 20 JCGD O=C(c1cc(O)n[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551468 PNYAOAMMJCLIEA-HTAPYJJXSA-N 491.932 0.781 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830731246 IPDSYQUFANOOKG-YWZLYKJASA-N 460.886 0.513 50 20 JCGD O=C(c1n[nH]c2cc(Cl)ccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732470 YZDULOLBXIFLEI-DNVCBOLYSA-N 457.314 0.886 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830734040 ZSLSVYDPEWDGNY-GWJPWWOOSA-N 497.976 0.605 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@](C)(O)CC(=O)O)CC1 1831868896 FSVMGEFBSMZPQB-JTSKRJEESA-N 454.568 0.595 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnco1)CCO2)NC(=O)NCc1ccccc1 1831935404 LDTZSMGOXJTRMZ-QHCPKHFHSA-N 486.529 0.091 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1C 1832405338 LNABHGMFFCADCZ-XMMPIXPASA-N 460.575 0.675 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832899944 PKPDUYWEHVSVDI-INIZCTEOSA-N 483.660 0.839 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(=O)n3O)CCO2)C1 1833469116 ZXCIRHLMIREPKI-FZKQIMNGSA-N 458.309 0.187 50 20 JCGD CC(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)no1 1834797873 GGUSBTCJEBFZED-UHFFFAOYSA-N 468.363 0.977 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798387 ONOTXXNZXLEXRM-UHFFFAOYSA-N 496.329 0.479 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)[nH]n1 1834801244 STBZVEUMCLJGBD-UHFFFAOYSA-N 481.406 0.886 50 20 JCGD Cc1ccc2oc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cc2n1 1836265410 QCVGYCFEEQINAU-XMMPIXPASA-N 494.508 0.519 50 20 JCGD O=C(NCCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc[nH]1 1836715030 HKKGMNWLGSYAKI-GOSISDBHSA-N 454.955 0.733 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)n(C)n3)CCO2)C1 1838835011 GZPRIEICCGTFAD-SCLBCKFNSA-N 459.341 0.672 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1 1839035260 GNDIZKIAHGYRQM-YWZLYKJASA-N 474.963 0.787 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)N1CCN(C)CC1 1839154583 RTYXKHYLUUSNGL-DBVUQKKJSA-N 465.422 0.315 50 20 JCGD N#Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(Cl)c1 1839424253 WVMBXSXJXCNLKR-QHCPKHFHSA-N 498.927 0.594 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1839444218 ABGBTUCSCKPLCY-UTKZUKDTSA-N 454.907 0.533 50 20 JCGD COC(=O)C12CC(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](C)CBr)C4)C3)(C1)C2 1840004636 IUYHCVZHDDCQOO-CKIVDRAYSA-N 473.364 0.817 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840077572 BPSSRQFQGVDASF-WMZOPIPTSA-N 485.347 0.203 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC3CN(C(=O)OC(C)(C)C)C3)C2)C1 1840156511 QDHGQLCBVDMPGG-VGSWGCGISA-N 489.997 0.954 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1 1840185252 ODYXIJVUXHENHI-JOCHJYFZSA-N 466.510 0.277 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840298974 KTHGIWCYYYREFU-BVZFJXPGSA-N 481.553 0.634 50 20 JCGD Cc1ccc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840664459 RWQKEMGFYOEVQL-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)O2)C1 1841080009 OBOMMEYFJQIJKD-IBGZPJMESA-N 499.373 0.352 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(Br)nc2F)C1 1842141071 NUDTVCQDQBTOKN-UHFFFAOYSA-N 462.084 0.794 50 20 JCGD O=C(c1ccc(CCN2CCCC2)nc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013826 RUYHDFYKNPAWFK-UHFFFAOYSA-N 462.359 0.531 50 20 JCGD COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)nc1Br 1843014328 XPWPJILFHGHSBZ-UHFFFAOYSA-N 474.120 0.663 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCc1ccccc1O)c(=O)n2Cc1ccccc1 10161436 QIOZDXFCOWDINE-UHFFFAOYSA-N 490.520 0.914 50 20 JCGD O=C(Cc1ccccc1)NCCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 105473921 UAJALEHXSCZGLB-UHFFFAOYSA-N 458.540 0.981 50 20 JCGD COc1ccc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1[N+](=O)[O-] 728210573 PHDBMXFVOYKHCH-UHFFFAOYSA-N 463.472 0.917 50 20 JCGD CCn1c(=O)n(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c2ccccc21 728214859 TZKLAPWBSVYIKF-UHFFFAOYSA-N 472.571 0.902 50 20 JCGD CC[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(S(N)(=O)=O)c1 729221045 HBXSXJXXUSMVCO-CQSZACIVSA-N 468.561 0.722 50 20 JCGD N#Cc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1 747103384 FONLTZHSENXSDR-UHFFFAOYSA-N 457.516 0.049 50 20 JCGD C[C@@H]1CN(C[C@@H](C)C(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)C[C@@H](C)O1 747725080 FJWUAOFYOYLXBO-RBSFLKMASA-N 457.622 1.000 50 20 JCGD NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2C(=O)NNC(=O)CNC(=O)c2cccs2)cc1 751212543 SIHGXDBRLDXVQP-BJIFSAINSA-N 469.523 0.429 50 20 JCGD C[C@@H]1Oc2ccccc2N(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1=O 761183413 IVGDLZDXSJKREA-IFXJQAMLSA-N 469.450 0.721 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 849120102 RTBDXUACIBODAX-UHFFFAOYSA-N 496.929 0.923 50 20 JCGD CNC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cn1C 914689021 YYVPIIUQJYLXDL-UHFFFAOYSA-N 494.537 0.710 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3CCN(Cc4ccccc4)C3)nc2)CC1 915902615 IUMPFPPRUWNLRD-IBGZPJMESA-N 473.603 0.918 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCC(=O)N2CCOCC2)cc1 920854141 VVVLSGWVHGAULB-NBVRZTHBSA-N 480.525 0.706 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1ccc(NC(=O)C[C@H]2SC(N3CCCC3)=NC2=O)cc1 920954291 LOHWOIPZESNTHX-MRXNPFEDSA-N 486.554 0.492 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(-n2nccn2)c1 1779032479 LHQZUVYQGMHUEV-DEOSSOPVSA-N 490.524 0.332 50 20 JCGD CC(C)O[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779174646 AQOBBYLEVKHHLF-CYFREDJKSA-N 475.590 0.976 50 20 JCGD CC(C)n1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n1 1779374205 KVPKXEGOJIRSBN-AUSIDOKSSA-N 469.546 0.904 50 20 JCGD O=C(CC12CCCN1CCC2)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1780665916 PLBULOCVSRJFAL-ZJSXRUAMSA-N 469.391 0.512 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)nc1 1781327051 WLCQXQPREXPXMU-CZUORRHYSA-N 464.313 0.619 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3c(C)n[nH]c3C)C2)C1 1781431759 OIUOIJOQMWVZQZ-XDEFOSFOSA-N 455.519 0.533 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CC(c3ccccc3)=NN2)C1 1781453823 MQSOPWLPEZPERN-BPYKYCOYSA-N 484.601 0.640 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1 1781716906 PVPYIZJKNVFSNY-DEOSSOPVSA-N 460.299 0.309 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1 1781881353 RGUWLRGCZRWUBH-XMMPIXPASA-N 460.299 0.514 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1782051774 MVQABGZIDZPETM-HSZRJFAPSA-N 497.512 0.417 50 20 JCGD CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CC(=O)C2)C1)NC(=O)NCc1ccccc1 1783148849 MFGPLVFLZFTXMP-PXDATVDWSA-N 485.585 0.826 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)n3cc(C)cn3)C2)C1 1784447995 JUJXFENFPNUZOF-COATZDGTSA-N 455.519 0.716 50 20 JCGD C[C@@H](NC=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785079560 POXMBOWGOXMCRF-YXMSTPNBSA-N 460.959 0.233 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1scnc1C(F)(F)F 1786265013 MPHFOTNAGSNUAH-QEJZJMRPSA-N 483.277 0.749 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4cccs4)on3)C[C@@H]21)c1cccc(B(O)O)c1 1786984213 QSWPCXRCBAXGRR-KNBMTAEXSA-N 481.339 0.990 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)[C@H]2C1 1788080561 FJCMXODUTYGNAP-ZJOBFFGXSA-N 488.932 0.418 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C[C@@H]21 1788611390 ZCKUWNRQXMMOHH-ZISIXLHDSA-N 490.520 0.314 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)nc4cccnn34)[C@H]2C1 1789200246 YTHVAXFUJVSTNB-ZOBUZTSGSA-N 459.579 0.534 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)C(=O)CC4)[C@H]2C1 1790385122 RQUOWHRIRINSRD-BUKVSMQUSA-N 477.521 0.721 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1F 1791289082 IZCSOGIMUYOTMS-ZQIUZPCESA-N 498.527 0.948 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21)n1cncn1 1791612987 LFMHMKZAXWDOGL-HZEGPAAWSA-N 498.588 0.165 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(Br)ccc1F 1792694369 WDJIVOITWMBFIS-HBCWATKFSA-N 491.122 0.785 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3ncnn3c1)C2 1792872344 ALQSUBMTCPJYFB-LJGDNWOOSA-N 450.337 0.892 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)[C@H]2C1 1792982847 RUWDFQFQQJUICP-GFNSITTLSA-N 487.981 0.058 50 20 JCGD O=C(Cc1ccc(F)cc1C(F)(F)F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793708214 RBHLWURIBUZQSU-VPTLXERWSA-N 494.250 0.970 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(O)nn1)C2 1793879213 OHMVDXKVCZSYNP-MVWRLGRASA-N 497.980 0.837 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ncsc13)C2)c1ccc(B(O)O)cc1 1795734186 HOMVEHQNPNMCGK-CCWDJLKJSA-N 451.313 0.493 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(-c2ccccc2)ns1 1795917726 ASPNDGDWPRXBCG-HGKCTWBKSA-N 472.571 0.781 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccc(Cl)cc2nn1 1796246640 BGOHRNVVVRZEBL-USGNIVHTSA-N 474.949 0.859 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2 1796443828 MOLQORYXSCCYST-COIRSVNQSA-N 491.552 0.476 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(O)n2c1CCCC2 1797985098 DDRHLXVJINGMTL-LOHQAQBBSA-N 483.529 0.262 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H](C(F)(F)F)CC1 1801994092 TZAVETYGXNAZDP-XDEXSSCRSA-N 468.281 0.938 50 20 JCGD CCc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1807361686 HBTMDZFVNOCQGW-IIBYNOLFSA-N 465.294 0.819 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807369816 WSIYAASIKVELPS-XLIONFOSSA-N 463.303 0.137 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1)[C@@H](F)Br 1808679427 XYOLHFIHKNEHTG-BHYGNILZSA-N 461.332 0.065 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810300570 ZHWAVYNSCQEYAY-DNVCBOLYSA-N 478.513 0.456 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1 1813072157 ASZWIPUAEIDSMA-OXQOHEQNSA-N 468.514 0.898 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCCC3)CC2)c1ccc(B(O)O)cc1 1815344343 UVLPEWHUWANOHZ-OAHLLOKOSA-N 465.344 0.895 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCc3nc[nH]c3C1)CC2)c1ccc(B(O)O)cc1 1815347554 CZPIBQCNSRKKCS-UKRRQHHQSA-N 465.344 0.577 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3c(n1)OCCO3)CC2)c1cccc(B(O)O)c1 1815354571 JLFFAVKMTDQDEU-AWEZNQCLSA-N 480.311 0.529 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356934 VRRVJQVTFWHYQI-BDKZABQWSA-N 472.332 0.578 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)n1cnnn1)CC2 1817283076 UDEQSMAMASCGAZ-ASDXFMOLSA-N 470.519 0.437 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1818123711 HHJSTQCUFOYLBI-SJCJKPOMSA-N 456.507 0.581 50 20 JCGD C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1cncn1 1819802206 ZMAAGCKOEROTLD-QWRGUYRKSA-N 455.504 0.220 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1819898453 KNPUDSKMWJRUOB-BDKZABQWSA-N 472.332 0.578 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(CO)on2)n[nH]1 1820347991 SMMGLXIBXINPQG-INIZCTEOSA-N 454.447 0.508 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3cccc(B(O)O)c3)CC4)c21 1821177533 BAJXGPWRGHALMY-AWEZNQCLSA-N 491.338 0.955 50 20 JCGD O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1 1824181811 MSAFHWPCOKTJGW-JKSUJKDBSA-N 458.968 0.671 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824522914 LLOZYZPVSRDYGJ-KXBFYZLASA-N 479.603 0.599 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@H](N)C(N)=O)CC1 1827680852 IXKNEZMCUWBCPC-ZQMUCIDFSA-N 473.578 0.333 50 20 JCGD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)n(C)n1 1828925291 IXBKMFLCZCMEQM-SFHVURJKSA-N 469.546 0.974 50 20 JCGD O=C(Cn1ccnn1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829023586 ROBWGHBQEXCHFK-PGRDOPGGSA-N 490.948 0.330 50 20 JCGD O=C([C@H](O)CCl)N1CC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@H](O)C1)CCN2C(=O)OCc1ccccc1 1829096107 NGMKWMHTGFIMNO-ISJRUSPKSA-N 479.961 0.809 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CC1 1831870813 GXVCHHSNBFMRNV-MOPGFXCFSA-N 497.637 0.865 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)CCO2 1832043328 VJTMVVYPFDUHMQ-HSZRJFAPSA-N 499.609 0.119 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)n(C)n1 1833439170 NEABSEPWJLNFNI-FZKQIMNGSA-N 459.341 0.530 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccccc3O)CC2)CC1 1834045740 CGVIRKZCRCWOJE-UHFFFAOYSA-N 466.542 0.890 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1834325567 IODBMHIPBKKOBW-CQSZACIVSA-N 495.422 0.843 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc4ccccn34)CC2)CC1)c1ccc(B(O)O)cc1 1834798690 YFFPVVGWHJXOOB-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)N3CCOCC3)CC2)CC1 1835765790 AAQKQBZPHNVYQS-AZUAARDMSA-N 465.422 0.445 50 20 JCGD Cc1ccccc1NCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1835866642 HPIKFOICRFAGCZ-HSZRJFAPSA-N 461.563 0.236 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCN3C(=O)C=CC3=O)CC2)CC1)[C@H](F)Br 1836413305 ACJLYGAKRYTATA-SFHVURJKSA-N 473.343 0.564 50 20 JCGD Cc1cnc2c(C(=O)N3CCO[C@]4(COCCN(C(=O)CCBr)C4)C3)cnn2c1 1836947462 UGVLYGQTEZKXOL-IBGZPJMESA-N 466.336 0.893 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cn3ccsc3n1)CCO2 1837048447 QGCZHRIXEIUMCS-BHSKHCGUSA-N 499.553 0.600 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)n1 1837656256 YJKWUIXYBCJWFA-BTYIYWSLSA-N 499.406 0.774 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)n1 1837658940 HFSKUMQHNRIMBM-SFTDATJTSA-N 489.400 0.980 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1837842106 OELJWBPDLRXVFD-HNAYVOBHSA-N 451.395 0.814 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](NC(C)=O)c1ccc(F)cc1)CCO2 1839040021 OUCBUELOCGDNJW-NNMXDRDESA-N 485.940 0.713 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)F)C2)C1)NC(=O)NCc1ccccc1 1839054359 VRACKGSMVXYUDM-QHCPKHFHSA-N 479.553 0.537 50 20 JCGD CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)C[C@H]1CO2 1839086107 WERZGNSDOACZGW-RSMHBEIYSA-N 491.944 0.756 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]nc4ccncc34)C2)C1 1840032916 NJJMLHPOOFRMSE-KZULUSFZSA-N 452.309 0.811 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1840033021 QRSPNFKYFHEXTI-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1 1840035268 LLVXTMWTDJIGDQ-LXIYXOSZSA-N 480.356 0.069 50 20 JCGD Cc1cc2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)[nH]c2cc1C 1840184350 HPSFWCRXZJFYFB-XMMPIXPASA-N 486.573 0.623 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CC1)CCO2)NC(=O)NCc1ccccc1 1840636796 WWUOTLLMAKCELK-HSZRJFAPSA-N 459.547 0.199 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccc(F)cc1 1843011956 NOMTYVBVDIIGPY-HXUWFJFHSA-N 453.279 0.200 50 20 JCGD CN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1845123655 JFKBUEDQIKRYDP-LSDHHAIUSA-N 474.986 0.551 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCS(=O)(=O)c1ccccc1)C2 1846384656 RXFXXSRLVQTSJA-UHFFFAOYSA-N 450.561 0.427 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)O2)C1 1847289410 XSJFCJNBFVPLHX-JONQDZQNSA-N 457.955 0.956 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1847627090 MVBGVTRKLFXRDI-FKBYEOEOSA-N 463.343 0.781 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCn1c(=O)oc2ccccc21 1848153319 PISMBFLIFAPUOH-IRXDYDNUSA-N 464.482 0.499 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc2c(c1)CC(=O)N2C 12969465 NFDKACPAWRUIPV-UHFFFAOYSA-N 451.530 0.430 50 20 JCGD CCn1nc(C(=O)NNC(=O)CCc2c(C)nc(N3CCOCC3)[nH]c2=O)c2ccccc2c1=O 14044382 VSKJAIXIKYHINM-UHFFFAOYSA-N 481.513 0.039 50 20 JCGD Cc1ccc(SCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)cc1 16201109 VSOULUSBUUSISG-UHFFFAOYSA-N 452.558 0.908 50 20 JCGD Cn1cc(Br)cc1C(=O)NNC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O 16270018 YEDCYCVVZRKVHH-UHFFFAOYSA-N 450.205 0.753 50 20 JCGD CCn1c(=O)c2ccccc2n(CC(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1=O 16364927 TVRPEYUZKWOWMZ-UHFFFAOYSA-N 484.465 0.205 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)c1csc(N2CCOCC2)n1 21967609 XOCAXDKWVBFNFS-CQSZACIVSA-N 497.574 0.981 50 20 JCGD CCc1noc(CCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 117371245 DPKOKZMNGODAPN-UHFFFAOYSA-N 451.505 0.437 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)C1(C)CCOCC1)N(S(C)(=O)=O)CC2 726797785 AUTLRCHFVOPGRQ-INIZCTEOSA-N 469.560 0.917 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CC[C@@H](C(F)(F)F)NC3=O)cc2)CC1 728214872 UHQRBJDIYBGLPE-CABCVRRESA-N 463.482 0.523 50 20 JCGD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728367520 HGQDJGGMBXQRLX-YVEFUNNKSA-N 467.438 0.212 50 20 JCGD COc1cccc(C(=O)N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)c1 728961229 COQQDTMPUQLAFQ-UHFFFAOYSA-N 467.530 0.900 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNc3ccc(S(=O)(=O)C(F)F)cc3)c2)CCN1 728975477 NIZOGJHZMLBDRX-UHFFFAOYSA-N 488.494 0.560 50 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C[C@@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919885804 RMCURLXQVIMJDH-UKRRQHHQSA-N 458.562 0.381 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)NCCc2cccs2)c1 920860264 PGBANVKOKFOJTN-UHFFFAOYSA-N 455.562 0.513 50 20 JCGD O=C(c1nc2c(=O)[nH]c3ccccc3n2n1)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1778057211 VVHIYXSLDNBCSE-LJQANCHMSA-N 465.297 0.818 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778095061 RIQVCAGAPQOJDI-UNQCOTSDSA-N 460.535 0.159 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1778716179 QRECXXPRAMSLBH-OAQYLSRUSA-N 454.317 0.141 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1 1778905328 ZZYSBMSSWZUBOU-YNOKNOMWSA-N 490.520 0.986 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)C1 1781332897 GDISYHQDXWFXPS-FASAQXTFSA-N 494.358 0.879 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2)C1 1781342983 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CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1C1CC1)CCO2)NC(=O)NCc1ccccc1 1830501004 GCNSYDOOUUTYKL-VRUMLPLGSA-N 499.612 0.835 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1830544272 SVCWSVSEPWSMHN-KKSFZXQISA-N 498.422 0.820 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830739061 XXQZAMSGMLWPKG-HRAATJIYSA-N 475.970 0.300 50 20 JCGD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)N1CCN(C)CC1 1831873857 AZMSQMKIHWFSPE-PZJWPPBQSA-N 464.655 0.615 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832800164 KVFBXMITSCSQOQ-PBHICJAKSA-N 474.312 0.421 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1 1833032220 YQHZTUKZNLLKKX-HXUWFJFHSA-N 469.636 0.786 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(=O)n3O)CCO2)C1 1833469120 ZXCIRHLMIREPKI-UGSOOPFHSA-N 458.309 0.187 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1833565887 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C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1 1837715707 FVGKPPOQOVWPRH-SIKLNZKXSA-N 450.608 0.898 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(C(F)(F)F)n1)CCO2 1837932691 PDQQHGHRFZXIQI-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COCCNC(=O)OC(C)(C)C)CCO2)C1 1839139338 APEQEWSUBZKFRJ-IIBYNOLFSA-N 493.985 0.238 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1839142987 IBRJCTPTACCCGQ-DNVCBOLYSA-N 459.952 0.573 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nn1 1839201889 MORLPDRCIRNVMX-SUMWQHHRSA-N 462.320 0.794 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3c(C)n[nH]c3C)CCO2)C1 1839239767 GANIBUSQWKQZNR-RQFMOZSRSA-N 485.545 0.159 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840103560 HBTMSIVIGVSVAS-KXBFYZLASA-N 460.369 0.486 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1 1840183652 RIIVVYJQCPYFNV-FQEVSTJZSA-N 453.927 0.178 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(O)cc3Cl)C2)C1 1840184740 CTZFJAFGDKCHOT-KURNWNDPSA-N 494.976 0.888 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2 1840260469 OTDSLCSBBFVJAV-HYBUGGRVSA-N 458.559 0.546 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCc1ccc(N(C)C)cc1)CCO2 1840315764 NTUNIOWJOKTYOW-RUZDIDTESA-N 489.617 0.515 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@]2(C)CN(C(=O)OC(C)(C)C)CC[C@@H]2O)C1 1841031048 CZOYSGIBAISKPZ-GAJHUEQPSA-N 495.621 0.571 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)c2ccco2)C1 1842367905 JCRXVXPPSKMJCS-IBGZPJMESA-N 497.357 0.912 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010550 AMDQZVMVAWOKHQ-UHFFFAOYSA-N 451.288 0.457 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCCC12CN(C(=O)[C@H](F)Br)C2 1845246185 PRVZHFCKLSWOOA-INIZCTEOSA-N 469.348 0.967 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)C[C@H]2C[C@H]21 1847573239 YHYHBUWTTBLCLE-DABHTEOTSA-N 469.347 0.580 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1)c1cccnc1 1847677526 QFZKYFAURFTRCO-ACRUOGEOSA-N 494.357 0.843 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1847967173 HRDOLRUKNZVRSC-AABGKKOBSA-N 471.363 0.971 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 9748356 OBXYDPMYNUWFNN-UHFFFAOYSA-N 472.527 0.808 50 20 JCGD COc1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc(Cl)c1OCC(N)=O 10292272 AOAXJCMALFBTEV-UHFFFAOYSA-N 469.907 0.581 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNC(=O)c2ccc(F)cc2F)cc1 10471338 VNOZLNKFYCENRF-UHFFFAOYSA-N 454.455 0.471 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)C1 15639462 AINPLPMPVJNRHK-IJEWVQPXSA-N 457.574 0.549 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)n(C)c1 16226036 SMDMWQSNHLATPE-UHFFFAOYSA-N 485.588 0.381 50 20 JCGD CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 17513641 KHFGBRJCLYPAIK-UHFFFAOYSA-N 480.568 0.796 50 20 JCGD COCCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)OCC(=O)NNC(=O)c1ccc(C)cc1 19420010 MKERXBLECBUOOI-RUZDIDTESA-N 494.504 0.925 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(N)(=O)=O)c(Cl)c2)cc1OC 726065199 YMNXHOKHKYJTQP-UHFFFAOYSA-N 471.875 0.623 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H](C)NC(=O)c2n[nH]c3ccccc23)cc1 728204203 YJUHBMVELAOEMT-AWEZNQCLSA-N 472.527 0.458 50 20 JCGD CN(CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(=O)OC(C)(C)C 728713302 PLHFRBOQRWGZQT-UHFFFAOYSA-N 484.575 0.654 50 20 JCGD O=C(NCCNS(=O)(=O)Cc1ccccc1)NNC(=O)C1CCN(c2ncccn2)CC1 728960261 XXMUVIHVILNYKB-UHFFFAOYSA-N 461.548 0.143 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)c1cnn[nH]1 729455838 CBTQPFIGFBMGQV-LLVKDONJSA-N 477.366 0.428 50 20 JCGD C#CCN1C(=O)C(=NNC(=O)CSc2nnc(O)nc2O)c2cc(Br)ccc21 747047062 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NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)COC(=O)C(F)(F)F)sc2C1 1819612657 ZNBZWIVGSYNIJK-MRVPVSSYSA-N 486.432 0.473 50 20 JCGD CSCC[C@@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1822433560 IIUQCPIPKHDCDU-JKSUJKDBSA-N 461.548 0.828 50 20 JCGD O=C(CNC(=O)C(F)(F)F)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822441222 YTFZHQRKHSYVFC-CQSZACIVSA-N 467.213 0.074 50 20 JCGD CC(C)N(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)C(=O)OC(C)(C)C 1830719869 MXZAJEZBTIIOMA-IERDGZPVSA-N 477.986 0.688 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)N1CSCSC1 1830730461 ANMZHDBQSSAHQN-CPUCHLNUSA-N 454.014 0.086 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1F 1830736620 VFLHOKNDWWLGDM-UZLBHIALSA-N 461.893 0.701 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(NC(C)=O)n3)CCO2)C1 1833339745 RHMRLUREULKGBN-YWZLYKJASA-N 454.911 0.364 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1ccc(N2CCOCC2)cn1 1834002451 DWYGKIBARLXNIH-NRFANRHFSA-N 480.009 0.703 50 20 JCGD O=C(CCC(F)(F)F)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834593245 CYGZMUBAHPSOHW-UHFFFAOYSA-N 455.286 0.894 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnoc1C1CC1)CCO2 1834614182 UHDVGMGIYIRZPF-XQQQEEOESA-N 484.513 0.756 50 20 JCGD N[C@H](CC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccnc1 1834762532 GLAKMVHIAKVTTK-HSZRJFAPSA-N 479.390 0.037 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cncc4cnccc34)CC2)CC1)c1cccc(B(O)O)c1 1834801343 ZIHOHMYQZUOFGV-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD O=C1CCc2ccc(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)nc2N1 1834971211 UHBDJMUDQADESP-GOSISDBHSA-N 463.966 0.751 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccc2c[nH]nc12 1835007717 KUDFEOQDAWQFMZ-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)ccnc3Cl)C2)C1 1837456229 FVADXIOYUXPLAB-OAQYLSRUSA-N 492.895 0.256 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3nc[nH]n3)CC2)CC1 1838010918 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010595 IJWCOUUHJPNHET-INIZCTEOSA-N 465.743 0.316 50 20 JCGD O=C([C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012209 ONOUPWDQFNHVCL-ZDUSSCGKSA-N 462.237 0.340 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCn1cncn1)C2)NC(=O)NCc1ccccc1 1845039516 XCJJZHKOYYILBI-UHFFFAOYSA-N 454.535 0.218 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1O)C2 1846385175 YMGPKDWXWSHUNI-IRXDYDNUSA-N 481.594 0.181 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC3(CCCN3C(=O)CCC(=O)NN(C)C)C1)C2 1846385975 QZEPZFARCSJVSD-INIZCTEOSA-N 474.562 0.199 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(=O)c(OCc2ccccc2)c[nH]1 1848279406 SQEXWMOHXDHKSW-VXKWHMMOSA-N 487.321 0.763 50 20 JCGD O=C(CCn1c(=O)[nH]c(=O)c2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 27063804 OSKPUVFNMYJLBJ-UHFFFAOYSA-N 485.522 0.326 50 20 JCGD CCn1nc(C(=O)NNC(=O)C[C@@](O)(c2nccn2C)C(F)(F)F)c2ccccc2c1=O 105566509 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O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2)c1n[nH]c2c1CS(=O)(=O)C2 1777714682 FAPGROZQWLFNBK-SJKOYZFVSA-N 465.359 0.769 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4cnccc34)C2)C1 1778610770 GZXRLYLURWELSB-DEOSSOPVSA-N 460.494 0.991 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1778952443 DFBIEJHDRLRYEK-FPTDNZKUSA-N 491.501 0.671 50 20 JCGD CCc1nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)co1 1779372237 DDHOWQMKPUAXAG-VGOFRKELSA-N 456.503 0.677 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(O)cc1F 1780940006 ZDWMNETXEJFQGC-NFBKMPQASA-N 456.279 0.652 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1781226878 BUEFZHPGPKJLFK-IRXDYDNUSA-N 465.359 0.518 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc3c(c2)CCO3)C1 1781949595 MFCRWGNVZJXUNC-ATIYNZHBSA-N 493.564 0.990 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(N(C)C)o1)C2 1782210766 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc(O)nc1O)CCO2 1780097897 QPLQPUBXOLVCHS-OAQYLSRUSA-N 487.425 0.479 50 20 JCGD O=C(Cc1cccc(OC(F)(F)F)c1)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1783010242 AJSWRNVKBWIBIH-QFIPXVFZSA-N 492.259 0.951 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(F)c1F 1786982128 NSUIDUVRIRBLDX-SNRMKQJTSA-N 458.270 0.860 50 20 JCGD O=C1CSc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)ccc2N1 1787388825 ZLZIVCWQRHLGED-QRFRQXIXSA-N 495.366 0.318 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3-n3nccn3)C[C@@H]21 1788609785 KAHLBRNBCNRYOK-ZRCAFCQKSA-N 490.524 0.173 50 20 JCGD CCOCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726834 WFOKIUHHBLXZSR-ACRUOGEOSA-N 475.590 0.739 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792981895 YWELIXGDVSABAF-QKQGURCUSA-N 459.971 0.823 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792983830 QHEUSJHZAOKNND-UNPPPGBBSA-N 471.982 0.823 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNC(=O)c1ccc[nH]1 1794033696 QOWSUDXFTDEIHG-VWPFQQQWSA-N 455.353 0.755 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCS(=O)(=O)c1ccccc1 1795301737 QRJHUFYSYYOLAF-HIRMHNASSA-N 458.964 0.694 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(Cl)c1 1795736827 JTIWYLOOLIKHMC-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccccc1-n1nccn1 1799671220 JFUYLDKSETTWFB-KFYWAZSKSA-N 490.524 0.605 50 20 JCGD CN[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1)C(=O)O 1799871538 MNWMFWQIKYNSDK-RDGPPVDQSA-N 474.562 0.034 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1 1804811645 YLAVHOYEZVTBHN-MGPUTAFESA-N 488.508 0.207 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)C1 1805505366 FWIBALHTPSZSSU-RTBURBONSA-N 456.348 0.801 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCC2(CCCN(C(=O)[C@H](O)CCl)C2)CC1 1805527123 SHNMGJHDWPRZKX-LJQANCHMSA-N 479.014 0.904 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CN2CCCCC2)[C@H]1c1cccnc1 1806887432 QYUNIRCSYJGUCR-XMSQKQJNSA-N 465.558 0.886 50 20 JCGD CN1CCN(CCC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CC1 1806916537 QXPSUOISZFENFV-GBXCKJPGSA-N 473.622 0.098 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)c2ccccc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370720 JWVIJPMTPAQPJR-PMVMPFDFSA-N 459.311 0.815 50 20 JCGD COCc1c[nH]c(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1807373527 BJSRWNOGKWYYQG-SIKLNZKXSA-N 462.315 0.869 50 20 JCGD O=C1Cc2cc(C(=O)N3CC[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)ccc2N1 1807376601 VFSNUQPYXSOWSS-CYFREDJKSA-N 484.321 0.889 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2[nH]nc3ccncc23)[C@H]1c1cccnc1 1808101836 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O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(-n3cccn3)nc1)CC2)c1ccc(B(O)O)cc1 1815344039 CXLWRGKCXNMZHT-QGZVFWFLSA-N 488.338 0.943 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1)c1cccc(B(O)O)c1 1817476195 JWDFBYWXQWXXEY-AWEZNQCLSA-N 468.197 0.501 50 20 JCGD C[C@@H](NC=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(C)NC(=O)NCc2ccccc2)n[nH]1 1820710221 AHTFVMOXUKEFDQ-APWZRJJASA-N 484.561 0.883 50 20 JCGD C[C@H](CN)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828947548 SHNZDNSNJBTVTL-TVTNDZMWSA-N 466.966 0.633 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(-c3ccccc3)on1)CCO2 1829590061 BIBQWYHFOHWSAL-RUZDIDTESA-N 491.309 0.405 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1830352552 PXYYIIKXSJOTSO-GAYYXQCQSA-N 471.913 0.157 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCSC(=N)N)C2)C1 1830537848 QGBBXHRZEPSKKP-LRDDRELGSA-N 451.387 0.491 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2)CC1 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O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1ccc2c(n1)OCCO2 1835040571 NYKMXKOAMUDTCC-QGZVFWFLSA-N 452.939 0.638 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1 1835079471 YTTGVUNMRATIKX-CVEARBPZSA-N 464.966 0.978 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cnc2[nH]ncc2c1 1835522980 ABZZQCHCOXJBLO-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD Cc1onc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1C 1835736982 DTTXECWLTHPTCG-UHFFFAOYSA-N 469.546 0.789 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737484 XQALRLKOVHEVLQ-INIZCTEOSA-N 482.589 0.636 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C3(c4cccc(F)c4)CC3)C2)C1 1835927216 MKLKEXPHBIIZSD-XMMPIXPASA-N 482.317 0.307 50 20 JCGD Cc1nc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3ccc(B(O)O)cc3)CCO4)ccc2s1 1835930779 ZEJCMOLBEWVKKR-XMMPIXPASA-N 495.366 0.668 50 20 JCGD O=C(Cn1cnnn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1836150335 MPYMGASAIJIJEX-PXNSSMCTSA-N 493.362 0.136 50 20 JCGD Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1 1837529063 VVCQPLKCFDTIOV-UHFFFAOYSA-N 451.332 0.996 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1cnccn1)CCO2 1837609183 OOVQBKVYQQMEIF-AUSJPIAWSA-N 453.927 0.069 50 20 JCGD O=C(c1cc(C(F)(F)F)ccn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838081383 FYQRPUDQLPYXFY-WMLDXEAASA-N 451.829 0.770 50 20 JCGD O=C(c1cc2n(n1)CCCO2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201369 VTBNUKLGUABFMO-YOEHRIQHSA-N 461.288 0.426 50 20 JCGD COc1c(C)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1C 1839394420 YXYUAIBCBGWOFC-DEOSSOPVSA-N 476.574 0.755 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839464488 QPBQGOPRFYKQDE-RUZDIDTESA-N 497.552 0.694 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc(C)c1C(=O)O 1839481776 WXSQMAZQNKVMNU-XMMPIXPASA-N 490.557 0.445 50 20 JCGD Cc1cc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)ccc2[nH]1 1839616721 MCVCDJZIQZBAGC-DEOSSOPVSA-N 471.558 0.919 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2 1839691695 HUKLVVGQAUTZPY-IBGZPJMESA-N 458.462 0.201 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)N3CCCC3)C2)C1 1840030821 XKSTVUZFQPTFBE-BEFAXECRSA-N 460.369 0.629 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1840035462 SAUIAMWENGPAIA-YCRPNKLZSA-N 481.391 0.623 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)C2)C1 1840150146 GKUUZNVRCGQLEY-ZJBJCVSYSA-N 471.982 0.488 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OCCCO)cc3)C2)C1 1840154223 PYXSHSPBKMIQEV-SIKLNZKXSA-N 470.950 0.772 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)COC4)C2)C1 1840184574 VVQPGWCUTKRVJA-QHCPKHFHSA-N 460.531 0.160 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3Cl)C2)C1 1840184895 CAGJPNLESIZLCP-OAQYLSRUSA-N 452.939 0.783 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc(C)c1C(=O)O 1840185086 IHPNDYSACKVDNF-XMMPIXPASA-N 490.557 0.445 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3CCOC3)CCO2)C1 1840533677 KBGWXVGKDZTFIL-XFQAVAEZSA-N 475.970 0.611 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc(C)c1O 1840674679 AQZAXUZKVRWWBV-DEOSSOPVSA-N 468.315 0.073 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cc(Cl)c3)CCO2)C1 1840710251 IQUQWQCMLKWIGO-JOCHJYFZSA-N 491.907 0.861 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)CC1=O 1848091278 NTOPKPAAMMGSQM-HJNYFJLDSA-N 475.354 0.852 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC 10791378 SLWIHUCOJFVKKZ-UHFFFAOYSA-N 465.484 0.572 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)c1cccc([N+](=O)[O-])c1 15342776 YCCGEWFUPJAEJM-UHFFFAOYSA-N 452.420 0.830 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCN3C(=O)NC4(CCCC4)C3=O)cc2)CC1 728214056 WKXVNUDXDDLHSY-UHFFFAOYSA-N 478.575 0.321 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)Cc1cccnc1 728851023 ISKLQJSMWYEWQG-UHFFFAOYSA-N 459.528 0.085 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCCC2)c1 729276176 YINJPHXOZNGTCO-LBPRGKRZSA-N 480.996 0.603 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 729276178 YLQPHLZKBAFKMT-NSHDSACASA-N 458.493 0.325 50 20 JCGD Cc1cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc(S(=O)(=O)N2CCC(C)CC2)c1C 729276192 YTGSVPCDKWFRQK-OAHLLOKOSA-N 474.605 0.423 50 20 JCGD CCC(CC)N1C[C@@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1=O 729301687 IWNIETDWPZYOBV-SFHVURJKSA-N 494.614 0.825 50 20 JCGD CCCN(CCC)C(=O)CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 729510022 ODGTWBWFHJXWON-UHFFFAOYSA-N 468.576 0.897 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21 729946377 CVGGTMFXKZSJIV-UHFFFAOYSA-N 492.828 0.987 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCCC3)CC1 744446678 ILEUMRGEJVPFBJ-UHFFFAOYSA-N 450.561 0.638 50 20 JCGD CC(C)c1noc(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 749356720 SZRFEZCJHIDCST-UHFFFAOYSA-N 480.547 0.791 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CCS(=O)(=O)c2ccc3c(c2)OCCO3)n1 761533051 FBMTYNRJWLRNQD-UHFFFAOYSA-N 483.524 0.320 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2ccc(S(N)(=O)=O)cc2)c1 804025861 WGCKTIHPQUMUPL-UHFFFAOYSA-N 469.545 0.831 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)C[C@@H](C)O1 912919595 PPBBBZPULGHSFF-CHWSQXEVSA-N 466.482 0.630 50 20 JCGD O=C(NNC(=O)c1nc(N2CCCC2)ncc1Cl)c1cccc(S(=O)(=O)N2CCOCC2)c1 916029696 DHPXZUKZMKBPKZ-UHFFFAOYSA-N 494.961 0.826 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCc1cccnc1 916262889 VDPGQRKKWMHTQT-UHFFFAOYSA-N 461.544 0.608 50 20 JCGD NS(=O)(=O)c1ccc(OCCSCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 918552140 NHJPIOSJEPEQFN-KRWDZBQOSA-N 467.525 0.433 50 20 JCGD O=C(NNC(=O)c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1)N[C@@H]1CCS(=O)(=O)C1 919888853 HJZOCMJCDQWVJP-GFCCVEGCSA-N 491.526 0.945 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2nnn(-c3ccccc3)c2C)cc1 919963460 QXZLQKQOKIYGDJ-UHFFFAOYSA-N 456.528 0.895 50 20 JCGD CS(=O)(=O)c1nc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c2ccccn12 921165016 FVSJNHDHKHRKKY-UHFFFAOYSA-N 470.555 0.711 50 20 JCGD NC[C@H](N)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Br)Cc1ccccc1)C2 1778003339 VYKGHGXZGQANNT-BMQTXXJKSA-N 467.408 0.793 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccnc1OCC1CC1)CCO2 1779029326 VSNHLVRUZDNECN-DEOSSOPVSA-N 480.525 0.626 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3nccn13)C2 1779374134 CBCDYMAAUMVSPU-NTKDMRAZSA-N 477.525 0.774 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc[n+]([O-])cc3)C2)C1 1779879964 JNVRMTIDNAAGBU-HRAATJIYSA-N 468.938 0.896 50 20 JCGD COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc(Cl)n1 1779882915 PMNJQTQKIOLNSD-WZONZLPQSA-N 487.749 0.865 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](COC)NC(C)=O)C2 1781901486 OZDFLVYXOGOXOA-YIOZNXECSA-N 462.385 0.825 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(S(C)(=O)=O)ccc3F)C2)C1 1782151755 WJTIOIGPERHWTP-NRFANRHFSA-N 484.550 0.046 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)C1CC1 1784084582 YKKUOVIYBWQNPO-HJWJTTGWSA-N 459.971 0.965 50 20 JCGD Cc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)n1 1785114041 GAAYXMOGVSEUAH-NYVOZVTQSA-N 451.332 0.296 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)[C@H]1CCc2nc(O)nc(O)c2C1 1785330064 NTYYMBAXEYUHOZ-DUPGQFARSA-N 483.363 0.757 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)C3(c4ccccc4F)CC3)C2)C1 1785458507 CBTRGLQSHVZHQY-QHCPKHFHSA-N 452.291 0.681 50 20 JCGD N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)c1cccc(Cl)c1 1786979826 KLMRDCDNKMTGBU-LRGNLBRXSA-N 471.750 0.313 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(O)cc3)C[C@@H]21 1787506618 JSBCJSVTMGBKIZ-UNGBVBFUSA-N 483.525 0.885 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1occc1Br 1787587585 YOBGVPARKWNBJE-QRTARXTBSA-N 477.120 0.629 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc2c(c1)OCCO2 1787813250 MQEKWOQMCSWQRT-JLMWRMLUSA-N 466.299 0.045 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cnccc4n3)[C@H]2C1 1787890988 OGCFAVJRFFIPKE-ZWOKBUDYSA-N 454.531 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nn(C)cc4c3)[C@H]2C1 1790354190 OZLUNHREQCGGKC-QRFRQXIXSA-N 456.547 0.540 50 20 JCGD O=C(NC1(c2ccc(NC(=O)[C@H]3CCCS3(=O)=O)cc2)CCC1)c1cccc(B(O)O)c1 1791179230 ZQYDVSOPRLCHPG-LJQANCHMSA-N 456.329 0.691 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC(=O)NC1 1792578827 UZALTVAVJDORTJ-LFYQSXPISA-N 472.970 0.234 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(F)(F)F)C2)c1ccc(B(O)O)cc1 1795732585 YBSWQGONDXVRHG-ZSBFGKGUSA-N 463.221 0.297 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)C1=C2c3ccccc3C(=O)N2CC1 1796191934 RIQJVUSFXFBWRI-REPLKXPHSA-N 471.322 0.889 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNc1ccc(F)cc1)C2 1796440232 JFUSFIMPHYELMV-BSBFHTJNSA-N 470.505 0.961 50 20 JCGD CCOC(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)OCC 1796446408 UVIGRKQQXRKHEU-OYSOCFBGSA-N 463.535 0.499 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1797769524 USKVYCOSUQTTQA-KCYAQADSSA-N 496.996 0.999 50 20 JCGD Cc1cccn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)c12 1800107002 LIVUQDFXHSSKCA-CCWDJLKJSA-N 463.498 0.158 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CC(=O)OC)NC(=O)OC(C)(C)C 1800802029 ZRRAEWWGFRWTRD-LBKYZSNHSA-N 491.969 0.286 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1 1804044090 VVNDRHZBEIVUBD-GOEBONIOSA-N 497.210 0.436 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1804347999 LSFBCPICNJATGK-HOSILWTGSA-N 466.336 0.859 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1807028325 JGPDUDRKMWMSPY-WHOFXGATSA-N 463.269 0.596 50 20 JCGD NC[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccc1 1807251089 FUPULCPBEIVCJG-XWGVYQGASA-N 472.354 0.824 50 20 JCGD CC(C)(CCl)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1807944213 NZQRGBIWPYNDBE-CZUORRHYSA-N 458.910 0.792 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc3c2NC(=O)C3=O)[C@@H]1c1cccnc1 1810025719 JSSHXOIMOSIZCF-ZHRRBRCNSA-N 492.536 0.909 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1 1810302438 JDIRRSBGAFWGRL-BTYIYWSLSA-N 485.508 0.985 50 20 JCGD Cc1nccn1CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1812405738 WXFJIBKWEALILF-UTKZUKDTSA-N 462.514 0.605 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(=O)nc3cccnn23)[C@H]1c1cccnc1 1813072194 BCWCYYUCBMDZNB-HXOBKFHXSA-N 492.540 0.177 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815228581 ISIJLRBQQYIOCC-CXAGYDPISA-N 462.337 0.076 50 20 JCGD O=C(CCC(=O)N1CCCC1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336856 GRQZWCKGORCBPW-INIZCTEOSA-N 470.360 0.451 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337858 XDYNUYSWWHSLCF-BBRMVZONSA-N 453.333 0.582 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815341319 WKLDVAMMQXODRA-ZDUSSCGKSA-N 497.298 0.674 50 20 JCGD Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)s1 1815576618 PSYDQBRXBIPYFA-CYBMUJFWSA-N 457.346 0.451 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCCS1(=O)=O)CC2 1817282872 NIUZGBBONJSXCD-KRKRZFJASA-N 492.583 0.766 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc3[nH]ncc3c2)[nH]n1)c1ccc(B(O)O)cc1 1817471172 CDYXLVINDZUDIQ-GOSISDBHSA-N 459.275 0.981 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401526 GFTQWSSNBGKIEU-WBMJQRKESA-N 492.562 0.042 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)[nH]n1 1819403120 VMIGAYFKYYTVIB-HKUYNNGSSA-N 477.529 0.679 50 20 JCGD Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c(=O)[nH]c1C 1819793513 OSEYYDHTJOLCKR-NSHDSACASA-N 482.526 0.381 50 20 JCGD COC(=O)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829381219 DOFUTDMHZOWRFM-VGSWGCGISA-N 496.948 0.394 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1830358029 OJUDAANQOAKFIT-HXUWFJFHSA-N 451.911 0.770 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830363522 ABTBZYJZTVZYPJ-VBKZILBWSA-N 463.959 0.551 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](C)CBr)CCO4)c(C)n2n1 1830538871 SPYYCZPJGDITFK-RBZFPXEDSA-N 495.378 0.842 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccnn3)C2)C1 1830546175 PUYCKOIFAHTSEQ-KSSFIOAISA-N 457.325 0.343 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1830738037 LIVKGPCJHKNUFT-HYFFOGBASA-N 489.997 0.690 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCn2ccnn2)CC1 1832246843 FUGQTDARKQFPLV-LJQANCHMSA-N 454.535 0.600 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1 1832425126 DNBDHTCBXSUWLL-KXBFYZLASA-N 460.369 0.629 50 20 JCGD CN[C@H](CC(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1)C(=O)O 1833263674 QPUIDZMMZHXSIM-CZUORRHYSA-N 461.401 0.652 50 20 JCGD O=C(CSc1ccncc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833764658 VMXLCIPBYUQMDS-UHFFFAOYSA-N 482.415 0.739 50 20 JCGD O=C(Cc1cccnc1Cl)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833769218 KJOAFXLCWBJCJG-UHFFFAOYSA-N 484.793 0.843 50 20 JCGD CCc1ncsc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798408 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CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4cc(Cl)ccn34)C2)C1 1840184083 QYXBOPNROJCTKL-QFIPXVFZSA-N 492.964 0.431 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COCc3ccc(OC)cc3)CCO2)C1 1840254833 KTENRMYAOVDCJC-DENIHFKCSA-N 470.950 0.922 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1840314145 TXMDZPIARIEWOU-DENIHFKCSA-N 453.967 0.741 50 20 JCGD CN1CC(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)C1 1840572270 PXDSFASOVCXQPY-NYRBYKDPSA-N 460.481 0.890 50 20 JCGD COc1cc(Cl)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840741842 LCZZNGOYTDVYSM-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1 1841237984 HEMWYPBALMDRHA-LJQANCHMSA-N 451.288 0.281 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1841921419 UFKLHOJLSZZLSV-CVEARBPZSA-N 484.557 0.972 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)/C=C/c1ccc(O)c(O)c1O)C2 1844265476 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(O)cn3)C2)C1 1784641431 RUVRZHOSJOAOAQ-BHSKHCGUSA-N 454.487 0.294 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ncn3)[C@H]2C1 1784668938 SHSVSWIRLQNCSX-AXHNFQJDSA-N 485.453 0.923 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)C3(c4ccccc4F)CC3)C2)C1 1785458559 GEMBBRQUAMBNKZ-QHCPKHFHSA-N 452.291 0.681 50 20 JCGD COc1cc(OC)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786980916 DNVAXBWQDHSWTN-SSKFGXFMSA-N 468.315 0.291 50 20 JCGD CSc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1O 1786981092 QVZIPPXLPUOSIR-SNRMKQJTSA-N 470.356 0.701 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS(=O)(=O)N3CCCC3)[C@H]2C1 1787505533 FMYUGEGRTDRYDL-AJNGGQMLSA-N 466.398 0.175 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C[C@@H]21 1787507607 IQPSGUXLBHOXEF-PRYFDBBFSA-N 498.584 0.501 50 20 JCGD Cc1nccn1CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611105 MKGDAJCJQLFBPV-VDGAXYAQSA-N 469.546 0.264 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)Cc3ccccc3)C[C@@H]21)[C@@H]1C[C@H](O)CN1 1789766355 WYKGOXJQZLYHJI-RABCQHRBSA-N 480.403 0.695 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)c(F)c3)[C@H]2C1 1790066171 CCGUIELYGVJTBU-AXHNFQJDSA-N 457.462 0.437 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C[C@@H]21 1791291337 RRDVIUZZHVJFGG-QIJZPMMNSA-N 471.558 0.857 50 20 JCGD C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792978687 MNYZLVJYAAMUQR-MDMSPXHWSA-N 471.982 0.873 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(Br)cccc3n1)C2)[C@@H](O)CCl 1792981230 HIIMQSRMKRTAQD-DZJQYVJYSA-N 471.739 0.900 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(C(F)(F)F)n1)C2)c1ccc(B(O)O)cc1 1795733038 ZXDOGAFPWHJHFL-YVWYUNDQSA-N 477.248 0.226 50 20 JCGD CN[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2)C(=O)O 1796092587 CFEAAQRMGHTPKO-FCGDIQPGSA-N 474.562 0.034 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796367289 DZTVYWSXXHTBNE-RHBQXOTJSA-N 479.933 0.957 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)CSC1=S)C2 1796893287 XAEIZLOWEZLDRX-ONMDDFKGSA-N 476.584 0.619 50 20 JCGD CN1CCCn2nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)cc2C1 1798442809 GPJVHYHRSROHJD-MUJYYYPQSA-N 466.546 0.283 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCNC3=O)C2 1800332602 SGLUQJZYHKXLEP-YJMBJCRISA-N 496.474 0.715 50 20 JCGD CCOc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cnc2c1cnn2C 1802332368 AXBOXLFNKSQTRL-MUJYYYPQSA-N 471.562 0.992 50 20 JCGD CN(C)c1cncc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1804850472 PCISJOGCZRLEJL-XXBNENTESA-N 473.342 0.856 50 20 JCGD CCOc1cnc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1 1804919898 UHJGNOPXXRYCJD-VGOFRKELSA-N 469.546 0.963 50 20 JCGD COCCOCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1806755844 MPAXFKCIWGMPKU-OXQOHEQNSA-N 456.503 0.063 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370908 NBAZZMLQEHBZFH-JTSKRJEESA-N 470.298 0.666 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373118 NATCRLVJAWGYEY-WIYYLYMNSA-N 482.346 0.606 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374591 LKAIXZSJJBXAQL-QANKJYHBSA-N 460.137 0.864 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)CC1 1807699895 MEGMAUIKLQJXDN-UHFFFAOYSA-N 492.385 0.757 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807943241 DFICGQKELZXQFN-FFSVYQOJSA-N 489.334 0.558 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1 1808323261 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C[C@@H](Oc1ccccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347911 XEZCPMQJBBSABU-CJNGLKHVSA-N 466.328 0.911 50 20 JCGD O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1 1816782650 SHUUQJQNRTXMPR-NSHDSACASA-N 464.284 0.627 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCCS1(=O)=O)CC2 1817282870 NIUZGBBONJSXCD-FAUFNCHLSA-N 492.583 0.766 50 20 JCGD CC(C)(C)n1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)nn1 1821631517 KECPXNQXKLNNHI-CQSZACIVSA-N 468.348 0.709 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822790853 HBQMSNMIFGBLBC-HXUWFJFHSA-N 464.335 0.988 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)CC1 1825072480 ORHGNBSRVWOBAG-PTISKKJCSA-N 485.545 0.338 50 20 JCGD COC(=O)C12CC(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3cccc(B(O)O)c3)CC4)(C1)C2 1825553067 CUJDCGDFDOALHE-DRKNDHHNSA-N 469.328 0.392 50 20 JCGD N#CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1828805692 AIAQSIBJUWYMEV-VWLOTQADSA-N 490.325 0.346 50 20 JCGD CN1CC(C(=O)N2CCN(C(=O)OCc3ccccc3)[C@@]3(CCN(C(=O)[C@H](O)CCl)C3)C2)C1 1829415930 NNHXIZNDFMEMMW-AUSIDOKSSA-N 478.977 0.600 50 20 JCGD CCSc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1829576119 OOIUVJHLGHWDTK-HSZRJFAPSA-N 485.371 0.257 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)C1 1830716107 UDVPNAUHYPJOBR-LZJOCLMNSA-N 456.612 0.884 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830738692 RQFFSAMEKLJXRZ-LAUBAEHRSA-N 450.923 0.552 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831598901 WUDFFPNCOPKDAV-WIEQDCTASA-N 490.985 0.086 50 20 JCGD COCCOCCOCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1831722630 DKAXRHKYEIKYAT-HSZRJFAPSA-N 490.406 0.669 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1834329133 UHPKPFOHADLLAR-INIZCTEOSA-N 495.422 0.985 50 20 JCGD COC(=O)CCCCCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799019 JYJMYKQPZFBHTK-UHFFFAOYSA-N 487.406 0.675 50 20 JCGD CC(C)c1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)co1 1834799858 ILKBXDZXJVCCEK-UHFFFAOYSA-N 468.363 0.977 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)/C=N/O[C@@H]3CCCCO3)CC2)CC1 1835768911 OQHFJFIKEOJBHO-WDRHXJDGSA-N 480.610 0.460 50 20 JCGD NC[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)c1ccccc1 1835811333 DKTJRPUVYVJRSP-YLJYHZDGSA-N 454.365 0.970 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1 1835836926 CNIXXFATZLWYTO-HXUWFJFHSA-N 485.654 0.904 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1836670982 NNUJSOHHVNGGCW-BBRMVZONSA-N 461.401 0.609 50 20 JCGD COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1836981798 KKVYDSADBGFXMQ-UHFFFAOYSA-N 467.331 0.696 50 20 JCGD O=C1CN(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)C(=O)N1 1837076791 SLHGSZNGPBTIIU-OAHLLOKOSA-N 463.304 0.227 50 20 JCGD O=C(CCBr)N1CCC(OC2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1837651877 PYSJYPJMMOQUDZ-UHFFFAOYSA-N 470.301 0.495 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)[nH]1)CCO2 1837766636 KYUVEKQCIZLTRK-IBGZPJMESA-N 475.468 0.477 50 20 JCGD CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)cc1C 1838149318 FXMVVJHMMSLCIX-QADUPLGGSA-N 485.545 0.415 50 20 JCGD CCC1(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)COC1 1838394691 NMLAWUTXQSWWMC-UHFFFAOYSA-N 459.547 0.724 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc[nH]3)C2)C1)NC(=O)NCc1ccccc1 1839054297 SAWCSWIMSYEZAG-XMMPIXPASA-N 484.557 0.431 50 20 JCGD CC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054323 UECUSKTXSZQZED-XMMPIXPASA-N 489.573 0.158 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1C[C@H]1F)CCO2 1839097805 MGHSGAIXKDLMOV-LUQKVYGDSA-N 465.434 0.948 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(C#N)c1 1839131456 ZMMFUCGPPYROBU-NQIIRXRSSA-N 451.907 0.165 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1839149949 XDCMVOHLGKIVKG-QZTJIDSGSA-N 454.420 0.728 50 20 JCGD O=C(c1cnc(OCF)cn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839197712 GLKBXAJOKBELKE-BBRMVZONSA-N 465.251 0.543 50 20 JCGD O=C([C@@H]1CC(c2ccccc2)=NN1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202994 WERDDINEQQSXQD-ZWOKBUDYSA-N 483.338 0.900 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802162 NLWGPPHUVVXSKR-CDMIOBSGSA-N 496.402 0.961 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cc1 1840030249 GUMFCGNXLQTQKJ-CFLQYTFWSA-N 471.348 0.968 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1 1840153133 FPBOHLLQKAYYLC-BTYIYWSLSA-N 467.906 0.341 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1 1840185004 DLWMGPJITQFOQG-FQEVSTJZSA-N 487.479 0.543 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2 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NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CC3Cc4ccccc4C3)CCO2)C1 1779036063 WHVLVFSRFHKHNU-RUZDIDTESA-N 463.538 0.934 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(Br)ccc3O)C2)C1 1780557547 MUXVRQMJXVQRDV-NRFANRHFSA-N 489.131 0.592 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)C1 1780653053 JYIIRAVQHWZEPW-CLJZWUSWSA-N 489.997 0.328 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2)NC(=O)NCc1ccccc1 1780968281 AFDSPRHSDWRNLA-WATLYSKOSA-N 487.601 0.714 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)[S@](=O)c1ccccc1 1782681829 RAFBPWVQUMXFAE-XXVJPEFISA-N 470.356 0.006 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(S(C)(=O)=O)cn3)[C@H]2C1 1785713363 JMIFNJOYTYCGBX-DSPQJCBJSA-N 474.377 0.862 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786982862 BPYFPPWLJBDHTA-BWPZPKMVSA-N 468.334 0.978 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Oc3cccnc3)C[C@@H]21 1787508172 MJEZFMJCUQDMTQ-VHCRWPNBSA-N 482.541 0.963 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788144995 KEKLXXRZYITTTI-OAHLLOKOSA-N 473.360 0.442 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1788178648 KWNCFQXDQZNHHD-VIQHNZTISA-N 459.971 0.823 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c(F)c1 1788610332 XPYPZARZLSJAMI-GMVOTWDCSA-N 471.489 0.740 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COCc3ccccc3)C[C@@H]21 1788610537 DMPUYSKBIILZTK-YYWHXJBOSA-N 467.526 0.495 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC(F)F)cn3)C[C@@H]21 1788611689 RCGHDRYXUQCALW-IWEFOYFVSA-N 490.467 0.589 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N(C)C(C)=O)C[C@@H]21 1789222137 AFQTUIDCYDESFN-VDWZUQCSSA-N 490.513 0.980 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1789892219 IMGYQPMXFSYOKB-BODMQJBDSA-N 473.530 0.610 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)c(O)cc3O)[C@H]2C1 1789993230 WENUHDDSHADCHU-LLJZQGTPSA-N 489.916 0.657 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(F)c(F)cc1F 1790042936 JWWSXIYXDDVEIV-RISOHXOYSA-N 462.233 0.691 50 20 JCGD CSCC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1791305821 CFLZGIMBXPQLJD-DWJZEIJXSA-N 465.576 0.214 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1792223524 OMZWMKUMKJOPJH-LXFSFDBISA-N 479.933 0.957 50 20 JCGD Cc1ccc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1792251755 BEPOXMNXSDQQBI-YYWHXJBOSA-N 494.552 0.017 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCN(C)C(=O)OC(C)(C)C)[C@H]2C1 1792263395 PFEGGZFCOLQKBN-FHWLQOOXSA-N 497.637 0.986 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1 1795385299 ORYYVJSXHPYLPV-KPKSRIACSA-N 453.499 0.444 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c(F)c1)C2 1796443878 PHVYXQRROVRMQE-MGZYLUJXSA-N 457.462 0.869 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1 1797680547 HBZZRRLBWKLWCN-FHULIHMCSA-N 459.971 0.842 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@H]1CCCCO1)C2 1797751804 SNNWATXIKHZYJR-FTUNRGFVSA-N 463.560 0.148 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1800293616 KUVRWLPFFLECQT-NLFJOSALSA-N 464.327 0.682 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801010555 GFRBBKCLTMHWJR-CLWJZODNSA-N 481.594 0.418 50 20 JCGD C[C@@H]1[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C 1802248966 SQLVXQJHWDOQHQ-IFTGGNMHSA-N 459.971 0.821 50 20 JCGD O=C(Cc1cnc2ccccn12)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1803099289 NRSHFVAKVODXGX-CJFMBICVSA-N 483.337 0.971 50 20 JCGD Cc1nnc(CCC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1 1804558306 ALLSJCYJTSNROX-GCJKJVERSA-N 479.371 0.874 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc(-n2cnnc2)cc1 1806991662 CSNSRRYHMTZLCY-QPPBQGQZSA-N 496.336 0.976 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1807029391 RWKKWHDAYWLGDN-DZKIICNBSA-N 477.296 0.986 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363658 NHWPQJDQLTZEHN-URXFXBBRSA-N 496.336 0.976 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366954 IUSNXAODMJVCOL-BSLALVQMSA-N 461.331 0.847 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C(=O)N(C)C)[C@@H]1c1cccnc1 1808414953 QPIRUWCMHOYHGJ-GMQOBWHFSA-N 453.503 0.310 50 20 JCGD Cc1nccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1808763418 MBYYRDHNRWJPBW-UZLBHIALSA-N 460.498 0.812 50 20 JCGD COCc1oncc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1808822358 SLZABECVQVSEGV-QRWLVFNGSA-N 479.497 0.848 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1810539852 GGTVPQBYCQVKAQ-QAPCUYQASA-N 458.528 0.664 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CCC(CO)CC1)CC2)c1cccc(B(O)O)c1 1815350301 OXKOBCHFDBNGSK-KVULBXGLSA-N 457.361 0.847 50 20 JCGD Cc1cc(C)n(CCC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815361756 QSUMLFWXNXVZJR-QGZVFWFLSA-N 467.360 0.952 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nc1 1817471124 SEDUOAXCCANZHC-LJQANCHMSA-N 497.342 0.508 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc2c(c1)CNC2=O 1819203239 VPZONNSPEYRTEE-FQEVSTJZSA-N 473.298 0.953 50 20 JCGD N#Cc1ccccc1OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1828030134 RVTRJEYUUDIIIN-KRWDZBQOSA-N 476.323 0.999 50 20 JCGD COC(=O)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828834612 KZXRQMHTLCMZPV-WZONZLPQSA-N 495.960 0.991 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)N1CCN(C)CC1 1828924585 SRINBKCPKGBVQH-GCJKJVERSA-N 485.633 0.554 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C#CC(=O)O)CCN2C(=O)OCc2ccccc2)C1 1829334312 HPNQPZQITAYJHU-MBSDFSHPSA-N 491.928 0.780 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2 1829843867 RGHNPMPIVVKPRK-QHCPKHFHSA-N 458.559 0.548 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830726576 QUNCBRVHUWWCTK-KKSFZXQISA-N 473.954 0.220 50 20 JCGD COCCOCCOCCOCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1 1831731387 JWBWSYFLQQBHAJ-PMACEKPBSA-N 479.014 0.902 50 20 JCGD O=C(Cc1ccc(Cl)s1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832603081 NFKUIPAFRSGYAU-OAQYLSRUSA-N 478.763 0.394 50 20 JCGD Cc1ccncc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1833013152 YJOLKUHCLOEHFP-XMMPIXPASA-N 482.541 0.091 50 20 JCGD O=C(/C=C/c1ccsc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1833138652 INEWCMCVJKJUPM-TWKPZUECSA-N 456.329 0.211 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833313491 HHYHQRXXFBUMJO-MSOLQXFVSA-N 491.029 0.433 50 20 JCGD O=C(c1ncc(Cl)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1833788610 OZUNGYRWTRZQHO-XHDPSFHLSA-N 451.680 0.891 50 20 JCGD COc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835736995 FKNXVYUJFQENKJ-UHFFFAOYSA-N 481.557 0.588 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1 1835934214 QDCSUNGCGGGPAI-NFBKMPQASA-N 456.279 0.147 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4c(Cl)cccc34)C2)C1 1835939401 PHXAJNSMVDVYIV-XMMPIXPASA-N 497.744 0.885 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836717341 CBMJTHBPUNRHRP-CVEARBPZSA-N 463.959 0.428 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837456412 HLZOSXDMLHVPGP-XMMPIXPASA-N 482.541 0.091 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1C 1837461296 TWKXFGRACACYNX-RUZDIDTESA-N 497.552 0.315 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1 1837921253 QLCLDQAEKVJRFI-UHFFFAOYSA-N 470.291 0.529 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838526802 DNZGQLKURSVEQL-RWAHWCJQSA-N 493.513 0.997 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)CCOC1 1839191180 XVQRGMDXMXDLRL-UXHICEINSA-N 496.388 0.930 50 20 JCGD C[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)Oc1ccccc1 1839746254 HMPJJFOSHPFEET-KBMIEXCESA-N 482.342 0.294 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)C2)C1 1839964651 YBKNFWNHBRHCIE-RSLFNQERSA-N 491.408 0.419 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1840032629 FHJAWOJKCPVHGL-ORAYPTAESA-N 470.320 0.706 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1840032876 MQCYOFTYLCHMQH-IFIJOSMWSA-N 461.382 0.253 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1 1840033574 JTPMEBIUSJXWQD-ZUOKHONESA-N 482.331 0.871 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1Cl 1840732098 KIKPJXPOIXZBCD-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011739 MUBMLMIADZQTII-UHFFFAOYSA-N 465.315 0.450 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1cccnc1 1843013087 HDJACJAKIPOJBE-HXUWFJFHSA-N 494.357 0.844 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cc3cccnn3n1)C2)NC(=O)NCc1ccccc1 1845039137 JBNXJXRDOPTIOV-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846311636 QHPXXSZGOVYFHB-IBGZPJMESA-N 473.379 0.980 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CC(=O)N3C)c2ccccc2c1=O 12969266 BZTLMEHWUTXZKA-UHFFFAOYSA-N 455.496 0.949 50 20 JCGD Cc1ccc(C)c(OCC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1 17203456 HYBJEOPVXITCFT-SFHVURJKSA-N 497.595 0.611 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2c(Cl)nc3sccn23)c1 728502456 LFADSPAJBYBEPN-UHFFFAOYSA-N 463.950 0.923 50 20 JCGD CN(C)S(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728889233 AWLKFRMBNUTGJU-UHFFFAOYSA-N 450.496 0.544 50 20 JCGD COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1 729692492 JGPMSRFLCAUUKQ-UHFFFAOYSA-N 451.530 0.743 50 20 JCGD COc1ccc(C(=O)NNS(=O)(=O)c2ccc(N3C[C@@H](C(=O)O)CC3=O)cc2)cc1OC 914746379 UNJIQBNXFRVDCP-ZDUSSCGKSA-N 463.468 0.765 50 20 JCGD Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)c2ccccc2OCc2ccc(F)cc2)cn1 915636625 XZIHXVKYYCZVSR-UHFFFAOYSA-N 461.475 0.878 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)COCC1CC1)N(S(C)(=O)=O)CC2 915639829 XFDHYTJSZAZXJW-INIZCTEOSA-N 455.533 0.527 50 20 JCGD CCn1nc(C(=O)NNC(=O)[C@@H](Cc2cccc(OC)c2)n2nnnc2C)c2ccccc2c1=O 916123250 RQFDQFKBOBDWCI-LJQANCHMSA-N 476.497 0.965 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)Cc3c[nH]c4ccccc34)n[nH]c2n1 917393588 LGJZRGHLJGDBAT-UHFFFAOYSA-N 468.547 0.768 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc3c(cc2F)NC(=O)CC3)cc1 917721522 YCGJMJFUTRFPAO-UHFFFAOYSA-N 484.531 0.649 50 20 JCGD C[C@@H](CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)Cn1cccn1 919778911 NEXKOIZYFVISOO-KRWDZBQOSA-N 478.575 0.503 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1 920297376 DXSQYZIFQWHBMW-ZDUSSCGKSA-N 484.556 0.585 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NC[C@H]1CCCCO1 920343862 DXKKDFXFXGMVLE-QGZVFWFLSA-N 454.549 0.540 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4cncn4c3)C2)C1 1778691893 VRLUXQWXDZLUHI-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3cc(F)ccc3n2)C1 1779029395 GVHILOLRIYATMX-NTKDMRAZSA-N 495.515 0.913 50 20 JCGD N#Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(Cl)c1 1779036906 IHABRMQLBJPNSE-QFIPXVFZSA-N 468.901 0.967 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1 1779593481 RDTPBAKMQKIYSJ-JOCHJYFZSA-N 455.519 0.288 50 20 JCGD O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780947331 CTIJWFJKKFAUHQ-HSZRJFAPSA-N 482.733 0.582 50 20 JCGD CCc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n[nH]1 1780969794 JQJXNJBJKXXVST-DEOSSOPVSA-N 483.573 0.762 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccnc2ncccc12 1781298308 MTZVANUGCNKIOO-PXDATVDWSA-N 474.326 0.751 50 20 JCGD C[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1781993364 HDTYBHQBAUMWHC-GEQKSPFYSA-N 461.563 0.227 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1 1782218618 KXNNWOLNQDOXLO-QFIPXVFZSA-N 483.916 0.972 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)CCO2)C1 1783875722 SLNNTLAIDMQAMP-YEJXKQKISA-N 474.905 0.268 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783934853 IIFMIDZJPUVXDF-FQEVSTJZSA-N 453.927 0.560 50 20 JCGD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784086064 SKKSYUCIRSIBBP-ZCVDQKGDSA-N 489.997 0.590 50 20 JCGD O=C(Cc1cccc(Cl)n1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785426651 BWZYMFMONGLUGC-SNRMKQJTSA-N 457.723 0.251 50 20 JCGD C=CCCc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c(O)n1 1788611530 JTLNIRKWKVFTDN-JHVJFLLYSA-N 494.552 0.811 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21 1789933873 DODSYBDIGALQNB-HCZIRCDUSA-N 451.923 0.776 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21)n1cnnn1 1791681876 CPVORKPAJJTEGC-YXMSTPNBSA-N 485.973 0.346 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792984234 ZVIAZQZJBSPPJP-FQMQPWHVSA-N 459.971 0.869 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C(F)(F)F)c1)C2)c1ccc(B(O)O)cc1 1795735119 MOLODVTVNCFOSJ-HGKCTWBKSA-N 462.233 0.902 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188247 GOWHEPMLVLPISQ-REPLKXPHSA-N 463.299 0.616 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1nccn1)C2 1798522996 MOVKMCUDAHJKLS-HBCWATKFSA-N 458.431 0.015 50 20 JCGD CC[S@@](=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798524596 GVCPLRJXUOJEMI-ILNGJMQFSA-N 481.527 0.882 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798524927 QOHLKBMZEJMGSZ-DTNKQSLVSA-N 474.470 0.414 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br)C(C)(C)O 1799350330 ORWUTTBCAAPQSN-ITGHMWBKSA-N 496.374 0.931 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2c1 1800007608 VAJXHKKHZWTZDN-KEMUROEHSA-N 463.498 0.672 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)C=CC1=O 1802541130 HFEXGNFOCLKLFE-XGUBFFRZSA-N 468.938 0.682 50 20 JCGD CCOC(=O)N(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)Cc1ccco1 1802757247 KRCNAYLQJMWDQX-ACDBMABISA-N 483.330 0.870 50 20 JCGD CN(CC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)C(=O)c1ccccc1 1805846538 WPVRZPDNYNCFGD-UHFFFAOYSA-N 477.370 0.983 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807366893 VRQBXUNAIGCEKS-LRQRDZAKSA-N 496.373 0.994 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)C(=O)N(C)C)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807452668 KQPNYYABNNSLRB-UNMCSNQZSA-N 495.584 0.522 50 20 JCGD O=C(NCC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)c1cccnc1 1809975116 UOEGMSUOAYACQK-UHFFFAOYSA-N 464.331 0.036 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302022 DPSLKDBJBAMRNG-VDGAXYAQSA-N 466.542 0.973 50 20 JCGD O=C(C#CC1(O)CCCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810326802 IZDYKDUXJRFLOM-XUZZJYLKSA-N 475.354 0.780 50 20 JCGD Cn1ncc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1Cl 1811166761 FVLDRHOUGLIBTF-VQIMIIECSA-N 467.722 0.782 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(C(=O)Cn2cnnn2)[C@H]1c1cccnc1 1811358481 GYJUMNCLNFELBA-KKSFZXQISA-N 494.468 0.921 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H](O)Cc1ccccc1 1812770804 OUMNOBQKZZNGBY-OEMFJLHTSA-N 473.338 0.685 50 20 JCGD CCc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n(C)n1 1815360599 JWIOIKQENWRQFT-OAHLLOKOSA-N 453.333 0.658 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3[nH]nc4ccncc34)sc2C1)c1cccc(B(O)O)c1 1816857742 NKHZARPWRJSJEQ-ZDUSSCGKSA-N 462.300 0.634 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=N/N2CCCCC2)[nH]n1)c1ccc(B(O)O)cc1 1817472563 XCKJRCFFACRZMC-WWJLXRQJSA-N 452.324 0.867 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2n[nH]c3c2CS(=O)(=O)C3)n[nH]1 1817684624 OVPOPWQQGSNNFT-HNNXBMFYSA-N 492.562 0.240 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1 1818112167 VEZGCELOOZURCJ-GIEPYWIESA-N 453.467 0.223 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3nn(C)c4c3CCC4)sc2C1 1818476240 IYVCGYDTZGIWOK-GFCCVEGCSA-N 459.576 0.964 50 20 JCGD CC(=O)O[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(C)C 1819247886 RMVLPFSJZFUKGJ-QUCCMNQESA-N 456.308 0.983 50 20 JCGD CC(=O)O[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)C(C)C 1819797846 MJMXBAUSRYUUDA-YVEFUNNKSA-N 474.543 0.955 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nn[nH]c1C(F)(F)F)CC2 1819798090 VEHUYLOVJHMBSN-ZETCQYMHSA-N 495.447 0.818 50 20 JCGD Cc1c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](O)CCl)CC3)cn2[nH]cnc(=O)c12 1821217313 FMCLBUKAFGEZHK-JOYOIKCWSA-N 450.908 0.613 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(C)C(=O)C(=O)O)n[nH]1 1821712669 DSJIISIUILMYJU-JQWIXIFHSA-N 458.313 0.976 50 20 JCGD CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)nn1 1821754496 RWVMMKFTTRNJOU-AWEZNQCLSA-N 467.316 0.551 50 20 JCGD O=C(Cc1ccc2ncnn2c1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1822496118 JJUKLASEZVLOEI-INIZCTEOSA-N 476.327 0.334 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)CC1 1824899744 FSBVOANTDMROBA-GTPWMTBTSA-N 485.545 0.292 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(CCO)CCO)CC2 1825451738 PWVUWMGYNSNEAM-RYUDHWBXSA-N 463.398 0.515 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CS(C)(=O)=O)CC1 1826627183 NXUXJXSHGDOCKO-MMTNMYCKSA-N 465.576 0.785 50 20 JCGD O=C(c1cc(=O)nc2cccnn12)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057458 FVOXBCFMCXGEKM-HXUWFJFHSA-N 489.341 0.316 50 20 JCGD CC(C)(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cn1 1829567415 OWLYFYYGYGXFJF-RUZDIDTESA-N 481.358 0.443 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ccc(Cl)cc3[nH]1)CCO2 1829613993 KLOPQBYQYNMCKX-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn(C)c3=O)C2)C1 1830536126 YMIGOOKEHWUIIE-KUHUBIRLSA-N 456.337 0.486 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830737432 HMWIQSYTESBQMH-CVDCTZTESA-N 498.960 0.723 50 20 JCGD Cc1cncc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1832963209 VFADXVMRLAIWQG-HSZRJFAPSA-N 461.563 0.152 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CN3CCOCC3)CC2)CC1 1834619496 TXRMYNAQPKEHSL-MRXNPFEDSA-N 459.429 0.921 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)C1 1834819456 SKYIHOPHIVHKJU-OAQYLSRUSA-N 497.390 0.773 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)[C@@H]3SC(=N)NC3=O)CC2)CC1 1835113819 KHFIQZAXVJNDKO-KCXAZCMYSA-N 474.027 0.614 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3[nH]nnc3C)CC2)CC1 1835117673 KMHGPOAEIFNVPH-MFKUBSTISA-N 469.550 0.432 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835117823 NSBOTKYCMQXBLK-UEYIPHHSSA-N 488.593 0.139 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(=O)oc3)CC2)CC1 1835118398 YKFUPJPPKVJPAQ-JVWAILMASA-N 482.541 0.959 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(CN(C(=O)CC3CC3)CCO2)C1)NC(=O)NCc1ccccc1 1835220466 HAQJMFJKCZSGDE-DEOSSOPVSA-N 473.574 0.589 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1 1835645145 UYRQRUVDDDXRRH-IBGZPJMESA-N 458.632 0.474 50 20 JCGD Cc1nnc(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)s1 1835737041 SYOPGLCIARZWAF-UHFFFAOYSA-N 486.602 0.273 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccccn3)CCO2)C1 1836187818 ZEOCORWTDMNNBN-OINMWHHXSA-N 468.514 0.215 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)n3ccnn3)CC2)CC1 1836513689 NLVQHETWDMBYIK-DCMOEJRUSA-N 483.577 0.545 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1836671257 SOGDZGZQOCABEU-XJKSGUPXSA-N 461.401 0.609 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)no1 1837549360 RLNIUOLTYCARPU-MOPGFXCFSA-N 477.345 0.406 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CCNC3=N)CC2)CC1 1837862786 JSLBXDIWLRVSTL-MRXNPFEDSA-N 458.401 0.998 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)sc1C 1838408068 PKQGVBIWICKTMQ-OAQYLSRUSA-N 474.543 0.142 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnnc3)C2)C1 1838526728 AXMPCDUVQNJWCD-JOCHJYFZSA-N 485.453 0.694 50 20 JCGD O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1838627561 GBRHQUGHZKHUGG-MAUKXSAKSA-N 459.814 0.928 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C)CCC3)C2)C1)NC(=O)NCc1ccccc1 1839054427 YUQXMMAJCTUUFO-VWLOTQADSA-N 487.601 0.979 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2)C1 1839141940 YOVKIAVPTGOLHH-CKJXQJPGSA-N 477.986 0.736 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])CCO2)C1 1839234187 XXSMFJRMYRAXKO-LAUBAEHRSA-N 485.921 0.856 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccn3nccc13)CCO2 1839538771 JEAXAYPHNSAEFW-FXZATJRASA-N 493.524 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1 1839982548 ZJJDOWAICQQUHF-QHCPKHFHSA-N 489.479 0.276 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)CCO2 1840370200 MQFABNJILNRHBK-DBXWQHBBSA-N 469.970 0.321 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1 1840647994 ZGFCCMXUTLMULG-KSSFIOAISA-N 458.284 0.546 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCCC34CN(C(=O)[C@@H](F)Br)C4)n2)CCCN1 1842305182 WPPQKIBFGVCNKC-MRXNPFEDSA-N 468.327 0.915 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CC4(CCCN4C(=O)CCBr)C3)csc2n(C)c1=O 1842638826 LRZWFNQKMLLPLI-UHFFFAOYSA-N 483.388 0.830 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1847070420 XYGPVHCPOSOFDS-GOSISDBHSA-N 455.320 0.100 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1847080339 YVNGOPZSPZYKGW-JCGIZDLHSA-N 484.557 0.900 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H]1CC=CCC1)c(=O)n2Cc1ccccc1 10161604 BMFIWQDKKGFVCG-GOSISDBHSA-N 480.525 0.558 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)c2ccccc2c1=O 17189946 RRTZRYZVNBPARP-UHFFFAOYSA-N 455.496 0.932 50 20 JCGD CCn1c(SCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)nnc1N1CCOCC1 26612618 LKGMJBRVFJZMAS-UHFFFAOYSA-N 450.521 0.705 50 20 JCGD C[C@H]1Oc2ccccc2N(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1=O 728213379 ASLIYMSJZGBTFA-MRXNPFEDSA-N 473.555 0.880 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCNS(=O)(=O)c3ccc(F)cc3)cc2)CC1 728213801 JLUUUJZZZRQRAG-UHFFFAOYSA-N 499.590 0.574 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1 745992220 WPFREJPPSJFOKN-UHFFFAOYSA-N 481.575 0.384 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1)c1cccc(S(=O)(=O)N2CCOCC2)c1 915802890 WIYMPSGZEGYVEV-SFHVURJKSA-N 493.586 0.396 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCCCn1cccn1)N(S(C)(=O)=O)CC2 916376780 HKDUZCCYOLBPJZ-KRWDZBQOSA-N 494.574 0.570 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@H]1CCN2CCC[C@H]2C1 916572538 AVJXUCJNYXXVQH-IRXDYDNUSA-N 451.549 0.278 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NC[C@H]1CCN(C2CC2)C1 916577944 NBLNEWLLWJKSCU-GOSISDBHSA-N 479.603 0.455 50 20 JCGD CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 916644966 HJBGXQLFJZEOHE-UHFFFAOYSA-N 489.554 0.601 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccnc1N(C)C)c(=O)n2Cc1ccccc1 918254927 GXYQEHUBWUWVNX-UHFFFAOYSA-N 490.524 0.350 50 20 JCGD Cc1nccn1-c1ncccc1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 919780058 ZXVNHTAASKGZHE-UHFFFAOYSA-N 485.574 0.733 50 20 JCGD CCCn1c(=O)nc(O)c2c(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc(C(C)C)nc21 919889628 QFVLISZSQHYOSU-NSHDSACASA-N 466.520 0.162 50 20 JCGD Cn1c(C[C@@H]2CCS(=O)(=O)C2)nnc1SCC(=O)NNC(=O)c1ccccc1Cl 1317708175 ASIODHRGWYGPPN-NSHDSACASA-N 457.965 0.999 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1c(F)cncc1F 1779843008 WLNWDWOYRMFQJX-XMSQKQJNSA-N 459.258 0.481 50 20 JCGD CNC(=O)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1780054759 QQWBCKPOGGITGJ-XMSQKQJNSA-N 476.486 0.784 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnccn3)CCO2)C1 1780095383 OEGDLMXXBNSPDO-JOCHJYFZSA-N 469.454 0.996 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1780328471 OMBISQHRMQGEHP-FQEVSTJZSA-N 453.927 0.560 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)CC[C@H](N)C(N)=O)CCO2)C1 1782864516 NFLBLTVNVWGAGU-XYAYVLSKSA-N 461.469 0.294 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)CC1 1783216815 UMZYJKIEWSFAPG-QHCPKHFHSA-N 487.557 0.116 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)NS(=O)(=O)c3ccc(C)cc3)CCO2)C1 1783870885 IFUUZGIVCMZNND-YRISNDGFSA-N 488.006 0.746 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784092424 NUCNWNXULOYBAR-FRJURHEUSA-N 454.911 0.854 50 20 JCGD CCOC(=O)N(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)Cc1ccco1 1784095420 GGBCLSRIAMWNPN-DKIMLUQUSA-N 471.938 0.818 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1 1784237634 YMNHRTCWSQNXMC-JYFHCDHNSA-N 477.370 0.475 50 20 JCGD O=C(c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2 1785245625 NGRMEOQLKZWUOA-XLIONFOSSA-N 489.953 0.685 50 20 JCGD Cc1ccn2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]43)c2c1 1787373823 PZMYLWJMLNPNCN-QRFRQXIXSA-N 456.547 0.609 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21)[C@@H](F)Br 1789926840 HMIHHGDVIOSBRC-AVWBDOJWSA-N 468.370 0.517 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1791149900 LSIHOIHBJBYBCR-CIJWOSIWSA-N 482.317 0.821 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccnn1 1795892345 WJZKWDQCZCGTCI-HBCWATKFSA-N 458.431 0.015 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)CCOC1 1796191729 SITVMMFHKJQXNC-YDLHNXBPSA-N 487.362 0.302 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O)C2 1796892052 DCQUZPLIYSGAAF-BRFYPRMVSA-N 473.559 0.561 50 20 JCGD COC1(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)CN(C(=O)OC(C)(C)C)C1 1797153033 LIHNYTPPOSZONW-IVSAIRAKSA-N 475.970 0.202 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)s1)C2 1797748639 OOYMYMMENRFUTN-KSPBDQMDSA-N 463.947 0.846 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)C2 1798442158 YYWUQTGDYVQZQF-BTTYYORXSA-N 454.443 0.865 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])cc2c1OCC2)c1ccc(B(O)O)cc1 1799214482 DCKRDRIAFVEQTL-BCDXTJNWSA-N 465.271 0.775 50 20 JCGD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1NC(C)=O 1799321454 IQYAHGPKZHQQPT-ACDBMABISA-N 465.315 0.899 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccsc2[nH]1 1799940012 FKRCVRVIRFAUOX-FVCICTRLSA-N 454.512 0.745 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)n2ccnc2n1 1799987911 HFXFPFXVTMGKME-JRADWPLCSA-N 478.513 0.375 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCOCC1)C2)[C@@H](Br)Cc1ccccc1 1800435786 NRCXNOLHMFMUBD-JTJHWIPRSA-N 480.403 0.914 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nnc(Br)n3c1)C2 1800975820 UIYARLRGLUYTEB-XFMPKHEZSA-N 486.754 0.949 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=COCCC1)NC(=O)NCc1ccccc1 1801048210 DOXOBVMVJKAJBD-VTYHHJSWSA-N 471.558 0.617 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)C3=NN(C)C(=O)CC3)C2)CC1 1806622375 GBCHQORNEOOJFV-PCLIKHOPSA-N 469.546 0.960 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C2CCC(CO)CC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360403 AXKFLAHUYLIGHV-HIYLJXDJSA-N 465.359 0.880 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1 1808297487 QPEQUAAHOFZXSU-WTBDCCNDSA-N 492.496 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc3c2NC(=O)C3=O)[C@H]1c1cccnc1 1810025717 JSSHXOIMOSIZCF-OPAMFIHVSA-N 492.536 0.909 50 20 JCGD CN(CC(=O)N1CCC2(CCCN(C(=O)Cn3cncn3)C2)CC1)NC(=O)NCc1ccccc1 1810148912 VTVLJKLDDKNESC-UHFFFAOYSA-N 482.589 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)CC1 1810259844 CHRRYBRXQTZCIA-UHFFFAOYSA-N 480.591 0.056 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)n3)C2)CC1 1810893482 UODURCOUPLJDEK-UHFFFAOYSA-N 455.475 0.045 50 20 JCGD O=C(CN(CCO)CCO)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1812713146 HBFUFPRKRAQCDC-QFBILLFUSA-N 457.369 0.159 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](COC(C)=O)OC(C)=O)[C@@H]1c1cccnc1 1813030264 AIDLXVSXVKEJOA-CADBVGFASA-N 469.922 0.836 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)N1 1814875401 YILUOVJUVFPZHM-SPWCGHHHSA-N 498.993 0.182 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)[nH]n1 1818111651 YNMFTPVKKUOLOE-FCUAXUHVSA-N 483.489 0.088 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ncccn1)CC2 1819793109 KTKBTRIYGNFSAH-NSHDSACASA-N 452.500 0.400 50 20 JCGD O=C(Cc1ccc2ncnn2c1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1820698645 NXJDAUNNOIXOBU-LJQANCHMSA-N 473.302 0.681 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1826893008 UWDZMEIQNVQBAK-NRFANRHFSA-N 454.380 0.882 50 20 JCGD O=C(c1cn2cccnc2n1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057357 CPBVPLKMIUJHON-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])CC1 1827646778 MASMJXDSDDXDJN-MRXNPFEDSA-N 470.490 0.864 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3n(n2)CCNC3=O)CC1 1831872483 ZCBVMAYHIHQDFT-SFHVURJKSA-N 473.578 0.233 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccs3)CCO2)C1 1833157003 BEWBRANLNUTIPS-JOCHJYFZSA-N 473.555 0.449 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccs1)CCO2 1833934188 YSFBQILLAGCOKF-VQYZLWMVSA-N 459.528 0.952 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CCn3cncn3)CC2)CC1 1835118097 PLPXMJPYHQINKX-OGLMXYFKSA-N 483.577 0.374 50 20 JCGD Cc1nscc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737163 QUOQYEDBIAIHTM-UHFFFAOYSA-N 471.587 0.949 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1835934303 UWTIJNGOIRUDEQ-PPJWLVRDSA-N 494.353 0.249 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n(C(F)F)n1 1836164473 KSTBVTWAFIJZJI-UHFFFAOYSA-N 489.332 0.765 50 20 JCGD CCn1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c2ccccc21 1836339818 QWSNVPWJQLVFJW-UWJYYQICSA-N 450.923 0.726 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)C=CC3=O)CC2)CC1)[C@@H](F)Br 1836414505 OGEQZRHUBKXEKQ-QGZVFWFLSA-N 459.316 0.174 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837143630 QDCUVRSXWAZMFX-QFIPXVFZSA-N 499.553 0.087 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837576834 BOONHENZLHUUEB-SKELBMGJSA-N 468.315 0.441 50 20 JCGD Cc1nn2cc(CC(=O)N3CCOC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)nc2s1 1837710219 PAFUQXQALFTLFT-FQEVSTJZSA-N 481.651 0.950 50 20 JCGD O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838524433 MEPRUWWPFJQLKT-JXFKEZNVSA-N 469.878 0.199 50 20 JCGD COc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1OC 1839202028 RJFZDHAATZWAPI-QAPCUYQASA-N 476.299 0.859 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1 1839203636 QOQMDVVALDGPCP-SJCJKPOMSA-N 453.305 0.723 50 20 JCGD O=C(c1ccc(Br)cc1O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839268482 SZPZECITGCJRIQ-CRAIPNDOSA-N 477.739 0.824 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839652006 XTITVZABHFTVAS-DNVCBOLYSA-N 471.352 0.745 50 20 JCGD CN1CC(C(=O)N2CCOC[C@]3(CN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)CCO3)C2)C1 1839743685 LZGHKABTEKSLSW-NYRBYKDPSA-N 460.481 0.890 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840110943 NAIOOUSXSCMGFA-HNAYVOBHSA-N 473.935 0.743 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1 1840185528 SWNBEZCSNAUFRV-HSZRJFAPSA-N 472.546 0.016 50 20 JCGD CSc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1840303596 VUCKOYWJYTYOTA-DEOSSOPVSA-N 499.593 0.720 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc(OC)c1C 1840756158 LFJVSITVYTVWKO-DEOSSOPVSA-N 492.573 0.455 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1 1845939574 AAKKFZAKRQQKOA-UHFFFAOYSA-N 464.588 0.599 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1846213669 SRRYHLWLGWGKLT-OAHLLOKOSA-N 483.566 0.019 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCOCC3)c2)cc1OC 15793293 JPSKBKXMMWQUAS-UHFFFAOYSA-N 467.475 0.939 50 20 JCGD O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12 18017737 BBBYTEVOPBQAKT-OAHLLOKOSA-N 460.493 0.899 50 20 JCGD C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 26068327 ZQAAEIBJOIDSRS-UHFFFAOYSA-N 469.567 0.571 50 20 JCGD COc1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1S(=O)(=O)NC1CC1 725742018 XWLBMZVKQJEPMI-UHFFFAOYSA-N 452.514 0.388 50 20 JCGD O=C(NCCCN1CCCS1(=O)=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 726276413 FDKRDLMCIAOKBC-UHFFFAOYSA-N 487.604 0.231 50 20 JCGD COc1ccc(C(=O)NNS(=O)(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1OC 726764542 GYZVKGWLXGSXLP-UHFFFAOYSA-N 455.514 0.867 50 20 JCGD CCOc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1C(=O)O 727720610 SCKFQFVYUHEYCJ-UHFFFAOYSA-N 456.502 0.700 50 20 JCGD Cc1cc(=O)c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nn1-c1ccccc1C(F)(F)F 728385129 KXMFAZRPOLVHSG-LLVKDONJSA-N 458.418 0.755 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccnc(F)c1)c(=O)n2Cc1ccccc1 748706969 OOSPDZUTVNLFIK-UHFFFAOYSA-N 495.471 0.050 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c1cccc(C(C)=O)c1 784679595 LGPJGOCCWPNXRD-UHFFFAOYSA-N 497.913 0.834 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)[C@H]1CCS(=O)(=O)C1 788023830 OXBRLLLBDWEZNQ-QMMMGPOBSA-N 477.870 0.219 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 895020805 MOADARGWGQZWSJ-UHFFFAOYSA-N 462.484 0.544 50 20 JCGD COCCN1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1=O 914457222 UBGHBDNTZHGWAU-INIZCTEOSA-N 452.533 0.117 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1C 916567458 HGRHSBCPUNVYLW-UHFFFAOYSA-N 454.530 0.502 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NC[C@@]1(N2CCOCC2)CCSC1 916636436 CFHLBONPUVLTDM-QHCPKHFHSA-N 476.647 0.737 50 20 JCGD C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 917723206 AYLCQNHYURHTDW-UHFFFAOYSA-N 451.530 0.519 50 20 JCGD COc1cc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc(C(=O)O)c1OC 917738006 YCVZERICQXWFJE-UHFFFAOYSA-N 458.470 0.429 50 20 JCGD CCCCN1C(=O)C[C@H](C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)[C@H]1c1ccc(OC)cc1 919886576 XPFRPBMELUZUQL-VDZJLULYSA-N 466.560 0.902 50 20 JCGD O=C(NNC(=O)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12)N[C@@H]1CCS(=O)(=O)C1 919889703 RTIYEFFGOLVYCV-QWQRMKEZSA-N 456.521 0.234 50 20 JCGD CCn1c(SCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nnc1-c1cccc(C)c1 919889803 UOGJRYIKCINNJA-AWEZNQCLSA-N 452.562 0.883 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1 1779031258 POPGMDWFFKTRDG-JOCHJYFZSA-N 456.478 0.380 50 20 JCGD Cc1cc2nc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)[nH]c2cc1C 1779032563 TYCXUUSVTNYGJQ-XMMPIXPASA-N 477.525 0.936 50 20 JCGD Cc1nc[nH]c1CSCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779287624 BGXBAVZJJQFRBD-NFBKMPQASA-N 486.403 0.459 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779310109 HYCBYLLVXFKSHY-MRUHUIDDSA-N 490.985 0.100 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Cl)C2 1780543907 BTBNVDUNOXUSNG-ZXYWRSMDSA-N 458.943 0.940 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc[nH]1)CCO2)NC(=O)NCc1ccccc1 1780968975 RMPKNWQDHPXGDI-HSZRJFAPSA-N 454.531 0.804 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1781861243 PAIRXIRZKUTCQQ-OCBCSQNSSA-N 454.351 0.896 50 20 JCGD COc1cc2c(O)cccc2cc1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1782390013 JXMTWVNYMNNVSR-AREMUKBSSA-N 490.321 0.991 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(F)c(F)ccc4c3)C2)C1 1782468698 YRAYZMQTIRYHPU-XMMPIXPASA-N 481.264 0.950 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)CN3CC(=O)NC3=O)CCO2)C1 1782864156 RHBHCYUZGHJIMQ-CMBCZCRSSA-N 473.436 0.253 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)Cc3cccnc3)C[C@@H]21 1783965984 YFAGZOFJALHWAW-HILJTLORSA-N 453.381 0.962 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)n3)[C@H]2C1 1788877433 OYESHGKPZVSVTH-PJODQICGSA-N 459.894 0.036 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncccc3F)[C@H]2C1 1789051876 FKKRJVMDIIKREO-XGBLWMCESA-N 456.478 0.948 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1 1789222304 QOYDLSMLKFIZNO-KUZCPNRJSA-N 491.501 0.560 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc(OC)c1C 1792045285 QGHDNSBCDQVXJS-NYDSKATKSA-N 482.342 0.599 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)C(C)(C)C)NC(=O)NCc1ccccc1 1792917860 SJVYOWRPBGBCAP-KOUHRCEDSA-N 475.590 0.329 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1noc(C(C)C)n1 1793997330 UYPVKWYYTYJISV-DHMDNZFNSA-N 471.518 0.459 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nccnc1C(N)=O)C2 1794142554 TVCCVEDPSATCBP-CRWXNKLISA-N 480.953 0.959 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCOCC2)cn1)c1ccc(B(O)O)cc1 1794766678 CYCRLUSPAQUTPR-ACDBMABISA-N 464.331 0.164 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188516 PLQNDNMBPYWBNR-REPLKXPHSA-N 475.351 0.160 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1800714857 DNUFOTMZRROJHU-TXPCXHQGSA-N 471.982 0.823 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)C2 1801012078 ASKOOSANVQTDCD-XARGGIHNSA-N 471.602 0.614 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2 1802128094 NBLUQBVXCWIQHQ-BPKGMFCQSA-N 457.955 0.746 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)C1 1803131366 SZYVHTHBWZKXSC-LZKITUNOSA-N 494.552 0.989 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CS(C)(=O)=O)[C@H]1c1cccnc1 1806765931 HIPLGNYUYOEVQU-FTVRPSQGSA-N 474.543 0.266 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1808592601 VPTDDDAGRFEESL-XMSQKQJNSA-N 488.309 0.576 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(CO)on2)[C@H]1c1cccnc1 1811591297 ALPWYZNHOGJLGK-IFXJQAMLSA-N 465.470 0.194 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2nc3ccc(F)cn3n2)[C@H]1c1cccnc1 1812291365 AAWUYDVEGQJKCG-HRAATJIYSA-N 482.520 0.956 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1)c1cc(=O)n2[nH]nnc2n1 1817816247 AAMKKMWVQAUFCI-SKDRFNHKSA-N 468.247 0.532 50 20 JCGD Cc1cc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)nn1C 1819793822 UCOFWVSMUVXLBP-LBPRGKRZSA-N 468.543 0.652 50 20 JCGD Cn1nc2c(c1C(=O)N[C@H]1CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C1)CCC2 1819800840 SCRJIHMWAAMYTN-NSHDSACASA-N 480.554 0.903 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1)[C@@H](F)Br 1820932950 WADSRXJXOMXOSQ-BXKDBHETSA-N 468.247 0.532 50 20 JCGD CCCNC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1824403328 LEXQKISOHMYVDS-NRFANRHFSA-N 457.380 0.906 50 20 JCGD Cn1cccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1=O 1824714852 BQRRKULUBPGVLR-NRFANRHFSA-N 451.332 0.612 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)C(F)(F)F)CC2 1826089667 KZSWTRFVLORXJR-VIFPVBQESA-N 464.470 0.107 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCNC3=O)CC1 1826199187 YDGJTLYWNJNLIZ-IBGZPJMESA-N 494.556 0.172 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2 1826644672 YNQUOUMBYYFDBB-GDLCADMTSA-N 454.940 0.125 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1 1828926788 RXJIFRIRPKOYAK-QGZVFWFLSA-N 469.502 0.433 50 20 JCGD CN1CCN(C2(C(=O)N3CCOC[C@]4(CN(C(=O)C(C)(C)CCl)CCO4)C3)CC2)CC1 1830364022 XSPAWTUMHYOMPP-NRFANRHFSA-N 457.015 0.488 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830719999 QQJPVVFPMJSBKK-QNFHRHJVSA-N 489.997 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCCC1(F)F)CCO2 1831718457 FIJLSRNLGWQRAY-UWJYYQICSA-N 481.500 0.581 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3Cc4ccccc4C3)CC2)CC1)c1ccc(B(O)O)cc1 1834800513 IWOLTAODHBQJDR-UHFFFAOYSA-N 475.398 0.967 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@H]1Cc2ccccc2CN1 1835085753 PDJWHKWWGFJAOY-RUZDIDTESA-N 490.413 0.266 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCC(=O)NC3)CC2)CC1 1835116673 XHPKYHMDRIQZQG-SSGLAOATSA-N 485.589 0.218 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc2nc[nH]c2c1 1835557190 WUNFXMNYAPXKHY-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2 1835682462 KQPJPJAARLWGJA-KXBFYZLASA-N 459.385 0.898 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)/C=C/c3cnc[nH]3)CC2)CC1 1835738310 UXSFONCBQUOUMT-OWOJBTEDSA-N 466.546 0.307 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835933826 GQCKMEYXXIZVOF-CLOONOSVSA-N 466.343 0.315 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1835934302 UWTIJNGOIRUDEQ-JCYRPKCISA-N 494.353 0.249 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cccc1C=O)CCO2 1835953634 FOCQOONMILPBQB-BZRUEVBDSA-N 498.540 0.452 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C2)C1 1837456458 NADFVNRFEZFRAR-CBNMVNINSA-N 497.474 0.488 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1OC 1837460082 TWCULCOKMISCIR-XMMPIXPASA-N 499.524 0.086 50 20 JCGD Cc1nn[nH]c1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838001650 OUBKFAONHVCLSY-UHFFFAOYSA-N 456.507 0.038 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)Cc3ccncc3)CC2)CC1 1838394772 VREHMQMHGVIETA-UHFFFAOYSA-N 466.542 0.935 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)C3CC3)C2)C1 1838526745 BGIOUGRUSAQLJN-QFIPXVFZSA-N 475.454 0.569 50 20 JCGD O=C(c1ccc(OCCCO)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838545848 ZEPDSPSGMVEXFO-WIYYLYMNSA-N 456.923 0.118 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1 1838760079 HUXOHUFOZWYHEB-FZKQIMNGSA-N 458.357 0.887 50 20 JCGD O=C(c1cc2n(n1)CCCO2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201368 VTBNUKLGUABFMO-WMLDXEAASA-N 461.288 0.426 50 20 JCGD Cc1cc(F)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839285244 WZJLQPCPOIZNOU-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ccoc4cn3)CCO2)C1 1839485792 XMBFRPNTXNOQCX-HSZRJFAPSA-N 480.481 0.210 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nn(C)c(C)c3Br)C2)C1 1840154589 ZYSPLLBJNSSTCQ-SCLBCKFNSA-N 493.786 0.815 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4C3)C2)C1 1840184836 GAMNWJMTTUWDRF-PXDATVDWSA-N 472.586 0.621 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185082 IDJQKYGALIZRDY-JPYJTQIMSA-N 461.563 0.090 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2s1 1840185123 JWZZFSSVGFQDEG-JOCHJYFZSA-N 477.587 0.981 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)C2)C1 1840185263 NIEKHIFSMVGIGH-JXALWOEJSA-N 458.559 0.620 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)C1CC1 1844264189 QTNKIBCNYOHKKD-KRWDZBQOSA-N 472.546 0.805 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc(OC3CCOCC3)n1)C2 1844264519 ATUQLMBNXBFLQJ-UHFFFAOYSA-N 480.525 0.769 50 20 JCGD CC(=O)NCCCC[C@@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1845875710 NWNVWSJZWUWGRH-UXHICEINSA-N 493.004 0.895 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1 21969727 AIQOCMCNUOQGNU-UHFFFAOYSA-N 457.512 0.538 50 20 JCGD COCCCNC(=S)N(C)NC(=O)c1ccc(N2CCN(C(C)=O)CC2)c([N+](=O)[O-])c1 726075931 JPTMCLDIPQNUQV-UHFFFAOYSA-N 452.537 0.751 50 20 JCGD Cn1c(=O)nc(O)c2cc(S(=O)(=O)NNC(=O)c3ccc(COc4ccccc4)o3)cnc21 727749244 UODCQHKITXDZDW-UHFFFAOYSA-N 471.451 0.829 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1 728381563 OPXXWWUNCQMLGD-DOTOQJQBSA-N 471.557 0.015 50 20 JCGD CCCCN1C(=O)C[C@H](C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)[C@H]1c1ccc(OC)cc1 728385112 KLFHWQBERLZDOC-HHXXYDBFSA-N 451.545 0.967 50 20 JCGD COc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)CC2=O)cc1 728730340 MPRJANKPRPZVGI-OAHLLOKOSA-N 460.512 0.742 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728845153 DGEZTJVXWULAML-AQDCRGGLSA-N 491.552 0.644 50 20 JCGD CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1Cl 751208251 BCKTZYBCCPMAAM-UHFFFAOYSA-N 460.921 0.774 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)cc1OC 913200769 OJUGCZTVJOFXEI-INIZCTEOSA-N 487.444 0.267 50 20 JCGD CN1CCN(CCCNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)[C@@H](c2ccccc2)C1 916484503 AIXFFNXBIYBZHZ-OAQYLSRUSA-N 463.546 0.985 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 916986730 JQTRCHSVARUPRD-UHFFFAOYSA-N 475.571 0.569 50 20 JCGD CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1)C(=O)C(=O)O 1780717150 XPRWYIDFHNWRMD-NXOUGTEYSA-N 452.335 0.280 50 20 JCGD O=C(O)c1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)ncn1 1780770893 IJHIYUANYOMNNC-IIYDPXPESA-N 459.272 0.993 50 20 JCGD Cc1[nH]nc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)c1F 1780968490 AWJLKOOICFHRFI-HSZRJFAPSA-N 487.536 0.647 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)c3cccc(Br)c3)C2)C1 1780974027 MSZYGJXWLGFGGV-CTNGQTDRSA-N 497.390 0.685 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCO2 1782869730 IIKOAWISFRWGDF-YMSBAQSPSA-N 489.370 0.909 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1782969088 RHOULOCTTGUPGO-QFIPXVFZSA-N 471.250 0.100 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2 1783533257 SWEMESAVEHAFOU-LPMFXHHGSA-N 477.400 0.842 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1 1783538131 UCBYYRBBEHRJNG-YLJYHZDGSA-N 495.411 0.686 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CS(=O)(=O)c3ccc(C)cc3)CCO2)C1 1783876872 SKILSDQAXRWKBJ-XLIONFOSSA-N 458.964 0.852 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CCO2)C1 1783933674 VISBTEFHOQPNIU-JOCHJYFZSA-N 461.519 0.730 50 20 JCGD CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783939222 BAXQCXKGVWYLLT-UZUQRXQVSA-N 483.610 0.883 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)[C@@H](O)C1 1784084469 TUJPIUKPJNQJKP-QQCJEOGWSA-N 489.997 0.184 50 20 JCGD O=C(Cc1ccc(Cl)s1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785108235 ZEUVJCCFSPKXAU-WBAXXEDZSA-N 462.764 0.917 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1785321145 PGQBGIXWRRZZLV-IQUTYRLHSA-N 466.000 0.672 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(N4CCOCC4)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786984977 FSCURQXNLWGVSN-OYDLWJJNSA-N 493.369 0.110 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3CCN(C)CC3)C[C@@H]21 1787507418 TZCAOACBSUFHSD-HDHADGOUSA-N 472.590 0.832 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCCC3)C[C@@H]21 1787508736 JZSMECYDHLNYLY-RWRPXTCXSA-N 458.563 0.586 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cc(C)on3)[C@H]2C1 1788671315 ADGULGGOQYVRTF-YXWQFLTLSA-N 471.352 0.866 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)nc4cccnn34)[C@H]2C1 1789201688 YGQKTAITKHRMIX-ABHRYQDASA-N 464.320 0.466 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)cc3F)[C@H]2C1 1789646352 FZJGUOQDBXCIOH-KHDYIWLOSA-N 459.453 0.870 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H](O)CNC(=O)OC(C)(C)C)[C@H]2C1 1789935830 KSZCMOKOOOSUJT-WOYTXXSLSA-N 477.986 0.496 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1790180638 DDJWYQNHXLJQCA-WFDGFOOXSA-N 475.546 0.109 50 20 JCGD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)N1CCN(C)CC1 1790438647 USCPRYFIYSDGGH-SFHVURJKSA-N 464.375 0.750 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792975319 NSPDGKBHHKOSGH-VPEYGQHGSA-N 459.971 0.965 50 20 JCGD Cc1nn2cc(CC(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)nc2s1 1793902921 WDTMPLCBNQBHFO-VBUUOAMHSA-N 453.333 0.274 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1cccnc1 1793956030 ANWMSQVNDXOOJJ-JJAZEVLHSA-N 453.337 0.432 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC[C@H]1CNc2ccccc2C1 1795649273 TVBIHSQOJPUUES-SYSFZUQMSA-N 492.580 0.953 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(Cl)c1OC 1795732636 FJXOECUKXYYWPO-YVWYUNDQSA-N 488.733 0.554 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796193171 QFCUSTHUKCNYFF-BCDXTJNWSA-N 455.251 0.908 50 20 JCGD COc1cccnc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796439421 BVHLZJNQQQDTMZ-HNAUYISWSA-N 482.541 0.746 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(I)cnn1C 1796747169 DQTUOXILTBHLLA-LSCVPOLPSA-N 496.733 0.482 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(Cl)cc1)C2 1797748579 JUSAYDUOROFOFC-ZSBFGKGUSA-N 471.901 0.425 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C(F)(F)F)CCC1)C2 1797750698 PBNXHBORVDJEQG-JJLQDPRZSA-N 455.437 0.621 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)ccn1 1798123593 XYPBUUHOUCRSCP-JHDGKUDLSA-N 496.568 0.640 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798269576 ZILQNZAZIODAIO-AJYBTWMASA-N 490.561 0.035 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccn(C)c1=O)C2)NC(=O)NCc1ccccc1 1799865650 GMIKTFGRZFKRCQ-ACDBMABISA-N 480.569 0.983 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]13C[C@@H]1CCN3C(=O)OC(C)(C)C)C2 1801012321 VMAAQACICDNYBY-SLMNMNMESA-N 493.605 0.349 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807359053 DJJQENSWBCPVJV-PZJWPPBQSA-N 466.347 0.243 50 20 JCGD COc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1807360665 CRPGKOXMJQVDOB-GCJKJVERSA-N 460.299 0.798 50 20 JCGD COc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(F)c1 1807361796 HUEGDDBNFXBZJT-JTSKRJEESA-N 478.289 0.938 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374025 WMPMPQUORAAEKW-AUSIDOKSSA-N 461.331 0.664 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1 1808175501 IBMMKVRTVXTQPR-JTSKRJEESA-N 464.530 0.817 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1 1808285427 BOKGIKXOMNRFPM-SUMWQHHRSA-N 476.440 0.510 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810293493 FGMWGVDPQSSWFM-VQIMIIECSA-N 467.530 0.314 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1812864206 GDJHPOZTLOALTH-GZCFXPHUSA-N 452.309 0.469 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813073651 NADMXYDXBZRMSQ-WRWLIDTKSA-N 461.567 0.168 50 20 JCGD COc1ccc([C@@H](O)C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1 1815347695 KZPWXLKMPOYXAD-OXJNMPFZSA-N 481.339 0.791 50 20 JCGD Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nc2nccn12 1815348136 FCLDFKGIFNDUEC-OAHLLOKOSA-N 476.327 0.714 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1)[C@H]1SC(=N)NC1=O 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CS(=O)(=O)c1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1 1830182071 DRAMXILLOUASOA-GOSISDBHSA-N 465.355 0.964 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](NC(=O)OC)c1ccccc1)CCO2 1830416278 ZDHUAGBJNIQXKE-HMFYCAOWSA-N 483.949 0.794 50 20 JCGD O=C(Cc1ccc(F)cn1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834834393 BXMRRFKRLZVBKM-UHFFFAOYSA-N 468.338 0.328 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3)CCO2)C1 1834951251 WQSBNIIBXQVRBF-PSQINSSGSA-N 483.525 0.656 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)ncn3)CC2)CC1 1835116239 CWDIAHUJMAYUIJ-RWPZCVJISA-N 482.545 0.501 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)n3ccnn3)CC2)CC1 1835117844 PXAOGFHICIMZRX-DCMOEJRUSA-N 483.577 0.545 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3scnc3C3CC3)C2)C1 1835929588 XMTZHACBMMIJLD-JOCHJYFZSA-N 471.344 0.084 50 20 JCGD O=C1CCCc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)c3cccc(B(O)O)c3)CCO4)ccc21 1835937404 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C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1839150853 ZNDBDYCZWCURPY-UXHICEINSA-N 475.373 0.827 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839668454 SDPFNRGBIFRNEQ-FZKQIMNGSA-N 473.324 0.048 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCSC)C2)C1 1839967088 ZNPBUJORGKUMRJ-ZQIUZPCESA-N 453.399 0.730 50 20 JCGD O=C([C@H]1C[C@@]12C(=O)Nc1ccccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1840017143 AGGVGDOYUAVUDI-CLUDHOEWSA-N 451.882 0.887 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1840031208 ISLLMEQFYYXILX-WBMJQRKESA-N 460.285 0.031 50 20 JCGD O=C(O)C#CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1840044511 KSXSPIYWUDJGAR-UTKZUKDTSA-N 479.327 0.537 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1C 1840070412 QPXMBSAPVNMDOZ-RUZDIDTESA-N 497.552 0.315 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1 1840154869 IFBXHWOJOCCLCT-SIKLNZKXSA-N 465.934 0.820 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CN(C)C1)CCO2 1840571441 UMFZWYBAMSLTCS-QFIPXVFZSA-N 476.486 0.152 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C[C@H]2C[C@H]21 1841361872 YVNGOPZSPZYKGW-ZTFGCOKTSA-N 484.557 0.900 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012515 VVCSVODCSDZMEH-XMMPIXPASA-N 489.353 0.923 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1845003730 UWZIIRPXSCRURI-AWEZNQCLSA-N 468.489 0.460 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@]1(C)CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C2 1846385127 VDCVELVBEXILIB-SBUREZEXSA-N 495.621 0.571 50 20 JCGD CCn1nc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(OC)cc3)C2=O)c2ccccc2c1=O 17189137 MNXAULXVSMNIFD-XMMPIXPASA-N 492.492 0.653 50 20 JCGD Cn1cccc1C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c1ccccc1Br 726540686 JSMQPSSYLSSPHS-CQSZACIVSA-N 485.360 0.782 50 20 JCGD O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1C1CC1)NNC(=O)c1nnc(O)c2ccccc12 744305617 GPCBAFPRBSXMOF-IBGZPJMESA-N 460.450 0.572 50 20 JCGD O=C(COC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)[C@@H]1COc2ccccc2O1 793940258 FBBUYUQZCUONBB-LPHOPBHVSA-N 453.451 0.566 50 20 JCGD O=C(COC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)[C@H]1COc2ccccc2O1 793940262 FBBUYUQZCUONBB-VQIMIIECSA-N 453.451 0.566 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)ccc1Cl 915789194 XLFCWBZVTRIITR-CQSZACIVSA-N 450.904 0.797 50 20 JCGD O=C(NNC(=O)C1CC1)c1cc(S(=O)(=O)N2CCOCC2)ccc1I 916034572 SCGHTHVNBKLFOU-UHFFFAOYSA-N 479.296 0.483 50 20 JCGD Cn1c(C=NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)nc2c1c(O)nc(=O)n2C 920361902 BTWASJMGSBNMPG-UHFFFAOYSA-N 487.523 0.999 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1n[nH]c2c1CS(=O)(=O)C2 1777715444 MBCGZELFTADEES-SUYBPPKGSA-N 493.355 0.656 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1778438339 KBJCVZCSRLIMHD-DEOSSOPVSA-N 475.509 0.694 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn(C)c2Cl)C1 1779930324 QOHWHAPEVNLXCV-FOIQADDNSA-N 454.959 0.574 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C1CC(=O)C1)CCO2)NC(=O)NCc1ccccc1 1780970753 YCMJKZIMKUIBIQ-QHCPKHFHSA-N 457.531 0.142 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1782618221 WDEFLRSKBJGJGD-NTKDMRAZSA-N 474.606 0.503 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1 1783835180 APFHZYZYGZYKAP-TYILLQQXSA-N 499.989 0.679 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)CCO2 1783937390 IMBRNXDFAPNAOY-SQJMNOBHSA-N 471.602 0.854 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)COc3cccnn3)C2)C1 1784456232 RZIPWPAHIQPGNT-BTYIYWSLSA-N 483.953 0.817 50 20 JCGD COc1c(C)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1C 1786981950 RRNGNLDQQNOINR-NYVOZVTQSA-N 466.343 0.899 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccc4[nH]ccc34)[C@H]2C1 1787337954 PATVUBGYWSEZCE-IXDGSTSKSA-N 463.498 0.469 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1nc2c(=O)[nH]c3ccccc3n2n1 1788080341 UWDGVMOTKKURIV-GVARAGBVSA-N 462.869 0.699 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1788610606 KWJNOHOVZWISLG-CQDKDKBSSA-N 454.325 0.063 50 20 JCGD CCc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cn1 1788611437 BWQMBDQMPSEFBT-YSSFQJQWSA-N 452.515 0.550 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1C(=O)c1ccc(F)cc1)C2)[C@@H](O)CCl 1792975771 XQNLEZVYMYNQCN-PTIUUAQKSA-N 467.925 0.620 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)C3(CCOCC3)c3ccccc31)C2)[C@@H](O)CCl 1792978444 CIOCWLAOKDFZLB-MNDZRTMASA-N 491.972 0.271 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793879659 AGPGIRVVMHSGAW-KSWRQPAISA-N 484.985 0.636 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2 1798442170 ZXSGDTMWRBABBO-VIQHNZTISA-N 454.531 0.338 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)NC(=O)NCc1ccccc1 1799094992 OGNIWWFWEQLPQX-MVJTYMMSSA-N 455.918 0.457 50 20 JCGD C[C@@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)O1 1799098081 ZVHKDHBJCFUOTR-QKYBYQKWSA-N 473.574 0.490 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1C(=O)OCCO 1799267454 PDGIUUVAUBIYPK-MUJYYYPQSA-N 481.509 0.400 50 20 JCGD O=C(Cn1ccncc1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1800198988 SUURMMKKTHJDLF-NYUBLWNDSA-N 489.370 0.839 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C)C2 1800758203 USHSXPYXDIZDBA-RBGFHDKUSA-N 490.395 0.995 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)C1 1801049575 DQFVFOAIZNRJDP-JHXTVGTDSA-N 466.362 0.752 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1 1801563317 HIOBVVFNZJEYFA-BCDXTJNWSA-N 499.593 0.973 50 20 JCGD CC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1802549230 OLJQKGBMTLZTIB-UXPWSPDFSA-N 467.530 0.314 50 20 JCGD O=C(CCC(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804148674 AXXWKRJLXGNDHU-GBXCKJPGSA-N 478.358 0.484 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cccc(O)n2)[C@H]1c1cccnc1 1805674673 FZGRTIBDMKHZIH-FOIQADDNSA-N 461.482 0.814 50 20 JCGD COC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1806377134 KGWWAPMPAJKENH-YWZLYKJASA-N 454.487 0.353 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@@H](O)c1ccccc1 1806802434 VKFCIDRZLMWECZ-PMVMPFDFSA-N 459.311 0.815 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360713 LVTKJKWVPUDCLL-DNVCBOLYSA-N 464.247 0.026 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807361176 PFMDUYZLBDVKSM-XMSQKQJNSA-N 460.299 0.094 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2cnccn2)[C@@H]1c1cccnc1 1810307022 CFGYANGGWSMKSK-DPZNOXRXSA-N 472.509 0.903 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@@H]1c1cccnc1 1813074323 PONCRWAUPSDQBX-HRAATJIYSA-N 482.520 0.956 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1 1813487531 QSBLNOJIHMUURB-AVMAXUKXSA-N 451.531 0.964 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCc3cncnc3)sc2C1 1815534909 RJYBCCGDKALUNK-ZDUSSCGKSA-N 466.527 0.790 50 20 JCGD CC(=O)c1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n[nH]1 1816292309 GZWGKVODENFHQY-GOSISDBHSA-N 450.264 0.635 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3c(n2)OCCO3)[nH]n1)c1ccc(B(O)O)cc1 1817471911 VZBDTVZIOKGWFK-SFHVURJKSA-N 477.286 0.875 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3ncn(-c4ccccc4)n3)sc2C1)c1cccc(B(O)O)c1 1817490360 GMINTNXLPHFIOB-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc(Cl)ncn3)sc2C1)c1cccc(B(O)O)c1 1820934320 WSWKEYCIJCHFBN-LBPRGKRZSA-N 457.708 0.806 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCN(C(C)=O)CC1)CC2 1825999890 GHWMBADXMYAYJZ-KBPBESRZSA-N 457.984 0.473 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cncc(S(C)(=O)=O)c1)CC2 1826080561 QUKKREGXZQRXNZ-ZDUSSCGKSA-N 494.599 0.540 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCOCC2)CC1 1826751119 QHJCNYRPIIWMOF-FQEVSTJZSA-N 451.612 0.701 50 20 JCGD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n(C)n1 1827049996 CYEYHFNPLQNUBP-IBGZPJMESA-N 454.336 0.656 50 20 JCGD CC(=O)c1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)n[nH]1 1827050801 ZDKXUDZUBXAZAX-OAQYLSRUSA-N 452.320 0.839 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1 1829063261 LHLLCNREHREJOH-JOCHJYFZSA-N 494.401 0.900 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)COc1cccc(Cl)c1)CCO2 1830281172 CWAVAIVAMKYGMF-JOCHJYFZSA-N 482.965 0.548 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)C(F)(F)F)C2)C1 1830544116 NXBALFLFANVMHO-XHDPSFHLSA-N 474.274 0.152 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)n(-c2ccccc2)n1 1830727947 LGVMJIHEEJBXFX-KNQAVFIVSA-N 462.934 0.850 50 20 JCGD COCCOCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549250 JPVSSBQDONVMAX-HRAATJIYSA-N 493.985 0.238 50 20 JCGD CN(CC(=O)N1CCC(N2CCC(NC(=O)c3cc[nH]n3)CC2)CC1)NC(=O)NCc1ccccc1 1833561502 WBTJXUYDRVLDRR-UHFFFAOYSA-N 496.616 0.941 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNCP(=O)(O)O)CC2)CC1 1834664763 AYTZMKFYJPQOSK-MRXNPFEDSA-N 452.920 0.690 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1 1834823443 VJZAXKZDJNJDLH-VQTJNVASSA-N 482.331 0.963 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)Cc3ccc(F)cn3)CC2)CC1 1834836320 IYIAEOZQDMXMSJ-UHFFFAOYSA-N 483.548 0.647 50 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465.511 0.303 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838499020 LIMVIKZJOFJGKT-QVKFZJNVSA-N 463.922 0.567 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(Cl)c1)CCO2 1838918041 GEIUZUFACVNFRB-QFIPXVFZSA-N 458.707 0.404 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)c(=O)[nH]c1C 1839151088 HZGSFNLCOOBOPS-MOPGFXCFSA-N 461.346 0.693 50 20 JCGD Cc1nnc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)s1 1839199309 MWKZNEHITVQJLE-HIFRSBDPSA-N 451.318 0.536 50 20 JCGD O=C1CSc2ncc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)cc2N1 1839578146 SNFLUPMXUPNLLM-KDOFPFPSSA-N 458.899 0.730 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CCO2)C1 1839789244 SXAGXTIKBQVNKA-OXQOHEQNSA-N 473.885 0.987 50 20 JCGD Cc1ccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)s1 1840394724 BGIOITCKEDZAJC-MNQSQUENSA-N 470.356 0.520 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840452983 KDWGQFZRCNIOHM-DHSIGJKJSA-N 460.300 0.996 50 20 JCGD Cc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1 1840672330 MUIZXSZDFILFFJ-RUZDIDTESA-N 481.553 0.994 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1842948027 QLRSMGIQAQMEQF-HZPDHXFCSA-N 451.365 0.789 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1 1843010926 VXYOQOXRASWHBL-UHFFFAOYSA-N 452.316 0.833 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccn3c(O)nnc13)C2 1843415939 GCZMTPGKLBTTMA-YDZHTSKRSA-N 450.459 0.386 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1843416417 HPHKUTJZHLMJRM-AFUMVMLFSA-N 483.554 0.229 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1847155726 XVWZOIRFZAEDBU-UHFFFAOYSA-N 459.352 0.734 50 20 JCGD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1847890971 ONFMXYCRWXHYLP-MVJPYGJCSA-N 487.362 0.206 50 20 JCGD Cn1c(=O)n(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2ccccc21 22082254 OKKWTKAFBUMTAY-UHFFFAOYSA-N 487.538 0.212 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCC1)c1csc(N2CCOCC2)n1 25322743 DUYCMPCIVVNHQV-UHFFFAOYSA-N 471.586 0.901 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)[C@H](C)N1C(=O)NC2(CCCC2)C1=O 726651786 NUTQOEXVUMVDQM-NSHDSACASA-N 466.878 0.906 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1 729274698 AQTPPBROEBWBAV-LLVKDONJSA-N 458.493 0.325 50 20 JCGD COc1ccc(NC(=S)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)cn1 729693043 FRTBDTCSXOOPRV-UHFFFAOYSA-N 454.534 0.081 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1 730782450 OJTNGRZJQWHPLR-UHFFFAOYSA-N 491.522 0.791 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 845922980 INVVJQKPIVIDJQ-LSLOVBDISA-N 461.858 0.460 50 20 JCGD COCCN1C[C@H](C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1=O 914462334 LDECMDKRBTULFW-LJQANCHMSA-N 463.498 0.644 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)c1 915197476 ORTBRCBXKKUNGE-UHFFFAOYSA-N 464.525 0.370 50 20 JCGD NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 916624142 TUSXJEBLNDRAJL-UHFFFAOYSA-N 481.556 0.263 50 20 JCGD O=C(CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1ccc(Cl)cc1 919782660 APUUBVJIDYGQEE-UHFFFAOYSA-N 495.945 0.944 50 20 JCGD CS(=O)(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 921294924 DTNDRFFLCBHIBC-UHFFFAOYSA-N 485.924 0.153 50 20 JCGD C[C@H]1CCCN(C(=O)CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 1351923008 ADKSVGRESGFPME-INIZCTEOSA-N 481.575 0.300 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CCN(S(C)(=O)=O)CC2)C1 1778758061 SZGAESLPUYSPKW-MBOZVWFJSA-N 480.027 0.426 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CSc3ccncc3)CCO2)C1 1779028683 NSDVCXXBDQWSPD-NRFANRHFSA-N 456.528 0.316 50 20 JCGD COc1ccc2nc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)ccc2c1 1779032726 XAWTWLGBZSMHMG-RUZDIDTESA-N 490.520 0.999 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc3ccc(F)cn13)CCO2 1779037176 SWQDUAZTQGOHHE-JOCHJYFZSA-N 467.461 0.229 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C2)C1 1780923727 OFGVOZHFPYAOSX-QHCPKHFHSA-N 470.281 0.820 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(=O)cco1)CCO2)NC(=O)NCc1ccccc1 1780968699 DIQFUGNCNVMQCE-DEOSSOPVSA-N 483.525 0.430 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)c1 1780969554 OAESXJBAJXYWCK-NLFFAJNJSA-N 497.600 0.929 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CC3CCOCC3)CCO2)C1)NC(=O)NCc1ccccc1 1780969859 KMRRFVWCJFWECF-RUZDIDTESA-N 487.601 0.979 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1onc2ccccc12 1781304412 DKDVZEZDYTZDHP-HYBUGGRVSA-N 463.299 0.949 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334485 OHHMAGUAGJDSTJ-FUHWJXTLSA-N 485.347 0.203 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1781444469 TUJYZUGSXACKFN-JOCHJYFZSA-N 461.519 0.681 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc([N+](=O)[O-])c1OC 1784092579 QFGMJVUTMZIDNR-CQPIRRRNSA-N 471.894 0.805 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CC3Cc4ccccc4C3)C2)C1 1785651414 RKGHZSQCUNKQMB-VWLOTQADSA-N 463.538 0.934 50 20 JCGD O=C(CCS(=O)(=O)c1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1786584285 AUHYLKGUNBINGQ-DKIMLUQUSA-N 458.964 0.430 50 20 JCGD CS(=O)(=O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21 1786648166 WGOVOXQABVDTTE-MEFGBEIZSA-N 467.494 0.896 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)ccc(F)c1F 1786986689 YTBRERRFTCHMPR-QSFXBCCZSA-N 458.270 0.860 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@@H]1CN(Cc2ccccc2)CCO1 1788199278 AYXNCBBXQLOSLI-WHZJULEDSA-N 465.978 0.467 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS[C@@H]3CCCCO3)C[C@@H]21 1788611249 RAFBJJYKAXPVHO-PRIDNEQBSA-N 477.587 0.538 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)[C@H]2C1 1790176718 CZYZMVUHUXZQAK-MJDBTJCESA-N 464.357 0.593 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3cccnn13)C2 1792872412 FWPXSWVDQWXDEW-KOFHJDLBSA-N 464.320 0.324 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792975427 RMIUZDPRQXXUJY-APAFKAMOSA-N 451.951 0.774 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1cccnc1 1792975764 XISAVDCVRLRTKC-FLXSYLCISA-N 482.965 0.837 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n(C)n1 1794744974 SOFDKTMXEPYCTE-HATOLVCRSA-N 483.573 0.278 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncccn1 1794813513 OEWOYTCURTWJCF-XGUBFFRZSA-N 453.927 0.812 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#Cc1ccccc1)NC(=O)NCc1ccccc1 1795277569 IDDJQRVLANOVIP-MWZSMPGESA-N 489.576 0.974 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1C(F)(F)F)C2)c1ccc(B(O)O)cc1 1795732866 NWZMGEWHDDIKRZ-VPTLXERWSA-N 494.250 0.970 50 20 JCGD CN1CCN(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN(C)NC(=O)NCc2ccccc2)C3)CC1 1795885130 KMNPQVNEZZJQQJ-NUNAXRQHSA-N 499.660 0.608 50 20 JCGD COC(=O)[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)NC(=O)OC(C)(C)C 1796368174 FIFMTZSGXNRVOI-BUONHZGMSA-N 465.906 0.567 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1796439473 GNZKSKTXLACQQF-PXQNEATLSA-N 473.530 0.299 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)Nc1c(C)cccc1C)C2 1796443760 GZUWKZSNFUDTHU-HMALFNAQSA-N 494.552 0.966 50 20 JCGD COC(OC)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798521503 LITMBBRGUHZGBE-FVCICTRLSA-N 451.432 0.342 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(OC2CCOCC2)n1)c1cccc(B(O)O)c1 1799061952 ZNYAJHLTFCSWNI-ACDBMABISA-N 479.342 0.885 50 20 JCGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1)C1(O)CCC1 1799094845 CGWYJNYIEPKNSO-KMQSCTNJSA-N 487.601 0.473 50 20 JCGD CC(C)O[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097145 FHSUOQIMRGCIHF-RPUPUWCGSA-N 475.590 0.736 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)cn1C 1799097269 LZALVRHXKJQAEB-IUTQVRIDSA-N 482.585 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1 1799246325 NCPMLBNSZMXGOT-FAQVEIGNSA-N 487.557 0.979 50 20 JCGD Cc1c(Br)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)nn1C 1799442721 HZNHUZWFMRXRHF-MUJYYYPQSA-N 475.152 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(c2ccc(F)cn2)CC1 1800292771 METXXEJNIXFIRB-FEJSZKPUSA-N 490.580 0.400 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800434831 DKWDOZIJAZXZGV-FSNPWBFUSA-N 498.374 0.647 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@](C)(O)CN1C(=O)OC(C)(C)C 1800824574 QASFFZQZWREDLH-WHDKQWSOSA-N 489.997 0.590 50 20 JCGD CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)c1cccc(Cl)c1 1801012541 ONGLRCCJVKNVNS-WOSNLTMFSA-N 493.992 0.480 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1ccnc1 1803310446 MELABUHRXBFMRG-WRWLIDTKSA-N 462.514 0.857 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1804197024 CUDBIHKMYJEZMJ-QILLFSRXSA-N 487.420 0.601 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1804197581 HXNBYZLQHPVNGN-JENIJYKNSA-N 472.995 0.072 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2COc3ccccc3O2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369203 CEZRBZXQLVBRQF-WUMKDDEVSA-N 487.321 0.921 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1807372284 DCKMHNXBENHMIY-QUCCMNQESA-N 465.315 0.424 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807374772 JBXDPYVFXDVOQO-KHZGNEAMSA-N 457.361 0.240 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1 1809778037 ZSXIRKPPFHMFGZ-JXFKEZNVSA-N 485.508 0.756 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1ccnc1 1810294318 JDJKXKMXKYJXQZ-OXFYSEKESA-N 462.514 0.857 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)no2)[C@@H]1c1cccnc1 1810303539 UVPCBZONGNSBOO-SCLBCKFNSA-N 451.443 0.407 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nn1 1813072351 GCJNHQPOVXHOQZ-VGOFRKELSA-N 469.546 0.963 50 20 JCGD Cc1cc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)nn1C 1814987377 BNPQMIICTDYUPV-GOSISDBHSA-N 465.518 0.999 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3snnc3c1)CC2)c1cccc(B(O)O)c1 1815360833 OOZZGEKYUNGFCH-ZDUSSCGKSA-N 480.340 0.762 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1 1819401892 FFAGDLHQJRNKRT-OAHLLOKOSA-N 466.458 0.427 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C[C@](C)(O)CC(=O)O)[nH]n1 1822416805 PZVCHYIZNXLYFL-XOBRGWDASA-N 452.512 0.391 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1824517852 RWUDEECLNSJIQL-KRWDZBQOSA-N 456.609 0.885 50 20 JCGD O=C(CCc1cnccn1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826904483 DIFRPYTZKPWBJO-HNNXBMFYSA-N 451.317 0.472 50 20 JCGD O=C(COC(=O)C(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057942 OAWCURIGNONRAH-QGZVFWFLSA-N 470.253 0.705 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923297 BSPYYDJVANCQRW-BEFAXECRSA-N 494.618 0.246 50 20 JCGD O=C(Cn1ccnn1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829023584 ROBWGHBQEXCHFK-AVRDEDQJSA-N 490.948 0.330 50 20 JCGD C[C@H](Br)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](N)CN)C2)C1 1829330717 PEHLKTFZTONBLS-HZUJVAHNSA-N 496.406 0.508 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1 1833292811 KSFWVEJQYWRCAB-JTSKRJEESA-N 475.933 0.862 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833312487 OJJIRDVLJYCDQE-FQEVSTJZSA-N 481.977 0.621 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1 1833399896 IWIJWAYYAHFRBP-YOEHRIQHSA-N 494.339 0.246 50 20 JCGD CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1833713598 ZRQNZXJPVLXBFE-UHFFFAOYSA-N 477.071 0.553 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ncc(Cl)cn3)CC2)CC1 1834056164 UTXUYBCJSDSHLV-UHFFFAOYSA-N 486.964 0.628 50 20 JCGD O=C(C#Cc1ccccc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834518746 KXMTWJCEOYJIKO-UHFFFAOYSA-N 459.355 0.603 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)nn3)CC2)CC1)c1ccc(B(O)O)cc1 1834798416 SJLPKGSRFWJWTC-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798634 SSIVVOKGABXGJW-MRXNPFEDSA-N 485.419 0.509 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3[nH]nnc3C)CC2)CC1 1834932005 NLDHRUDSGVYMLC-MFKUBSTISA-N 469.550 0.432 50 20 JCGD Cc1ccn2ncc(C(=O)NC3CCN(C4CCN(C(=O)c5cccc(B(O)O)c5)CC4)CC3)c2c1 1835035799 NFTBBGFEYXSWKE-UHFFFAOYSA-N 489.385 0.822 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc4nc(CO)[nH]c4c3)CC2)CC1 1835317519 VTCOYQCVLGXZMM-UHFFFAOYSA-N 499.616 0.613 50 20 JCGD CC(C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737175 RXOLMHAGSZGMGZ-UHFFFAOYSA-N 460.579 0.685 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836713271 AVKHAYZGTSWPPE-ZWKOTPCHSA-N 492.013 0.860 50 20 JCGD CN1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837003038 UZQBPICPAYZVNY-FQEVSTJZSA-N 458.563 0.392 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3sccc3[nH]1)CCO2 1837128928 QVQUSEKAQNKRMS-QFIPXVFZSA-N 469.328 0.293 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1 1837531492 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C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2 1840363193 ONZZQXILBASRIJ-IERDGZPVSA-N 450.612 0.823 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)C#CC2CC2)C1 1841540969 QOSSDRRSBHVJNW-NRFANRHFSA-N 495.385 0.419 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)C13CC(C1)C3)C2 1843428889 XGJRNAFRASOBBW-PSWPWZSKSA-N 497.401 0.806 50 20 JCGD CC(C)(CCl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CSCN2C(=O)[C@@H]2CCC(=O)N2)C1 1845873395 NPIOPTNHECKUSK-UONOGXRCSA-N 456.996 0.635 50 20 JCGD O=C(COC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)NNC(=O)c1ccccc1 12178826 XFBUVIIGOSVULT-UHFFFAOYSA-N 470.507 0.852 50 20 JCGD COc1ccc(C(=O)NNC(=O)Cc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)cc1OC 28776626 SJJNMVOSMCDAQY-UHFFFAOYSA-N 493.538 0.737 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)c1 109253749 DOURLAWFQDKCPW-UHFFFAOYSA-N 493.567 0.843 50 20 JCGD COc1ccc(CCC(=O)N2CCCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1 725872490 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472.531 0.835 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1778165967 HRETZMZNWIAHJA-XOBRGWDASA-N 465.348 0.953 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4ccnc4c3)C2)C1 1778567885 GVRKKQIEQQINRI-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cn4ccsc4n3)CCO2)C1 1779032309 NCAGNGQELJXFAF-HXUWFJFHSA-N 455.500 0.152 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nncn3c2)C1 1779066572 KAQUPDJLDFADIY-WZONZLPQSA-N 478.513 0.169 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C)nc3C(F)(F)F)C2)C1 1779543740 LROXRBBJZJKSLE-GOSISDBHSA-N 460.457 0.255 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnncc2C(=O)O)C1 1779697158 QAMHCLBYBUURQX-QCLQCBKUSA-N 497.512 0.436 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)n1cnnn1)CCO2 1780099176 XJTBISPENVOLPN-XCLFUZPHSA-N 473.446 0.211 50 20 JCGD 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CNC(=S)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828928649 NLBTYSYBIAENFZ-IBGZPJMESA-N 460.409 0.084 50 20 JCGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1 1830376018 ZPFYEMKWEHWNCO-GXTWGEPZSA-N 470.303 0.736 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H](N)c3cccnc3)C2)C1 1830537634 LLHGTJMBMLIZGW-SYNHAJSKSA-N 469.380 0.959 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)C1 1830713575 DSTVHMSINIUAGB-AHXJXLJNSA-N 465.316 0.723 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(C(F)(F)F)n1 1830731078 GWRWSDXBUGZWCF-FZKQIMNGSA-N 481.855 0.779 50 20 JCGD O=C1C[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CN1Cc1cccs1 1832750533 XQFVFPFUBVYNHJ-WJPUGNRLSA-N 485.990 0.153 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832793139 DWTLLIYXMVQTGW-SUMWQHHRSA-N 474.312 0.279 50 20 JCGD Cc1c(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cn2[nH]cnc(=O)c12 1833311747 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Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n[nH]1 1837921232 OSBJCQRRAJYSEO-UHFFFAOYSA-N 454.336 0.253 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCC3)C2)C1 1838527364 PRLONBFZLWXVQG-HSZRJFAPSA-N 490.513 0.686 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1 1838740286 IQRICUVNUTXBST-DLBZAZTESA-N 450.985 0.816 50 20 JCGD N#Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1F 1839187101 KDSMVCWFCWMBPH-DEOSSOPVSA-N 496.499 0.009 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3cccc(F)c13)CCO2 1839599332 AXYMXKIGGVBFSW-JOCHJYFZSA-N 476.509 0.145 50 20 JCGD CN(C)C(=O)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839742205 RPGJKPIRCMGEEH-AKMURLTLSA-N 491.495 0.599 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CS(=O)(=O)CC)C2)C1 1839962389 CSAKNDZFGCJYEL-BBRMVZONSA-N 455.371 0.051 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1840031074 FIQIHNVVIYIYDX-DIFFPNOSSA-N 457.281 0.028 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1 1840183788 AHPOVWWESYEYMK-NRFANRHFSA-N 464.544 0.937 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccn(C)c34)C2)C1 1840184379 JDENTDAGMSFMAW-DEOSSOPVSA-N 471.558 0.621 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc(F)c3F)C2)C1 1840186988 HMISXTMNUVZHCQ-NRFANRHFSA-N 472.464 0.547 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3c(C)nn(C)c3C)CCO2)C1 1840436314 XWJMMMZDJHGUIV-MSIOFZDNSA-N 499.572 0.170 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2nccn(Cc3ccc(F)cc3)c2=O)C1 1842242644 YHJVMKLDIWMURD-UHFFFAOYSA-N 490.300 0.241 50 20 JCGD Cc1nccn1CC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1845820447 JEAZXWLLXGRVDV-UHFFFAOYSA-N 453.547 0.741 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)(C1)C2 1846109687 UWOMVRHZUVHFJV-UHFFFAOYSA-N 484.557 0.950 50 20 JCGD CCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 16594282 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CC[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)NC(=O)OC(C)(C)C 1799367720 PGZMTFXZSKYMFO-SHJAMOMRSA-N 489.378 0.263 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802344023 MWLORJVIQSEEOL-XMTFNYHQSA-N 463.579 0.914 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1803007325 ARILKSBUFGGOIX-FFSVYQOJSA-N 489.334 0.558 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)C[C@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1804354464 OSIMWHNYTBMWDS-BFDPJXHCSA-N 456.330 0.922 50 20 JCGD Cc1nnc(CCC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1 1804558308 ALLSJCYJTSNROX-PGRDOPGGSA-N 479.371 0.874 50 20 JCGD Cc1nc(O)c(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nc1C 1804871923 BKQJXZRQACOSET-UWJYYQICSA-N 469.546 0.887 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363875 RATMXWOKWTZTKW-ZBFHGGJFSA-N 497.210 0.436 50 20 JCGD O=C(Cc1ccc(F)cn1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807477152 HLMIVUGGOLEOFS-FDDCHVKYSA-N 462.290 0.858 50 20 JCGD CCCNC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810293206 AYNYCCUHYJAZMJ-HTAPYJJXSA-N 481.557 0.706 50 20 JCGD Cn1cccc1C(=O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1813478571 AFWIORMREDICBI-JXFKEZNVSA-N 475.509 0.621 50 20 JCGD Cc1ccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815336787 FCLKRQJYEGPNOV-KRWDZBQOSA-N 450.329 0.995 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CSc3ncccn3)sc2C1 1815630187 GAHATJOPIJFAGU-LLVKDONJSA-N 484.567 0.950 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1=NNC(=O)C1)CC2 1817282213 YYMHFYXOFPROBD-CTWDJJQWSA-N 456.488 0.065 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cn3ncccc3n2)[nH]n1)c1ccc(B(O)O)cc1 1817471735 LGRJBVQXRVZAOL-GOSISDBHSA-N 459.275 0.752 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403620 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CCCNC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830533510 PINGEORQGLYQSE-BEFAXECRSA-N 462.385 0.780 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1830540866 UWWHBHJTBAGUBN-AUUYWEPGSA-N 469.336 0.508 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1831464034 NYBKAPMCFNHHQE-XOKHGSTOSA-N 459.392 0.360 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN(CCO)CCO)CC1 1831486972 SDLONERCAYEZQA-MSPRMREJSA-N 490.605 0.027 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833599072 BOYYKYBIPDJOMK-OALUTQOASA-N 494.397 0.791 50 20 JCGD Cc1cncc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1834229771 ANYSRVYCUKCRTP-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)C(C)(C)C 1834819194 IIZXVPZRTARJCA-APWZRJJASA-N 462.385 0.779 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)Cn3cc(Cl)cn3)CC2)CC1 1835737092 VTRLHWPKMNUQJM-UHFFFAOYSA-N 488.980 0.420 50 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KACOCECEECKVQO-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839744007 KBDCJZOOYCEXMN-ZGOLIUOYSA-N 491.495 0.775 50 20 JCGD Cn1nncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839801964 IVTNQFJFPJAJAK-UTKZUKDTSA-N 492.374 0.891 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)Cc1ccccc1)CCO2 1839958518 HJRMGHDCVUXLTG-HYTOSZNNSA-N 497.552 0.180 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)nc3OC)C2)C1 1839963688 SCFIDFZKXQHINN-KDOFPFPSSA-N 459.341 0.672 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)ccn1 1840032673 GYJMGEFDIRVGTI-ORAYPTAESA-N 469.336 0.893 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(NC(C)=O)c3)C2)C1 1840152832 VVMFKSMONJYAPR-UZLBHIALSA-N 454.911 0.364 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=COCCC3)CCO2)C1 1840215950 PWSHPVVUBOXIPQ-OLCUMFGGSA-N 459.503 0.271 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840854814 OBUUHBOIZKWVMP-VBQJREDUSA-N 452.321 0.438 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)C2)C1 1843015006 XUZBWESSXQVBCR-UHFFFAOYSA-N 483.374 0.831 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cc(Br)ccc2O)C1 1844881755 ONACNVUYXKEUTC-UHFFFAOYSA-N 459.105 0.965 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)NC2CC2)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1 11683819 QDXXKXKELQAFMW-STQMWFEESA-N 452.533 0.401 50 20 JCGD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1 16098510 DPIAHZLEWLFECT-UHFFFAOYSA-N 498.539 0.485 50 20 JCGD CCNS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 728329517 BMCPDMJVRXGVJH-KRWDZBQOSA-N 481.458 0.268 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)CCc2nc3c(O)nc(=O)n(C)c3[nH]2)c1 728526203 MBWYPHVUKHNWTC-UHFFFAOYSA-N 465.264 0.527 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(S(=O)(=O)Nc2ccc(F)cc2)ccc1Cl 729275164 MMHADCNGFCFYKO-JTQLQIEISA-N 492.938 0.979 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)s2)c1 729295413 IAWCNLXPJJKPLZ-UHFFFAOYSA-N 460.559 0.501 50 20 JCGD COCCS(=O)(=O)CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 915638347 JYJVZTQKMLYEHL-UHFFFAOYSA-N 461.543 0.371 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)ccc1Cl 915789150 RYKVITMJEUYAKV-TXEJJXNPSA-N 456.908 0.314 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCS(=O)(=O)c2ccccc2)cc1 918229464 CSRXJWPOUZTEOZ-UHFFFAOYSA-N 468.557 0.420 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C(=O)C(=O)N3CCCC3)CC2)N(C)c2ccccc21 919845845 QJEHPIDZKDKXSE-UHFFFAOYSA-N 478.553 0.950 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCN2CCOCC2)cc1 920848002 MKYJAJKKQNHPMC-JXAWBTAJSA-N 452.515 0.789 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(=O)oc1)C2 1778091082 FCKSXVSWFKEEQV-TUWUPGADSA-N 469.498 0.901 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)o1 1779024312 RSGAZIIAYNYFDV-FDCKDHBTSA-N 470.486 0.816 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc4sccn4c3)CCO2)C1 1779029931 BOMUYIKFRGWZRF-OAQYLSRUSA-N 454.512 0.757 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c2n1 1779030245 LSBXOSDBOJVHOF-QHCPKHFHSA-N 478.513 0.102 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3cc(Cl)ccc13)CCO2 1779031992 ISUQOZLWAYTPCJ-QFIPXVFZSA-N 483.916 0.972 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccc4)no3)C2)C1 1779578183 VNRFGBANFCRFPI-XMMPIXPASA-N 461.283 0.779 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780095220 KQCJGTDLGZKZFW-JLCFBVMHSA-N 476.486 0.878 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(OC)c1 1780533024 FZFLSJCYBBIMPH-QHCPKHFHSA-N 469.498 0.460 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1 1782179123 HBYXYTUTUXSDHT-NNMXDRDESA-N 495.013 0.450 50 20 JCGD Cc1nccn1[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782626595 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0.907 50 20 JCGD COc1cccc(OC)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789471827 ZIBXSSZETXRNDE-MDKPJZGXSA-N 468.315 0.291 50 20 JCGD Cc1n[nH]c(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726642 IJVGQMQYJUBZGA-ACRUOGEOSA-N 497.600 0.966 50 20 JCGD CO/C=C(\C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726832 WCXKLHRGOVKFJB-NTPIEOJGSA-N 473.574 0.863 50 20 JCGD Cc1cn(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]3C2)c(=O)nc1O 1789872175 BDIMQEBFSHVKLV-MNUAXYBXSA-N 461.346 0.473 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc(-c2cnco2)c1 1790145085 IGLZBDPRMDKPRD-RRPUWOKSSA-N 475.310 0.929 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)[C@H]2C1 1790174359 ZGIUQGOPTXKNDK-BLDNINTCSA-N 478.384 0.840 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC(c4ccccc4)=NN3)[C@H]2C1 1790547688 VCSWAEJIORZIPK-QIJZPMMNSA-N 470.574 0.105 50 20 JCGD CN(C)[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(Cl)cc1 1790673028 DYFZTJFXKNFXGB-FDTGPBLFSA-N 499.804 0.916 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1CCc2ccccc2O1 1791225418 APVZOOYBJHPBMS-MHADKKCISA-N 464.327 0.354 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1 1791289051 FNPUMPKKBXYOMK-VCOUNFBDSA-N 490.601 0.989 50 20 JCGD O=C(/C=C/c1ccc(F)cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793677004 FAFVQNFXRXZBGW-MBQWOLKWSA-N 456.254 0.561 50 20 JCGD CC(C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)ccn1 1795732555 USCLDANUQNNFNV-RMFSNUHRSA-N 451.332 0.576 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(F)cc3)CC1)C2)c1ccc(B(O)O)cc1 1795733011 XJLQJFHDWHQDFR-UPHUGPLXSA-N 452.291 0.441 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)C2)c1ccc(B(O)O)cc1 1795734240 KYFIJXGKIGSHLP-CSXWMVMESA-N 464.352 0.458 50 20 JCGD COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1OC 1795737791 UFMIJBLWQBBBIB-NHKMSHSESA-N 482.342 0.220 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)CC2=O)c1 1796185775 NHXQVZVFXOJDDD-BZNRXQDOSA-N 491.353 0.680 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccccc1C(=O)OCCO)C2 1798439818 IFDBJLMBVSMBEH-MUJYYYPQSA-N 481.509 0.400 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1ccnn1 1800268122 UTFXUSJHKROTLI-FIIQBIKZSA-N 472.458 0.576 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3cnco3)c1)C2 1801012653 UVELGPFJIAEEBB-OPMZPASUSA-N 455.515 0.918 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O 1801289206 OPZWRFATZVVWQK-GWCDLVAZSA-N 470.368 0.220 50 20 JCGD CCC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803432806 AIIXKMSNZLSBTB-KKVAFCGZSA-N 467.530 0.314 50 20 JCGD COC(=O)CSCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1803581287 WCLZJPYYUJKRPF-HRAATJIYSA-N 465.576 0.367 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803611963 BWCCBVZEOWYRON-ZXUOCUECSA-N 454.531 0.807 50 20 JCGD CN(C)c1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1 1805344046 QCIJKXNQTSQHFC-FXAWDEMLSA-N 463.303 0.449 50 20 JCGD CN1CCN(CCC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1806914829 NQOOEHKDYSGXEI-CVDCTZTESA-N 494.600 0.037 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc3snnc3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360692 LSWLUIXKARCGGQ-UZLBHIALSA-N 488.338 0.795 50 20 JCGD CNC(=O)CC(=O)N1CC[C@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1807454010 RIUIHCIEOLIJLL-YKSBVNFPSA-N 495.584 0.570 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)nc2N1 1807938586 WIGJMFOOLLLIPW-CVDCTZTESA-N 499.336 0.675 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)COCCO)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1808633640 SSQJCLLBZRHSHF-QPPBQGQZSA-N 498.584 0.443 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cc(=O)nc4sccn34)CC2)C1 1809978039 PQKUIAXQCFWINR-UHFFFAOYSA-N 480.355 0.594 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc2nccn12 1812169422 IKJFOYKICDTRAS-UGKGYDQZSA-N 484.325 0.746 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2C)[C@@H]1c1cccnc1 1813070562 JLQAIVGAJLMNML-HTAPYJJXSA-N 454.531 0.473 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1 1814876682 XOGYRHKLGLXDCZ-MJBXVCDLSA-N 486.957 0.770 50 20 JCGD O=C(CCc1cnccn1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347505 AGPGWYONYLXEQY-OAHLLOKOSA-N 451.317 0.472 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1 1816943959 AEEVRRGLKDWWAW-NSHDSACASA-N 477.510 0.724 50 20 JCGD Cc1cc(NC(=O)CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)no1 1817240848 UOLOUIIPQHEVRZ-AWEZNQCLSA-N 483.315 0.374 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)c1ccccn1)CC2 1819795213 KCPDCQFGFXTREA-GTNSWQLSSA-N 466.527 0.462 50 20 JCGD C[C@](Cl)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](O)N3CCOCC3)sc2C1 1819892034 WLCNJWCERAUSDB-NCHVAJSOSA-N 451.376 0.942 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccnc2C(N)=O)[nH]n1 1822410658 NPSMHEHSBPBONE-HNNXBMFYSA-N 456.507 0.583 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc2nn[nH]c2c1 1824411269 CFTCIPRHYMUBPJ-AWEZNQCLSA-N 462.300 0.634 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)N1C[C@@H]2C[C@H]2C1 1827052398 YAEZMOSPHDAZAJ-NPWUYRIISA-N 453.392 0.940 50 20 JCGD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n(C)n1 1827055948 KVFXNWHKDUSROE-IBGZPJMESA-N 454.336 0.656 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cnnn2)CC1 1827195766 AYEHAQQSOBGZBQ-LSPPGFKNSA-N 455.523 0.427 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cn3cccnc3n2)CC1 1828562284 UBVBGZWGZNAJNQ-NRFANRHFSA-N 461.331 0.956 50 20 JCGD C=CCO[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831426899 LFVQZQLGAWKZIW-KTUMRIBQSA-N 461.519 0.168 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1832139016 YCSLUTGERQYBMH-NHCUHLMSSA-N 489.621 0.450 50 20 JCGD O=C(Cc1ccc(Cl)s1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832603053 MGHQXPUWRVMUTD-OAQYLSRUSA-N 478.763 0.394 50 20 JCGD CN[C@@H](CC(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1)C(=O)O 1833263673 QPUIDZMMZHXSIM-CJNGLKHVSA-N 461.401 0.652 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)nc2N1 1833310849 VULHERFGFXVKGG-GOSISDBHSA-N 463.966 0.751 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CS(C)(=O)=O)CC2)CC1 1833484667 FWGLYDIRDRGHNN-WMLDXEAASA-N 452.017 0.493 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1 1833564325 YANJGFAYFLDMRP-NRFANRHFSA-N 488.006 0.961 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)cco3)CC2)CC1 1834344375 CQLDIPRGJOYVED-UHFFFAOYSA-N 468.514 0.137 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ncc(F)cc3F)CC2)CC1)c1ccc(B(O)O)cc1 1834797424 JULBRHJICHDRCP-UHFFFAOYSA-N 472.301 0.539 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCOc3ccccc3)CCO2)C1 1834829444 KLBPTMXJUXTCHH-DEOSSOPVSA-N 483.525 0.224 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cn3cccn3)CC2)CC1 1834883305 QSUFBXUBSXMROI-WPWMEQJKSA-N 468.562 0.589 50 20 JCGD Cc1nc2ncccn2c1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835373470 GBJFBMNZNJGSJO-UHFFFAOYSA-N 490.373 0.217 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCN(C)CC3)CCO2)C1 1835404721 LGXWILBYLWDXTE-YLJYHZDGSA-N 475.428 0.254 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1 1835844296 QVZJMGOUXJKNEL-FXAWDEMLSA-N 465.422 0.945 50 20 JCGD Cc1c(Cl)cccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835926277 KANWMNSXDGRARB-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccncc34)C2)C1 1835939382 PBJLWLMMJYZWFE-RUZDIDTESA-N 475.310 0.298 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cnccc4c3)C2)C1 1837459632 UCSJCBZCHKHQLO-VWLOTQADSA-N 490.520 0.617 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cnc4snnc4c3)CC2)CC1 1837921135 DDPGVBWOBKKSKN-UHFFFAOYSA-N 495.370 0.692 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1 1838085955 LBTFLBGVXXCFLM-QZTJIDSGSA-N 457.934 0.990 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])CCO2)C1 1838544776 RNKOXJLJHFNLTK-UWJYYQICSA-N 484.937 0.985 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)[nH]n3)CCO2)C1 1838661774 SEQIPGTYUMHFMU-QFIPXVFZSA-N 487.469 0.935 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)cc1F)CCO2 1839006738 QPPGGUCRDUDKOG-NRFANRHFSA-N 454.474 0.408 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1839205091 NLSVRZLATAKKBO-CKFHNAJUSA-N 467.922 0.253 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3nscc13)CCO2 1839576393 VOQZRMLRIQTQHT-QHCPKHFHSA-N 496.549 0.679 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1c[nH]c3c(Cl)cccc13)CCO2 1839589400 NKGBMJBSYVKZIA-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1839963821 XNCUYNQDWQYYDK-APWZRJJASA-N 462.385 0.339 50 20 JCGD COc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1C 1840187361 VMKCEMVGRRAUEQ-HSZRJFAPSA-N 462.547 0.447 50 20 JCGD COc1cc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840641798 ZBPRKGCXIUMDQE-QFIPXVFZSA-N 466.510 0.277 50 20 JCGD COc1cc(N2CCC(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)CC2)ncn1 1841460948 OPBIIHSAEDDHAV-UHFFFAOYSA-N 473.578 0.278 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)CO2)C1 1843014998 XHCVNKKBDYYPLC-SFHVURJKSA-N 499.373 0.209 50 20 JCGD C[C@H](Br)C(=O)N1CCCC12CN(C(=O)Cc1csc3c1c(=O)n(C)c(=O)n3C)C2 1846178272 NJZWAVGDDDWTAR-NSHDSACASA-N 483.388 0.828 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1 9931189 XEURCAMKORQYSM-ZDUSSCGKSA-N 481.508 0.412 50 20 JCGD CCn1c(NNC(=O)CNS(=O)(=O)c2ccc(NC(C)=O)cc2)nc2ccccc2c1=O 10679930 BBJRTJXDAKKWHF-UHFFFAOYSA-N 458.500 0.796 50 20 JCGD O=C(CN1CCC(NS(=O)(=O)c2cccs2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 11154221 PPADIRJLVSRBEG-UHFFFAOYSA-N 467.529 0.860 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c2ccc(Cl)nc2)cc1 14154001 XZCMUBITRPIWAN-UHFFFAOYSA-N 454.892 0.716 50 20 JCGD Cc1ccnc2nc(C(=O)NNC(=O)c3cccc(S(=O)(=O)NCc4ccccc4)c3)nn12 24820742 YBGOBXWIKBFCKS-UHFFFAOYSA-N 465.495 0.986 50 20 JCGD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 727608364 OXAZFJKCOUZYLK-OAHLLOKOSA-N 497.599 0.615 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CC[C@H](C(F)(F)F)NC3=O)cc2)CC1 728214878 UHQRBJDIYBGLPE-HUUCEWRRSA-N 463.482 0.523 50 20 JCGD O=C(COC(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)NNC(=O)[C@H]1COc2ccccc2O1 728328465 UBPPQYWAEORWAT-GOSISDBHSA-N 467.394 0.925 50 20 JCGD COc1ccc(CC(=O)NNC(=O)CCOc2ccccc2)cc1S(=O)(=O)N1CCOCC1 747181028 FAOSQBPZOXMUHT-UHFFFAOYSA-N 477.539 0.875 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(C)c2)cc1 748689943 QVCOEHWSFXMYJH-UHFFFAOYSA-N 485.540 0.397 50 20 JCGD C[C@H](NC(N)=O)C(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1 750600568 GBTYWIPEDGKJKT-SFHVURJKSA-N 452.559 0.988 50 20 JCGD CS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 903927146 IUDMOFXEKHEOPK-UHFFFAOYSA-N 487.581 0.498 50 20 JCGD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 915872273 AUIAXNPHPICTPZ-GOSISDBHSA-N 486.616 0.826 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(C#N)cc3)C2)c1 1318155676 FXQREROIJGIKEL-INIZCTEOSA-N 455.496 0.623 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778057392 XZCVLFBZLPLCHP-ODXCJYRJSA-N 489.330 0.798 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1 1778243788 MFGQNBMNEAOMIH-JMRQAQLSSA-N 465.510 0.954 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2C1 1778368203 DWOAZZFOFDPXDF-YCRPNKLZSA-N 498.968 0.072 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cc1 1779371560 ZPYSLRJSPVNWSS-TYBLODHISA-N 497.552 0.555 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1[C@H]3C=CS[C@@H]31)C2 1779374751 ZNJUMZACRPVAGT-VEYJHQLJSA-N 457.556 0.688 50 20 JCGD C=C(C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)C(F)(F)F 1779376099 XQMJTZDCNKKZSW-DNVCBOLYSA-N 455.437 0.931 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779394347 SZSTZFDPNJXVBS-OMXJDXKCSA-N 482.545 0.103 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1csc(N)n1)CCO2)NC(=O)NCc1ccccc1 1780970119 SFHZAHUCNQFWNP-JOCHJYFZSA-N 487.586 0.515 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1 1781133519 ONURPFNDEXQDTF-FXVMGJAWSA-N 470.574 0.969 50 20 JCGD CN1CCCn2nc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cc2C1 1781335326 XOOQQCLLHZHLSQ-QAPCUYQASA-N 458.332 0.853 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](CN)c1ccccc1)C2 1782210825 PZCBQWMGDXIDJI-YOSAUDMPSA-N 459.591 0.616 50 20 JCGD O=C(Cc1ccc(Br)cn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1785383684 USCFGBMPJFZWJS-DDWPSWQVSA-N 460.756 0.966 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786984982 GAJOCDULZGSARM-VJBMBRPKSA-N 450.344 0.819 50 20 JCGD O=C(Cc1n[nH]c2cc(Cl)ccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789713500 ZBGKHKXJQPNEBD-OHEPNIRZSA-N 496.760 0.732 50 20 JCGD Cc1cc(C)n(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)n1 1791508684 KTCQVUWTEOGSPA-VDGAXYAQSA-N 469.546 0.182 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792237595 PYQPJMWIZOTWOK-VOAKCMCISA-N 478.434 0.857 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1793086174 YGNLAVKBAUDVQQ-FQLMCAECSA-N 478.384 0.637 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)ccc1Br 1795739724 FZVGXXSBDGSKAN-XEMDLRDOSA-N 487.159 0.954 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)c(F)c(Cl)c1)C2)c1cccc(B(O)O)c1 1795740659 GUKMOMRIQOGKCN-HBCWATKFSA-N 464.661 0.815 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)nc2n[nH]cc12)c1ccc(B(O)O)cc1 1796517633 UVXVVDASAPQFCL-QDMKHBRRSA-N 453.695 0.857 50 20 JCGD Cn1c(=O)n(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)c2ccccc21 1797955990 UBMLSINNYKQGIT-VPTLXERWSA-N 460.607 0.781 50 20 JCGD Cn1ncc(Br)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798440453 SKPBXXNRCBEBGK-ZSBIGDGJSA-N 476.335 0.747 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1nccn1)C2)[C@H](Br)Cc1ccccc1 1800436635 LOYQDRMPTSFSMM-SFNKJDCFSA-N 462.348 0.874 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2 1800839888 RZDVYFUSBMTWHF-LORHWOILSA-N 455.379 0.882 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)C2 1800978353 BGEBCBDEDFRQJW-CNGORYIKSA-N 455.914 0.787 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(Cc3ccccn3)CC1)C2 1801009620 TWFOVUWOZVWEAX-IRJINJETSA-N 486.617 0.256 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1802160188 ZSJJVASFYXQLST-AIEDFZFUSA-N 493.964 0.452 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnc(OCF)cn1 1805030965 KKJTUUCBVFAVFA-UTKZUKDTSA-N 479.277 0.491 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n[nH]1 1805253814 CLXBMEGCJPKJGK-LAUBAEHRSA-N 461.287 0.321 50 20 JCGD Nc1ncc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1 1807365308 UIVIFAYHNDUMPR-QAPCUYQASA-N 451.317 0.434 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)COc2ccc(O)cc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807367003 WQSFHJLTROATKA-DVECYGJZSA-N 475.310 0.866 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ncn(-c2ccccc2)n1 1808547866 FPBKKOROXSIWBE-NZQKXSOJSA-N 496.336 0.976 50 20 JCGD COCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1808821399 NUDPPJUKRRUDEY-UWJYYQICSA-N 464.287 0.529 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)C1 1809968473 YOLYKSCJAFAGAV-OALUTQOASA-N 456.348 0.801 50 20 JCGD C[C@@H](C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)[C@H]1SC(=N)NC1=O 1809977947 MDXWVTUOGOQLJP-RHSMWYFYSA-N 472.376 0.014 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812715951 AXXZCEQQBMFFTB-YXJHDRRASA-N 457.369 0.157 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1 1813071632 VBFFRJYJWXQPOQ-KDOFPFPSSA-N 458.479 0.406 50 20 JCGD N[C@H](CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1cccnc1 1815172438 LFNJCMBLRQMAJB-IAGOWNOFSA-N 465.344 0.534 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1COc3ccccc3O1)CC2)c1ccc(B(O)O)cc1 1815336706 AGOHTGKUGRLWRK-HNAYVOBHSA-N 479.323 0.889 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1 1817815649 OTVZIDPYFHZMNW-ZDUSSCGKSA-N 459.543 0.693 50 20 JCGD Cc1c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)cn2[nH]cnc(=O)c12 1821217311 FMCLBUKAFGEZHK-CABZTGNLSA-N 450.908 0.613 50 20 JCGD Cn1cccc1C(=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1822866488 DRFQSDIHXLPGIS-MRXNPFEDSA-N 464.486 0.936 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cc(C)c(O)nc2=O)n[nH]1 1823370043 FYPPZRSOXHPYNN-OCCSQVGLSA-N 452.899 0.927 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824395715 GJPFPSSRHWZREQ-KXBFYZLASA-N 458.563 0.833 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CS(=O)(=O)N1CCCC1)CC2 1825998310 HWGGIYCQDQSPDT-NWDGAFQWSA-N 464.997 0.735 50 20 JCGD Cn1nncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548017 CKZGKJRCYYRYDT-AVRDEDQJSA-N 490.948 0.481 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc[n+]([O-])c2)CC1 1828923587 NKRLQQAXABCPOV-HXUWFJFHSA-N 452.515 0.866 50 20 JCGD CC(=O)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829300609 GZNHSGWQFONOGI-AVRDEDQJSA-N 480.949 0.174 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830363715 KOGGCOURPCIUJX-OPAMFIHVSA-N 492.013 0.984 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830736481 SPIRXZQTOQQNCA-TVTNDZMWSA-N 483.949 0.357 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830737385 HGACBYULYBOHSD-UWJYYQICSA-N 454.907 0.072 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 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O=C(O)c1cnncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834823445 VNZFHEDFAGWSPF-KRWDZBQOSA-N 457.281 0.030 50 20 JCGD CC(C)(C)c1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1835269770 WGCIMBNOSKUXRW-UHFFFAOYSA-N 493.417 0.953 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@@H]1Cc2ccccc2O1 1835476540 HWHLMCVJJQFRFR-DEOSSOPVSA-N 477.370 0.555 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)Cc3ccc(O)cn3)CC2)CC1 1835737381 MZFQVBDPNISMQL-UHFFFAOYSA-N 481.557 0.214 50 20 JCGD CC[C@@H](NC)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835907792 TZKBYNUHRSRMLO-XFQAVAEZSA-N 477.002 0.573 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939626 VXZJZRFABRJXDQ-VWLOTQADSA-N 482.342 0.376 50 20 JCGD Cc1cc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1 1835941058 FFXPPGDPJBOLPO-RUZDIDTESA-N 466.343 0.675 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CS(=O)(=O)N3CCCC3)CC2)CC1 1838101500 RVMCNNVPHZHUKI-SFHVURJKSA-N 480.027 0.664 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cc4cccnn4n3)CC2)CC1 1838394802 YRNGHOPRDLOBOB-UHFFFAOYSA-N 492.540 0.654 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)nc2N1 1839199846 WTEQOORIGGUENZ-BEFAXECRSA-N 485.310 0.727 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc2s1 1839524049 SLYQTGCTQSQPBJ-HSZRJFAPSA-N 483.355 0.601 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4ccc(F)cn34)CCO2)C1 1839592334 BBUHCWHTFQQCNT-QRWLVFNGSA-N 454.886 0.797 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1840017987 PBKSAHOIWLYCQD-IFOZNXLVSA-N 477.945 0.607 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn1 1840032765 JRQQNMWCNSCUCV-ORAYPTAESA-N 470.320 0.722 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)CCO2)C1 1840059687 MSLBQQPHTVJPQL-FSNCLGKMSA-N 489.997 0.831 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(OCC3CC3)cc1)CCO2 1840749075 DAVVVSRWKCSNHM-SANMLTNESA-N 494.353 0.539 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847565291 LHNJHAJGGKNBIM-YESZJQIVSA-N 477.986 0.736 50 20 JCGD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)[C@H]3COc4ccccc4O3)C2=O)cc1 21191019 IKLCYTMZANPYEF-VGOFRKELSA-N 454.439 0.450 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c(C(=O)OC)s1 726520818 OTGWUTLJHWXCQP-UHFFFAOYSA-N 466.453 0.995 50 20 JCGD O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1 749222429 XYGDDYSHCSZTNB-UHFFFAOYSA-N 456.459 0.653 50 20 JCGD O=C(COC(=O)CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)[C@@H]1COc2ccccc2O1 760426815 OILXZIDXMHUJLB-KRWDZBQOSA-N 497.913 0.539 50 20 JCGD O=C(COC(=O)CNC(=O)c1ccc(Br)cc1)NNC(=O)[C@H]1COc2ccccc2O1 793026107 HFLKEJPECFXUCC-MRXNPFEDSA-N 492.282 0.710 50 20 JCGD CN1CCN(c2cccc(Cl)c2C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)CC1 915958779 WFLWSAGQAGLABM-UHFFFAOYSA-N 465.967 0.127 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCCN1CCN(c2ncccn2)CC1 916267612 ZBODFXWGZLTORK-UHFFFAOYSA-N 495.632 0.531 50 20 JCGD C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1 916391891 MCPGDYVJQHTIHZ-AWEZNQCLSA-N 457.462 0.696 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1 916648939 FVHFIRXICXYKDU-UHFFFAOYSA-N 488.526 0.647 50 20 JCGD O=C(NNC(=O)c1ccnc(-n2cncn2)c1)c1cccc(S(=O)(=O)N2CCCCC2)c1 919743193 JJCJWUMANSPCQQ-UHFFFAOYSA-N 455.500 0.912 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCN(C(C)=O)CC3)cc2)cc1 919832755 JKKGZCLMJVFYHB-UHFFFAOYSA-N 488.566 0.942 50 20 JCGD COc1cccc(CC(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)c1 921071412 OXYJEIKCIADGAA-UHFFFAOYSA-N 464.486 0.412 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1S(=O)(=O)N1CCOCC1 1115819731 WCIYMYSRQVJOKG-SFHVURJKSA-N 477.495 0.317 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ncccn13)C2 1778090959 JCBCZIDTKDOZDD-VFHFUPNESA-N 492.540 0.991 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031891 GVCCERRHNLSODU-OYHNWAKOSA-N 453.503 0.024 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779035458 HWFNSCOGOBIKEN-GAJHUEQPSA-N 490.561 0.432 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1 1779593680 HGCUFKAMJKSHRN-HSZRJFAPSA-N 476.497 0.228 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)ncn3)C2)C1 1779818323 RFCJOHKJVDDHAR-HMHIXTCJSA-N 459.894 0.708 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1780098483 MRMFDQFZERTFGO-QFIPXVFZSA-N 491.501 0.337 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2)C(=O)C1 1780797367 YTYDSPVYPXPIGZ-XMMPIXPASA-N 484.557 0.616 50 20 JCGD COC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968499 BAGBDNWFZGZJRE-QHCPKHFHSA-N 475.546 0.116 50 20 JCGD C[C@H](NC=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 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O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)nc3sccn23)[nH]n1)c1cccc(B(O)O)c1 1817476618 MWINWBWEWJMNGU-MRXNPFEDSA-N 492.326 0.779 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)[nH]n1 1819403963 POSJMUSHOUTXJS-HOTGVXAUSA-N 475.531 0.291 50 20 JCGD CC[S@@](=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1819515332 YUIIBODTFHMZQV-AJHPHWTPSA-N 464.573 0.526 50 20 JCGD Cc1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn2[nH]cnc(=O)c12 1827052672 WWEZMYUIHZDSPF-NRFANRHFSA-N 491.357 0.558 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2n1 1830736031 PWWWNSPENZLTOU-UWJYYQICSA-N 450.923 0.621 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831246711 XBTKAGZBPWACTK-OZXSUGGESA-N 494.353 0.141 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1831437444 ALOBILJIDVSCSX-SUMWQHHRSA-N 467.382 0.380 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cccnc3OC)CCO2)C1 1833004658 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CCn1nc(C(C)C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1838809400 XVSTYLKZNCAZHV-XMMPIXPASA-N 484.362 0.090 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839203716 UDTJKEGMCFACEK-JCKWVBRZSA-N 460.300 0.996 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2n1 1839626905 AYCPZBWBUKPLNF-DEOSSOPVSA-N 486.573 0.394 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839744004 KBDCJZOOYCEXMN-LHMGHXNASA-N 491.495 0.775 50 20 JCGD Cn1nncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839801963 IVTNQFJFPJAJAK-LAUBAEHRSA-N 492.374 0.891 50 20 JCGD CC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839860873 RJJKLWUQEYXKDM-NSKACUHBSA-N 462.453 0.464 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(N4CCOCC4)n3)C2)C1 1840033068 RTSCMWQGEYRRGJ-IERDGZPVSA-N 497.390 0.772 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)C1 1840151170 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NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CC34CCCN3CCC4)C2)C1 1781136550 XWKYFUZTJOPAIH-QHCPKHFHSA-N 456.547 0.147 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1)C(C)C 1781387155 QFGOPNXCTJMAQL-GXYOHSSGSA-N 490.960 0.722 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1781934548 PWWCAFCDWMUSDV-UZUQRXQVSA-N 490.561 0.337 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccccc1C#N)C2 1782214365 RJTNHMCRNCRJAT-HYBUGGRVSA-N 471.558 0.824 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cccc(F)c3F)C2)C1 1783386998 YWXHAHGYYFOCHK-QFIPXVFZSA-N 459.453 0.650 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1 1783535030 VWDCQDCDEJESFA-SCLBCKFNSA-N 474.377 0.853 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4ccccc4[C@H]3O)[C@H]2C1 1784151038 CZBILTOABVTHTA-NGVXDUQMSA-N 493.564 0.574 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cnc(C)s3)C2)C1 1784436443 VCERTNXXCFBFHG-GQBLCDNYSA-N 458.544 0.958 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C2)C1 1785223953 UDDHLHSSYCZKAQ-JTSKRJEESA-N 461.902 0.813 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCOC3)C2)C1)NC(=O)NCc1ccccc1 1785497625 WOWFXJKOUKFMEC-YKSBVNFPSA-N 473.574 0.589 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980957 HACJNUJRDNIEOY-QRTARXTBSA-N 465.237 0.620 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3COc4ccccc4O3)C[C@@H]21)c1cccc(B(O)O)c1 1786983542 RQVNZUHLIBMWIW-USKVXJDGSA-N 480.326 0.190 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cc(C)cn3)C[C@@H]21 1787508508 ZMDIXKSAKNOEBK-MVOWZPSLSA-N 469.546 0.866 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1787508901 QLEYXWJCABANLJ-DVBSWERSSA-N 468.352 0.885 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc4ccccc34)[C@H]2C1 1787903054 NNCMIEHYMRRNJL-JBYOLUDKSA-N 490.520 0.846 50 20 JCGD CC(C)n1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788930959 FJJTYUKEFXRCGE-FNHZYXHNSA-N 455.519 0.370 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789874816 BFBWNBSKNJDKRO-JBACZVJFSA-N 479.342 0.215 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(NC(=O)C2CC2)cc1 1789989554 FCPLRUZKCVRUNW-VJBMBRPKSA-N 491.353 0.622 50 20 JCGD N=C1NCCN1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)Cc3ccccc3)[C@H]2C1 1790780878 YJSFLULCTKFIQH-OKYOBFRVSA-N 492.418 0.812 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1791236799 ZMTFLEBGWJDKAA-MMRYBOCRSA-N 499.568 0.856 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2 1792872394 DADPBLYSROWMGK-ZIEJDFEHSA-N 494.346 0.913 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792975214 MCUDXNWJDMDBCC-QKGUJMCYSA-N 497.980 0.364 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792983126 FGHUILVPRAPYDU-ZXPKRNLXSA-N 457.955 0.574 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2cccc(F)c2)CC1 1793780342 GQAHSSQZZGNNAZ-UPHUGPLXSA-N 452.291 0.441 50 20 JCGD Cc1noc(-c2ccccc2)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795738953 MGGMKPQEAMNQAD-HATOLVCRSA-N 475.310 0.847 50 20 JCGD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c(C(F)(F)F)o1 1796409406 VBLRHRXRTZDYBF-JJLQDPRZSA-N 461.441 0.578 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2 1796439504 ICLSTOHEGYYETQ-NIXXUYISSA-N 491.398 0.065 50 20 JCGD CCc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1Cl 1797749649 ISKIFCFEOALKSR-DPIQGUFMSA-N 475.937 0.151 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)ccn1 1798094751 XDHFEDULNAXFIH-IUTQVRIDSA-N 480.569 0.939 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1cc(=O)nc2sccn12 1798414391 AMWSQXFRYFTXBU-OTMMVIPVSA-N 459.297 0.650 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1799219828 USDRQENBXSNMPP-ZYKCCNLVSA-N 478.458 0.836 50 20 JCGD Cc1nn[nH]c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799871532 MJYVNRWGIBMXIN-BCDXTJNWSA-N 454.535 0.711 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(F)(F)F)C2 1801009415 GTRYIAQOFSIUII-IVWMJMPLSA-N 457.453 0.677 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1[C@H]3CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C3)C2 1801421814 YXBOUUBNIJWLBR-FFGOWVMKSA-N 494.357 0.254 50 20 JCGD Cn1cccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1=O 1803831018 RNSDPDFBAGDTNW-NQIIRXRSSA-N 460.299 0.094 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnn(-c2cccnc2)c1 1805073296 GMFZCYSTSIADCF-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1 1810303292 PSSHXCDATDQRGD-HRAATJIYSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1 1810305333 KBZSYDJLTOKEIW-DYVFJYSZSA-N 493.446 0.078 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1816015391 VJZMXSANNSLWTN-KXBFYZLASA-N 450.308 0.928 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817475424 OASGBGCFYKNVPT-HJCTWCACSA-N 451.292 0.254 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)n1 1820087583 FJKFHYIVYJWVJB-AAEUAGOBSA-N 453.952 0.955 50 20 JCGD C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1 1822184879 QJGUZXMZZMKEBM-JSGCOSHPSA-N 476.397 0.916 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1822574297 DQMFSDXCNSRHBF-HNNXBMFYSA-N 488.375 0.962 50 20 JCGD Cc1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c(=O)[nH]c1C 1825449607 YOEQLLIVDKDMKC-GOSISDBHSA-N 460.579 0.993 50 20 JCGD COc1nccnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827056127 PEEQJCQMYJTSDD-LJQANCHMSA-N 452.320 0.712 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)CC1 1827641618 FSPDSJJQEPZRFT-VXKWHMMOSA-N 479.585 0.883 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)[C@@H]1SC(=N)NC1=O 1827669979 XKCCORIPJDUPSC-JVPBZIDWSA-N 486.403 0.402 50 20 JCGD CC(C)(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cn1 1829567410 OPDPNFHYWPCZBZ-VWLOTQADSA-N 481.358 0.443 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1 1829882024 YPVXLSYVFOOHCE-QVKFZJNVSA-N 475.970 0.347 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC(=O)NC1)CCO2 1829960274 LOVGGAYRRRRRNW-TUXSKGRZSA-N 488.491 0.854 50 20 JCGD COC(=O)C12CC(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)(C1)C2 1831602423 KAINRHGGMUFJJJ-LXKSKSEUSA-N 468.359 0.943 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)[C@H]1SC(=N)NC1=O 1831870739 DEXIDIJTHHUVQS-URLQWDBASA-N 480.635 0.782 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)[C@@H](O)CCl 1833313846 WCMINEHFNZXHHP-AWEZNQCLSA-N 463.025 0.018 50 20 JCGD O=C(COc1ccccc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834468746 FTOUTHXJLKIHEB-UHFFFAOYSA-N 465.359 0.631 50 20 JCGD Cn1cc(F)cc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798491 BQPYGVOBHAZJGT-UHFFFAOYSA-N 456.327 0.343 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834800596 QOVMNUFCITTYDD-UHFFFAOYSA-N 497.376 0.942 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)CC1 1835510843 JQBJTKRBIPLJSV-IBGZPJMESA-N 490.418 0.413 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc2cccnc2n1 1835529664 GUDHLSGHQXOQGQ-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD O=C(Cc1ccccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929629 ZIILJMRYDBPXTM-QHCPKHFHSA-N 472.734 0.333 50 20 JCGD O=C(c1cccc(C(F)(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931293 LULWHMDSSLALKO-JOCHJYFZSA-N 492.259 0.769 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835934259 RVDHVWRBFSQRDF-RUZDIDTESA-N 482.342 0.132 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccccc34)C2)C1 1835937069 NJADVWCUTFNYBH-AREMUKBSSA-N 474.322 0.903 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1cccc1C=O)CCO2 1835953637 FOCQOONMILPBQB-ZKEKNWOOSA-N 498.540 0.452 50 20 JCGD O=C(NCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccco1 1837920117 BVALTXRULWEKCJ-UHFFFAOYSA-N 483.330 0.002 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc4nncn4c3)CC2)CC1 1838330363 QSONIJLMZJHXRR-UHFFFAOYSA-N 492.540 0.654 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1 1838760081 HUXOHUFOZWYHEB-UGSOOPFHSA-N 458.357 0.887 50 20 JCGD C[C@@H](S)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054109 HDSDBQQABLKJRX-VGSWGCGISA-N 479.603 0.107 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1839152941 OKMNJWPWFVVZKK-RTBURBONSA-N 461.346 0.972 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1 1839261332 VWLDCNIBVIEKET-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1839384754 PVARDQOBUDAIPY-JLTOFOAXSA-N 463.959 0.551 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1839717947 SUBURMMVIYREQE-MGPUTAFESA-N 470.910 0.620 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1840034295 HOCPTMOIWSOVGK-LKFCYVNXSA-N 470.246 0.677 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2 1840949903 ZNYKSQUSEBHSNH-FCHUYYIVSA-N 479.484 0.501 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1841428292 OPSNBVSVLWUQOS-KRWDZBQOSA-N 488.545 0.138 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@]13C[C@@H]1CN(C(=O)OC(C)(C)C)C3)C2 1846385882 HOJYCYIZVCVGCV-WAIKUNEKSA-N 463.579 0.820 50 20 JCGD COc1cccc(NC(=O)COc2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)c1 9930931 DILLWJJCKSGKIC-HNNXBMFYSA-N 461.496 0.908 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(C)c(S(N)(=O)=O)c2)c1 27205592 GIYDGNUZZHDADX-UHFFFAOYSA-N 468.557 0.748 50 20 JCGD O=C(COC(=O)c1sccc1S(=O)(=O)N1CCC(O)CC1)NNC(=O)c1cccs1 727873264 LAUUDHDHPBDDHV-UHFFFAOYSA-N 473.554 0.573 50 20 JCGD O=C(COC(=O)[C@@H]1CCN(c2ccc(F)cc2)C1=O)NNC(=O)[C@H]1COc2ccccc2O1 728335856 RUUWPTUJAMVYDR-CRAIPNDOSA-N 457.414 0.709 50 20 JCGD COc1ccc(NC(=S)NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1 729692969 AXFYCUCSVRSOIK-UHFFFAOYSA-N 466.545 0.088 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 744896145 MGWBVVKHVWWUBW-UHFFFAOYSA-N 483.595 0.476 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CN2C(=O)[C@@H](C)Oc3ccccc32)cc1 811956792 WPBBJQOSYFQDTC-OAHLLOKOSA-N 460.512 0.577 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)Cc1c(C)nn(C)c1C)N(S(C)(=O)=O)CC2 812191104 RPOGHTRZNKZYPN-SFHVURJKSA-N 493.586 0.693 50 20 JCGD C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C2=O 915789062 BUQUMVYOFWYAJD-PRWKNARSSA-N 499.977 0.885 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc(Cn2cccn2)o1 915808433 QFPVEKPSOKKZJD-UHFFFAOYSA-N 487.538 0.939 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)NCCCN(C)S(C)(=O)=O)c2ccccc2c1=O 916580442 ZSDCDEGCHLWVFQ-UHFFFAOYSA-N 466.564 0.812 50 20 JCGD O=C(COC(=O)C1=NN(Cc2ccc(F)cc2)C(=O)CC1)NNC(=O)[C@@H]1COc2ccccc2O1 917282483 TUISZFYEQQLBAF-IBGZPJMESA-N 484.440 0.835 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)nc4ccccc34)C2)C1 1777760717 DOPKGLVCOIIWPW-XMMPIXPASA-N 476.493 0.696 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nnsc2C2CC2)C1 1778294074 KORROAGIXMMSPJ-QVKFZJNVSA-N 464.592 0.916 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1778380165 JABMKEUAOOWSFX-BFUOFWGJSA-N 468.352 0.491 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1nc2ncccn2n1 1778589206 QAACOMAIMAKNGE-PSTGCABASA-N 455.288 0.942 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030470 ATHWUVCUGCSZBU-QRQCRPRQSA-N 453.503 0.024 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CNc3ccc(F)cc3)CCO2)C1 1779031259 POPGMDWFFKTRDG-QFIPXVFZSA-N 456.478 0.380 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1779179441 FPWPSPGPAKGKIB-XTQGRXLLSA-N 458.288 0.115 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)COc3cccnn3)CCO2)C1 1780099169 XDVYAIUMAMZTFL-QFIPXVFZSA-N 485.453 0.833 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1780293001 SURFNRXNXQSTLN-XMMPIXPASA-N 475.509 0.833 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781334395 NHQCVNMAMBEYTH-BEFAXECRSA-N 473.295 0.970 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)CC(=O)N3)C2 1782215222 ZDSKCLLCOHDIRR-NTKDMRAZSA-N 471.558 0.682 50 20 JCGD O=C(C1CCN(c2ccc(F)cn2)CC1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1782797261 MZMBDXFWSDSAJY-UWJYYQICSA-N 454.930 0.867 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1 1783448705 CCHGQFUJEULAJQ-KBMIEXCESA-N 499.373 0.067 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1 1783611382 MYLGBVQWZFBNJZ-SIFCLUCFSA-N 490.395 0.972 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C[C@@H]21)[C@@H](O)CCl 1784090833 DDFKLMCMMYHCJA-LVGORTOPSA-N 455.851 0.517 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1785607532 OIMLVLKXRWLEGD-WIEQDCTASA-N 474.986 0.993 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1785725446 UFZMNRNHYIYVOK-AVYPCKFXSA-N 461.943 0.052 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](N)c3ccccn3)[C@H]2C1 1786871777 UIAGYWWHYRTPAQ-JGTSNIRHSA-N 467.530 0.195 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COCc3ccccc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979423 HMECBXCJIYDBEO-BVSLBCMMSA-N 452.316 0.177 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1NC(C)=O 1786984912 XXRFAXGSWOBVNN-LEDOBFOHSA-N 495.341 0.241 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](COC(C)=O)OC(C)=O)[C@H]2C1 1788640488 SAHAOSQGYGTQNT-KSWRQPAISA-N 477.352 0.634 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)C[C@@H]21 1791293076 IDSGDIVNFCSBPH-VJANTYMQSA-N 495.621 0.739 50 20 JCGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)ccc(F)c1F 1791974911 ZEBXZXLIICVYOB-QSFXBCCZSA-N 458.270 0.860 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@](C)(O)CC(=O)O)C2 1793879246 SEGBHMVUUDBYQB-ZTKXOMSMSA-N 491.969 0.324 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn(C)n1)NC(=O)NCc1ccccc1 1794935141 CGYNVUVDDVZTHW-BCDXTJNWSA-N 454.535 0.413 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C)nc1)C2 1796439544 JTFRNZYMHMYQPA-MQRYTSQFSA-N 452.515 0.656 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)CC2)CC1 1797894549 LHCKTXNJZBDUSR-NRDMVMEKSA-N 469.026 0.947 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccc2)no1 1798138147 SJRPUINXQQGMLP-VPTLXERWSA-N 476.493 0.857 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2 1798443622 ONPWAJSWISHOCS-VBUUOAMHSA-N 488.504 0.680 50 20 JCGD Cc1cncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)c1 1799095073 SQIWUARCOKBOGB-IUTQVRIDSA-N 480.569 0.939 50 20 JCGD CN1CCC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)C1 1799118851 XMNWUXOIQHMQMY-CUDBPUKSSA-N 486.617 0.264 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC(=O)NC1)C2 1800329851 GNVCDLDJXQCMBB-PUPWTTRCSA-N 458.465 0.988 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800725208 OVFLBSCJFCRKBH-AYBFGTKDSA-N 471.982 0.964 50 20 JCGD Cc1nc(Br)sc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801011524 RRCVXBKHUWDFKG-JJLQDPRZSA-N 488.408 0.790 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1 1804417190 GGIPHYHFBFVMKM-QRWLVFNGSA-N 493.484 0.205 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361523 IOMYIDFZFULYPF-REWPJTCUSA-N 496.336 0.976 50 20 JCGD O=C1Cc2cc(C(=O)N3CC[C@H](CNC(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)ccc2N1 1807361847 JMCXPVVAEDCRIC-DVECYGJZSA-N 484.321 0.889 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371021 OCJHARFESPPDHY-XUZZJYLKSA-N 496.336 0.976 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)nc1 1807678143 PTJQVNGFGSZNCZ-UHFFFAOYSA-N 485.371 0.324 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1 1807997683 CVNIXVGUXVFQLW-YCRPNKLZSA-N 456.503 0.580 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CC2)C1 1809980702 PDTADEWEBTYJDU-TZIWHRDSSA-N 467.375 0.612 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)Cc2cccnc2)[C@H]1c1cccnc1 1810303626 UDXLGNKDENWHDP-COPCDDAFSA-N 488.552 0.365 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1 1812299999 SOFDKKSTKSPQGL-KKSFZXQISA-N 485.508 0.985 50 20 JCGD Cn1cccc1C(=O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1813478583 AFWIORMREDICBI-OXQOHEQNSA-N 475.509 0.621 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362010 YHCMHKDHBGJQNO-WBMJQRKESA-N 453.333 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCn2ccnn2)n[nH]1 1822808986 ZPEFRMQADQWCQX-INIZCTEOSA-N 452.479 0.396 50 20 JCGD O=C([C@@H](O)CCl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)CCN2C(=O)OCc1ccccc1 1829427990 HXWBAZAKILMFDM-JPNCOXSSSA-N 491.972 0.931 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc2)CC1 1829693830 YFMUXKIPTRSWNF-NFBKMPQASA-N 480.993 0.108 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1830542616 ASCXCGZQYRCBDD-PXNSSMCTSA-N 487.439 0.254 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830735291 GHQZXFBNKFKJCA-MCFFVMPBSA-N 487.981 0.300 50 20 JCGD CN1CCCn2nc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)cc2C1 1831042719 FNJPWFNIAHVHHO-XMMPIXPASA-N 493.417 0.946 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)s1 1832884462 KRQMJJJLUDUHPS-QHCPKHFHSA-N 472.372 0.439 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1833263034 GZCHLEKAZLPXTO-QRWLVFNGSA-N 475.428 0.240 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1)[C@@H](O)CCl 1833313680 MYQMMRMAOXIXDU-MNEFBYGVSA-N 454.999 0.559 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1833924316 SJMROCRSUCGDEH-UHFFFAOYSA-N 493.373 0.219 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C[C@H](NC)C(=O)O)CC2)CC1 1834740197 SGABUCDJKBQAAG-CVEARBPZSA-N 461.401 0.794 50 20 JCGD CN[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1)C(=O)O 1834741660 BQCSDSLXTVVLFF-KXBFYZLASA-N 451.395 0.857 50 20 JCGD N[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccnc1 1834762952 VJEIYTMZPBCACI-QHCPKHFHSA-N 479.390 0.037 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCC(F)(F)C3)CC2)CC1)c1ccc(B(O)O)cc1 1834797780 FGGKSDCDBSWBJZ-QGZVFWFLSA-N 463.334 0.987 50 20 JCGD COc1nccc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1F 1834906329 DUWYFKHCFAKPOL-UHFFFAOYSA-N 499.547 0.727 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1 1835081391 OLKWOOMQRCWCKX-GDBMZVCRSA-N 450.939 0.936 50 20 JCGD Cc1nc(N)sc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835736812 IRUGSWZGFJKWLP-UHFFFAOYSA-N 486.602 0.531 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](CN)c1ccccc1)CCO2 1835811710 MMRSDVBNQQQIGE-FRIZPYQLSA-N 496.568 0.319 50 20 JCGD CC(C)c1csc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)n1 1835927430 ONYYNCDMUYDTGN-JOCHJYFZSA-N 473.360 0.330 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)ccn1 1835927587 USECAJGGEKZTJD-RUZDIDTESA-N 481.358 0.443 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3onc4ccccc34)C2)C1 1837460192 XEIWFWXAACCDML-HSZRJFAPSA-N 480.481 0.210 50 20 JCGD O=C(C#CC1(O)CCCCC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837492808 UZBIINOGABUDCP-VQIMIIECSA-N 461.328 0.832 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc4ncnn4c3)CC2)CC1 1837919193 PLRNBQFCEUUYFF-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1 1837921141 FAMQZPIEOKWSKY-UHFFFAOYSA-N 483.378 0.639 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CNC(=O)c3ccco3)CC2)CC1 1837962665 NTMARHRGOMHMPU-UHFFFAOYSA-N 498.540 0.320 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(=O)n3C)C2)C1 1839963885 ZPRCIZICLBHFHO-AUUYWEPGSA-N 456.337 0.629 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Cc3cccc(F)c3)NC(C)=O)C2)C1 1840156893 XKQQOUPBWWVKKY-SXWKCWPCSA-N 499.967 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4ncccc34)C2)C1 1840184789 BQSOSPQZJJYOKC-QHCPKHFHSA-N 470.530 0.073 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1842185141 QGKSWUJYFXMCNT-UHFFFAOYSA-N 466.498 0.776 50 20 JCGD Cn1cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c(C(F)(F)F)n1 1844264643 SVNMKWAGHHTRIQ-UHFFFAOYSA-N 451.409 0.568 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2n[nH]cc2I)C1 1844466319 GSPRERPJWHHEMD-UHFFFAOYSA-N 495.281 0.144 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038482 HTZPNIXBBDQREB-ZHACJKMWSA-N 457.531 0.655 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)C(=O)NC3CC3)cc2)cc1 10214035 RQFNMRIXWHNBNV-UHFFFAOYSA-N 458.496 0.407 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2OC)c1 23712637 AZOAIHJBIURIAP-UHFFFAOYSA-N 484.556 0.448 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)Cc1c[nH]c2ccccc12 24455974 PAGZZAKVECASFP-IBGZPJMESA-N 492.579 0.640 50 20 JCGD O=C(NNC(=S)Nc1cccc(Br)c1)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 27011440 RNJMJKPHUIBZFU-LBPRGKRZSA-N 488.389 0.932 50 20 JCGD Cn1cc(CCCNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1 726851115 GKMPWZILXJIOKT-UHFFFAOYSA-N 478.575 0.337 50 20 JCGD Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728845027 CMGCJTFYSTXQBK-SFHVURJKSA-N 453.482 0.758 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)c1 729274948 HXUHJKNXIBPOOV-AWEZNQCLSA-N 468.557 0.803 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)Cc1ccccc1F 731344846 MNJREYZNSIJWKU-KRWDZBQOSA-N 465.503 0.758 50 20 JCGD CCCCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 749212874 RKHVLNZHGXBBNK-UHFFFAOYSA-N 467.592 0.916 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)o1 751294776 SUPWDXNUONRDMR-UHFFFAOYSA-N 455.514 0.684 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2cccc(S(C)(=O)=O)c2)c2ccccc2c1=O 903927985 NVWNFRWUZXXCRS-UHFFFAOYSA-N 464.525 0.833 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 914338879 BJWOTTIBKLMWCE-UHFFFAOYSA-N 497.603 0.182 50 20 JCGD C[C@H]1CN(C(C)(C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C[C@@H](C)O1 916234723 PGKCIWOLVFBHAG-GASCZTMLSA-N 455.581 0.769 50 20 JCGD CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 918013333 RJXWJDCHQURTNR-UHFFFAOYSA-N 462.532 0.591 50 20 JCGD CN(C)c1cccc(C(=O)NNC(=O)CSCCOc2ccc(S(N)(=O)=O)cc2)c1 918549859 ODARJWRWKFYQLH-UHFFFAOYSA-N 452.558 0.973 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 920031330 COJWEEXLJOHLQP-KRZKXXONSA-N 498.565 0.544 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N2CCC(=NNC(=O)[C@@H]3CCS(=O)(=O)C3)CC2)cc1 920371703 ZEIXQLZIPGOGHH-CQSZACIVSA-N 456.546 0.336 50 20 JCGD O=C(CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)NNC(=O)NCc1ccco1 920858294 JARGRUWKHDLYTQ-UHFFFAOYSA-N 477.499 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C2)C1 1778126745 RHFAYZIQUSICIW-QFIPXVFZSA-N 467.567 0.056 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2nc[nH]c2c1 1779010095 ZEWOQVPNAWKDAN-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029198 NTTQWPAWCAVZCJ-SGTLLEGYSA-N 454.325 0.160 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nc1 1780970952 QPPLAIINAWHDCM-QHCPKHFHSA-N 461.563 0.750 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCCN3C)C2)C1)NC(=O)NCc1ccccc1 1781030803 CQPHARCOHUYRFI-BWKNWUBXSA-N 486.617 0.647 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)n1 1781332148 UMDTUJMASQPYET-KSSFIOAISA-N 459.316 0.807 50 20 JCGD CO[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1782242319 BRCXQGIBKCCPOP-DRMXPCRNSA-N 475.590 0.881 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783940114 QLXJKXNSOQHRRF-YKSBVNFPSA-N 491.564 0.076 50 20 JCGD COC(OC)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21 1784289832 IFFLEMPITBUPCP-OWQGQXMQSA-N 465.459 0.732 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1784312660 VSPGPDHMIRJLAM-QYWGDWMGSA-N 485.969 0.275 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](Cl)COC)CCO2)C1 1785516600 OYUQDYHPCNQTIH-VTJXTGGHSA-N 491.969 0.527 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785547188 SIYRWYUVVARFGU-ZBEGNZNMSA-N 464.407 0.850 50 20 JCGD O=C(COc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1786488993 UJIDBLBRJBMGCF-NDXORKPFSA-N 456.279 0.178 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981138 UWKQRQWKQOJUIP-ZJBJCVSYSA-N 475.314 0.059 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(-c4ccccc4)ns3)C[C@@H]21)c1cccc(B(O)O)c1 1786984512 NSLKQPMMJRREFH-IHPCNDPISA-N 492.366 0.792 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)cn1 1787506937 UWXKIOQJAGNNJH-CCYFIYGFSA-N 468.514 0.818 50 20 JCGD Cn1ccc2cccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)c21 1788024798 PCBWAUQKYDCCJN-NYVOZVTQSA-N 461.327 0.765 50 20 JCGD COC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1789981924 WRKGCRUXZPLUQS-YYWHXJBOSA-N 481.314 0.452 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790960390 FLZJZMUULWUURU-DDWPSWQVSA-N 468.352 0.452 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)n1 1795114383 BSIJGBCXSAFURO-QHBPRCKVSA-N 457.281 0.987 50 20 JCGD CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C 1796908363 PUSLMRAFFWBNKX-YRPNKDGESA-N 459.352 0.460 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc3ccccc13)C2 1797750722 OFXPTWBJBWQHJL-GFENJXEQSA-N 476.493 0.456 50 20 JCGD CCN(CC)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccccc1 1800301736 MNVWYLBEUWQHOG-IYRWYFENSA-N 494.596 0.971 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2 1800760264 LNQCEQCAMGOLGW-IKVITTDRSA-N 480.319 0.665 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2 1800761732 GBBNUCVAGIMYJH-XVAUXIKLSA-N 480.403 0.995 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1scnc1C(F)(F)F)C2 1801009641 WXHXRFGSZAUHAU-GNXNZQSNSA-N 463.482 0.738 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1801157399 JSRBHAWCIWDKNG-QKDZRIPBSA-N 459.927 0.102 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc(OC)c1C 1801832628 GFLUCHQQMRGZJM-OPMZPASUSA-N 468.315 0.209 50 20 JCGD O=C(CNC(=O)c1cccs1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804571550 GHIMMHYDQCBNFS-GCJKJVERSA-N 492.366 0.573 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1 1804609937 BFYCZIFVHYCWHU-XMTFNYHQSA-N 481.594 0.634 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCC3(CCCN(C(=O)[C@H](O)CCl)C3)CC2)CC1 1805524298 OUYFSRMJWAJAMY-MRXNPFEDSA-N 450.001 0.489 50 20 JCGD N[C@H](CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cccnc1 1807259908 NHOGURNYQKJUOP-FJIJXJHWSA-N 473.342 0.566 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)n1ccccc1=O 1807374394 HEWCAUZBCLMNHV-LLBVYWAGSA-N 474.326 0.504 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374518 LAHXQXWKAIQPBQ-HFJQGTKSSA-N 473.342 0.609 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1 1808323263 JMTFGPAMWWGWAO-ICDZXHCJSA-N 484.365 0.796 50 20 JCGD N=C(N)SCCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303782 VSMNVKGRGOIOLR-KBXCAEBGSA-N 470.559 0.416 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1 1811366718 PZFAOOFTLQSSHC-VGSWGCGISA-N 454.531 0.473 50 20 JCGD CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812318209 FVXGJVVFQTWUAH-IUGYYLQHSA-N 450.304 0.121 50 20 JCGD CCC1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)COC1 1812490357 MMVQIHXOEWDTGD-LPHOPBHVSA-N 452.515 0.826 50 20 JCGD O=C(CN1CCCCC1=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1812973148 ASHZOXAPUGIQPH-XXBNENTESA-N 464.331 0.094 50 20 JCGD O=C(CNC(=O)c1ccco1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354637 OFVVNXKUZGXQAB-AWEZNQCLSA-N 468.300 0.072 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361993 XOUDJDLBQICESD-AWEZNQCLSA-N 474.348 0.573 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476433 RIVBTXUKDSDZHG-RDTXWAMCSA-N 451.296 0.323 50 20 JCGD CSCC[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819404740 WTIKWDVJNCRMPW-HOTGVXAUSA-N 461.548 0.828 50 20 JCGD CN(C)c1ncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)o1 1819795961 WLWCBBRBSLCDGK-SNVBAGLBSA-N 470.515 0.735 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCC(=O)NC2)CC1 1823836738 GHJQOMRTTVDEBF-APWZRJJASA-N 456.547 0.445 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CNC(=O)C3)sc2C1)NC(=O)NCc1ccccc1 1825203894 DGKHJANARXSVBO-CVEARBPZSA-N 499.597 0.537 50 20 JCGD CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1825218427 UQTDSQQESCFJSP-IMNSPMKVSA-N 459.532 0.714 50 20 JCGD O=C(c1nc[nH]c1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053014 SNTJUQNVKHFHIL-KRWDZBQOSA-N 455.280 0.545 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057538 HTQKBIYGWJRXFB-UWJYYQICSA-N 453.352 0.528 50 20 JCGD O=C(COCCO)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551703 SWFIVYZTSGTVGV-XMSQKQJNSA-N 483.949 0.047 50 20 JCGD CC(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1828792053 JMMSKLDUSHYBDV-VWLOTQADSA-N 493.325 0.021 50 20 JCGD C[C@H](CN)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828947545 SHNZDNSNJBTVTL-NRJQMVOHSA-N 466.966 0.633 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(OC)cc3)CCO2)C1 1830242973 VNRJLHOTSRTDRU-WIYYLYMNSA-N 456.923 0.784 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c2cc(O)ccc2n1 1830732160 VLIIMVHDCQBZAH-DENIHFKCSA-N 463.918 0.919 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830734979 BPDIHJKOLVSNBI-NXRGYDRKSA-N 469.872 0.928 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830739178 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COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc([N+](=O)[O-])c1OC 1839470449 PMWPOEIVZIFSBQ-FOIQADDNSA-N 487.893 0.282 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1839965166 PFBMRCMRDWAFBP-KDOFPFPSSA-N 471.308 0.418 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CCO2 1840089898 LMPMBMAXBNKPNM-STXHMFSFSA-N 463.959 0.610 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3C#N)C2)C1 1840156883 XGDLABMOZNOJQQ-LAUBAEHRSA-N 451.907 0.647 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(NC(C)=O)c3)C2)C1 1840156950 YQLLUCXEIFFSOH-GHTZIAJQSA-N 453.923 0.969 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2c1 1840182948 XIGZQYWFAPTSDC-RUZDIDTESA-N 485.585 0.848 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(C(C)(C)C)c3Cl)C2)C1 1840183496 HQYPJZVPXWWLCK-JOCHJYFZSA-N 499.012 0.735 50 20 JCGD O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1840188359 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Cc1ccc(NCC(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1 728204697 JHQCUSQDNXGECU-UHFFFAOYSA-N 459.572 0.869 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1ccccn1)N(S(C)(=O)=O)CC2 754573171 ADRUKGHNEBMYAI-QGZVFWFLSA-N 477.543 0.878 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)[C@@H]1COc2ccccc2O1 913416874 YZCCYERBTJOISH-IBGZPJMESA-N 477.495 0.504 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccccc2)o1 915441648 PBLJBSSBILEDEV-OAHLLOKOSA-N 493.494 0.614 50 20 JCGD CCn1nc(C(=O)NN=C(C)c2ccc(S(=O)(=O)NCC(=O)O)cc2)c2ccccc2c1=O 916321254 GHBWIHZZTCUPBD-UHFFFAOYSA-N 471.495 0.933 50 20 JCGD O=C(NCCCS(=O)(=O)Cc1ccccc1)NNC(=O)c1csc(N2CCOCC2)n1 916577335 RRRMQIMODWWXFL-UHFFFAOYSA-N 467.573 0.929 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 918540003 YVNWGKXWUMQHGB-HXUWFJFHSA-N 465.620 0.940 50 20 JCGD Cc1ccc(-n2cnnn2)cc1NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 919897038 UYBGCLCYAISGLZ-UHFFFAOYSA-N 472.535 0.450 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc3c(c(C(=O)O)c2)OCCO3)c1 919959721 YZHMOOPFXZOPAD-UHFFFAOYSA-N 456.454 0.183 50 20 JCGD O=C(NNC(=O)c1ccc(-c2ccccn2)nc1O)c1cccc(S(=O)(=O)N2CCOCC2)c1 920274613 USDNGKLMLYMOCF-UHFFFAOYSA-N 483.506 0.945 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)[C@H]1COc2ccccc2O1 920423701 XPOCVBXZTBRCKB-MRXNPFEDSA-N 450.429 0.251 50 20 JCGD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)nc1 1778385917 ZUSOBROZRJSWBC-NFBKMPQASA-N 453.304 0.211 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccccc3F)CCO2)C1 1779034061 KVLCGBHARQAJLQ-HSZRJFAPSA-N 455.490 0.901 50 20 JCGD COc1ccc(COCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779034124 NHJROMFOPJIKRX-DEOSSOPVSA-N 483.525 0.354 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1 1779691767 DIABSJLMTDTSBH-JOCHJYFZSA-N 455.519 0.084 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)C3=Cc4ccccc4NC(=O)C3)C2)C1 1779988798 CKOBYFHEPKRWIV-RUZDIDTESA-N 490.520 0.554 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1[nH]cnc1-c1cccnc1 1780036599 WOLNOHWAGGLBMH-CJFMBICVSA-N 489.341 0.593 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1782180388 ZBYHVRXSSKARIH-AKCHCHLHSA-N 470.910 0.524 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)nn1 1782212255 MHNOVVGAQQDQDI-VGOFRKELSA-N 462.551 0.376 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2C[C@@]2(F)Cl)C1 1782287557 PYUKQRKQUQRMQO-BWMZKYQQSA-N 453.902 0.737 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782788381 VCBKMUROGFBENB-ROUUACIJSA-N 461.302 0.823 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1783767168 XQAVWOPREOGCJU-NTKDMRAZSA-N 487.362 0.279 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1 1783950190 LDTXBNLGBIAXCV-RTBURBONSA-N 466.362 0.992 50 20 JCGD 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C[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)NC(=O)OC(C)(C)C 1791291450 VQQLUQIQYILADB-OWSLCNJRSA-N 483.610 0.642 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792975428 RMIUZDPRQXXUJY-PJVZLEMVSA-N 451.951 0.774 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H]2C[C@H](F)[C@H](C2)[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792983495 KMQHFHFGFDJUQE-ZEWJFTRYSA-N 489.972 0.912 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl 1793106273 COLWOOORHVPIEE-YYIAUSFCSA-N 477.986 0.782 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc2c1CCCO2 1796096926 AYDVTWNCVAIMDG-HBCWATKFSA-N 450.561 0.649 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cc1ccncc1)C2 1796443791 KLYYQMJLIYMYLA-UYOHPNQJSA-N 466.542 0.984 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cnc(C)s1)C2 1796446284 RDFNWQQFTQNSDU-UYNJTKMTSA-N 458.544 0.718 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2[nH]ccc2n1 1797396389 UHHDXAXRUHETPM-DFZQMDCHSA-N 463.498 0.900 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)cc1)C2 1797750818 UQEDQAYOZCEGIR-YVWYUNDQSA-N 457.918 0.784 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(O)n2c1CCCC2 1798660217 MBEBHINCTZOIMZ-BTTYYORXSA-N 453.503 0.489 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccccc1F 1799405133 LXSIGIPACKLKOD-NSOYYKSDSA-N 455.914 0.366 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1 1804948955 ILGKYJBFJUJUAV-HBSVRTSBSA-N 491.508 0.934 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)(C1)C2 1807368260 RIAMTVAPCNJMGB-QYQPWLLASA-N 477.326 0.424 50 20 JCGD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc2nccn12 1807372833 IWXFTSWYKIEUHX-DENIHFKCSA-N 484.325 0.746 50 20 JCGD Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)o1 1807472020 XKLVHAIQBWLXQU-QRWLVFNGSA-N 464.486 0.334 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1)[C@H](F)Br 1808652562 YPUHUIUFHTXMOE-UAGQMJEPSA-N 491.383 0.508 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCC4(CCCN(C(=O)c5ccc(B(O)O)cc5)C4)CC3)cnc2c1 1809972617 UCEFQMMMLOKWRF-UHFFFAOYSA-N 488.353 0.841 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccc(-n2cncn2)c1 1811824696 VJXKMHWOCHRJLL-XUZZJYLKSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1nc2ccc(F)cn2n1 1812289638 WIYVWLOADUKTOZ-LAUBAEHRSA-N 488.288 0.577 50 20 JCGD COC(=O)C1(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)CC1 1819404086 XKNCMPZHPFOFNE-HNNXBMFYSA-N 455.475 0.667 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COC(=O)C(F)(F)F)CC2 1819797972 PXXALTUJTWTLNI-QMMMGPOBSA-N 486.432 0.473 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)C(F)(F)F)sc2C1 1826146844 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O=C(Cc1cc(F)ccc1Cl)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832268638 ROVQHQZROFYMOK-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD C#CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551181 HBKCGXLOHWXKQH-KKSFZXQISA-N 457.955 0.988 50 20 JCGD C=CCOCCCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833469534 CUGNKCLOGZZZBL-UHFFFAOYSA-N 457.380 0.534 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(=O)n3C)CCO2)C1 1833869512 KIUMNNWVJGMAKI-KUHUBIRLSA-N 456.337 0.486 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1834821629 QMTYRNOMEWLBBB-SFHVURJKSA-N 452.309 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4sccc4[nH]3)CCO2)C1 1837131548 NGFFOOZTBLUIBR-QFIPXVFZSA-N 484.538 0.612 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1 1837920031 DUGGYMXFAUBCHR-CTNGQTDRSA-N 497.401 0.380 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cn1 1838130761 YZKLTTWJUPULOR-UHFFFAOYSA-N 489.573 0.853 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nc4ncccn4n3)CC2)CC1 1838227273 NWXZSBJUVFRRTA-INIZCTEOSA-N 450.927 0.990 50 20 JCGD CC[S@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838363089 UXJCJQMPTIZDMD-HKBQPEDESA-N 458.625 0.517 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 1838568676 JWXYHUKIUSTYLN-PGRDOPGGSA-N 484.933 0.160 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1c(F)cccc1F)CCO2 1838996472 RZOGVZXBTNPNHE-QFIPXVFZSA-N 468.501 0.337 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839651425 DHUMJTRQRWSMKT-FZKQIMNGSA-N 457.325 0.355 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3nccn3)C2)C1 1839743941 GJGQAJOAWGOBDP-IXNCKXOBSA-N 472.452 0.620 50 20 JCGD CCCCC[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839903990 OTSCRMRGBCOBIJ-GAJHUEQPSA-N 461.563 0.972 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1839965261 SAIRIYOVBSROIK-BEFAXECRSA-N 466.336 0.973 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1840081799 ITYJUZRKYNEHAS-SIKLNZKXSA-N 495.013 0.547 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840110942 NAIOOUSXSCMGFA-DNVCBOLYSA-N 473.935 0.743 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)C2)C1 1840150231 IBFQKUFWMZLCST-JLTOFOAXSA-N 472.926 0.486 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1 1840154057 JVYFVRUBYIUSJI-BTYIYWSLSA-N 479.921 0.764 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1 1840154849 HTTLSWJTJURURI-UTKZUKDTSA-N 453.898 0.950 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCCC(F)(F)F)C2)C1 1840182673 PPBDQRRSGMWIJV-GOSISDBHSA-N 452.474 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CCCC4=O)C2)C1 1840184202 CPXAOPIZDRBVMU-RUZDIDTESA-N 486.569 0.649 50 20 JCGD C=CC[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1840794951 CIGIRXIGRGTEJY-PNLZDCPESA-N 489.997 0.902 50 20 JCGD CCN1CCC(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)CC1 1840927953 IQZIAAGKUXTWLA-PSQINSSGSA-N 488.589 0.309 50 20 JCGD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013259 ZSYIZHKQLCZOPT-QFBILLFUSA-N 487.362 0.208 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C[C@@H]1COc3ccccc3O1)C2 1844263529 NQNJVNGVVAAFQL-OAHLLOKOSA-N 451.483 0.732 50 20 JCGD COc1ccc(Cn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3ccc(B(O)O)cc3)cn2)cc1 1848160969 XKDLTJDKMJAPHW-ZEQRLZLVSA-N 488.353 0.678 50 20 JCGD CCN(CC(=O)Nc1ccc(N2CCOCC2)cc1)C(=O)NNC(=O)CNC(=O)c1ccco1 725873033 UAIBDEUVQDLLBO-UHFFFAOYSA-N 472.502 0.547 50 20 JCGD O=C(CSCC(=O)N1CCOCC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 725908310 LCWJVJLGDHMMRM-UHFFFAOYSA-N 498.608 0.902 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CC(=O)N(Cc4ccco4)C3)cc2)CC1 728213148 SQSINYTYACCTEG-MRXNPFEDSA-N 461.544 0.708 50 20 JCGD Cc1nn(CCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c(C)c1[N+](=O)[O-] 728214068 JFIXDMIRDVMTEA-UHFFFAOYSA-N 465.536 0.878 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728981019 LANAWPMIVREFTC-UHFFFAOYSA-N 474.543 0.412 50 20 JCGD CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)[C@H]1c1ccccc1OC 729275098 KYLGMOPHTKBLNZ-SIXWZSSISA-N 468.576 0.860 50 20 JCGD COc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1 729275942 SPCKARQUHMZTGA-LBPRGKRZSA-N 470.529 0.195 50 20 JCGD O=C(CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1 729482945 QGUPHRKYLSENBI-INIZCTEOSA-N 479.490 0.938 50 20 JCGD Cn1[nH]c(Br)c2c(=NCCNC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ncnc1-2 729625766 CYLBQUNBRBRAPJ-UHFFFAOYSA-N 478.267 0.464 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1 730782768 VGKJHIUIIMMBPW-UHFFFAOYSA-N 458.496 0.780 50 20 JCGD Cc1nn(C)c(C)c1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 731040690 MAIAQVXIXCCJFX-UHFFFAOYSA-N 455.562 0.835 50 20 JCGD Cc1ccc(C(=O)C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 746091180 OUYJYLRPSRYCTQ-UHFFFAOYSA-N 459.524 0.979 50 20 JCGD NC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1 784061701 SQLFFHCFATVIGF-UHFFFAOYSA-N 466.541 0.583 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccnc(N3CCOCC3)c2)c1 916388644 AEKREPPUPLXOQA-UHFFFAOYSA-N 462.532 0.313 50 20 JCGD CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)CC1 916391040 XXCGXDXQPZHGEH-UHFFFAOYSA-N 463.502 0.194 50 20 JCGD O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cc2c(s1)CCC2 916516883 SROUGWBZPIRTJY-UHFFFAOYSA-N 478.600 0.728 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)cc1[C@]1(C)NC(=O)NC1=O 917731367 UQEXMIUXFYBBRW-NRFANRHFSA-N 471.495 0.865 50 20 JCGD COc1cc(C=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc(I)c1O 920385235 WVQVUZWRTBXQCI-SECBINFHSA-N 453.258 0.826 50 20 JCGD CCCNC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N3CCOCC3)ccc2n1C 921040874 KUODETKSFBXUDV-UHFFFAOYSA-N 452.537 0.267 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3cccc4ncccc34)CCO2)C1 1779028472 FMTFTJDRGTUFLX-VWLOTQADSA-N 474.521 0.920 50 20 JCGD O=C(O)c1cnncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780774829 NTRZFKIJCYBESJ-PBFPGSCMSA-N 459.272 0.993 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)C2)[C@@H](F)Br 1780777693 YTLUDDLSKNMZSH-GLXFQSAKSA-N 462.238 0.869 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)C2)C1 1780890418 VGABQTSKWMDIRQ-QHCPKHFHSA-N 468.595 0.947 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1780920500 OPVMFVCWKIDTBG-RUZDIDTESA-N 492.341 0.346 50 20 JCGD O=C1CSc2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)cc2N1 1781360214 SJXUYRYANVEUDF-BXTJHSDWSA-N 468.963 0.853 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1 1781936515 LFUAOBGVHFFHLP-SGCYSOCQSA-N 484.469 0.878 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](COC(C)=O)OC(C)=O)C2 1782175349 IJTIEFLAKFLEQB-AXVVYFOYSA-N 462.927 0.249 50 20 JCGD Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nc2ccc(Cl)cn12 1782494852 NPTQHVJKZXXBRU-QHCPKHFHSA-N 482.733 0.733 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)C(C)C)C1 1782738862 BBBSHSBIJXMIGO-RCBCJABQSA-N 460.579 0.975 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1782966815 CMHGIFRBGABXKW-JOCHJYFZSA-N 471.250 0.100 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)O1 1783019099 SJPHBFHCHBUSLM-FTRWYGJKSA-N 466.332 0.931 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 1783576473 MGSURNYFCKGCIL-SBUREZEXSA-N 481.594 0.589 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783941998 GDYKAEYSRQLRQS-KPZWWZAWSA-N 454.351 0.896 50 20 JCGD CCc1c(Br)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)nn1C 1784090282 XEKJHBGZGVZXJB-IMIFBBOLSA-N 477.787 0.938 50 20 JCGD O=C(Cn1ccc2sccc2c1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785256494 WLTXUIFIIRHOMY-VDGAXYAQSA-N 495.366 0.036 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785348917 VANUBMHUKQMUCF-OPAMFIHVSA-N 469.583 0.493 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1785521204 QLUFLLFDEIEEQV-VCOZGABYSA-N 461.519 0.540 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785561751 PMZDEQCBWPZXSN-GAJHUEQPSA-N 459.547 0.008 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3Cc4ccccc4C3)C[C@@H]21)c1ccc(B(O)O)cc1 1786982302 WWCFLWXNIOSIJO-XWGVYQGASA-N 462.355 0.765 50 20 JCGD Cc1cn2c(=O)c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]43)cnc2s1 1788037939 PXNRXJJMEBPLHC-XIRDDKMYSA-N 490.586 0.031 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1 1788607931 WLWITQMOOHUEQQ-FCRQHZQGSA-N 483.525 0.021 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@@H]1[C@H]2Sc3ccccc3[C@@H]21 1788620275 JCBIOQQDMIDKGD-FOOHHUQRSA-N 478.379 0.848 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1N(C)C 1789817561 ZVXWERUGPUWHTF-LEDOBFOHSA-N 481.358 0.348 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1790962928 WUEUTWAPDDZTFW-CYDGBPFRSA-N 478.434 1.000 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1791080772 GCVYAWWYOOIYQB-SIRPWMCASA-N 459.971 0.965 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cnnc4)cc3)C[C@@H]21 1791289187 NFCXOSJVEZBNJO-IHPCNDPISA-N 469.546 0.234 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1792129484 VHPVZWXFJIRWBX-FJIDUMEYSA-N 483.610 0.642 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc(OCC(F)(F)F)n1 1794335558 QIHXMBLJJQAVPT-CCWDJLKJSA-N 493.247 0.220 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(Cl)c(Cl)c1)C2)c1cccc(B(O)O)c1 1795737451 HKULQHHPPJMRFG-USGNIVHTSA-N 493.152 0.955 50 20 JCGD CC(C)COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)ccn1 1795738949 LOCWLCLEOBJRKC-HATOLVCRSA-N 467.331 0.313 50 20 JCGD COCCn1nccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1797056071 IFRVDUGZSGXQOP-OSSGZSMMSA-N 455.519 0.915 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc(Cl)c(Cl)c1 1798075280 PKBDCQNTTZLLNS-XOIINTDNSA-N 464.114 0.585 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(N(C)C)o1)C2)NC(=O)NCc1ccccc1 1799094738 HPJBBBZKLKKYAO-RMFSNUHRSA-N 499.572 0.290 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@](C)(Cl)CCl)n(C)c1=O 1800077731 HYOLJLONILWLOZ-NJEYBTAUSA-N 485.372 0.308 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1804582875 WUKDQKGYGZZVIP-XMSQKQJNSA-N 476.541 0.913 50 20 JCGD N[C@H](CC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)c1cccnc1 1809883128 CBMNNJYWMOSIEL-OAQYLSRUSA-N 450.348 0.696 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C(=O)c2ccco2)[C@H]1c1cccnc1 1810295444 STQZFQABPUXUNY-KXBFYZLASA-N 462.466 0.876 50 20 JCGD CC(C)(C)NCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303417 RTWWHUJRCZBKRH-UZLBHIALSA-N 453.547 0.788 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@H]1c1cccnc1 1810303939 XXQMKMTXEDAUQR-VFNWGFHPSA-N 485.508 0.985 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810305348 KHSFENKVLAVBFL-AYOQOUSVSA-N 472.571 0.514 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@H]1c1cccnc1 1812889742 SDKDKGBTVYJZSC-NHSHWBJMSA-N 464.526 0.967 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(Cl)ncn1)CC2)c1ccc(B(O)O)cc1 1815344103 HZQJQEIUETXZEJ-LBPRGKRZSA-N 457.708 0.806 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)nc1 1816196403 OXYVOLLVOIHSDF-LJQANCHMSA-N 497.342 0.508 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)[nH]n1)c1cccc(B(O)O)c1 1817474129 NAFUWJHQBNRZOF-QGZVFWFLSA-N 467.251 0.200 50 20 JCGD C[C@@H](NC=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)[nH]n1 1820882845 GSKMZUSMRGHKBV-APWZRJJASA-N 484.561 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccc4ncnn4c3)sc2C1 1822501743 QENUXXNABBJUAZ-AWEZNQCLSA-N 470.559 0.714 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)sc2C1 1822627415 GCFPGVVZYWWWJM-MCIONIFRSA-N 497.581 0.768 50 20 JCGD COC(=O)CSCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055800 JYYGRPVCWYHERM-LJQANCHMSA-N 462.377 0.506 50 20 JCGD CCOc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cn1 1830534492 AKYKNDBFOHYVPY-AUUYWEPGSA-N 471.352 0.976 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Cn3cncn3)C2)C1 1830539532 ICXVWKRMCCYTGB-RKVPGOIHSA-N 458.357 0.402 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1830668166 SAEJKMYAVGAZSG-VQTJNVASSA-N 489.378 0.443 50 20 JCGD C[C@@H](Sc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831157808 RUMCNCCLNDQMHU-KOSHJBKYSA-N 484.383 0.617 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)O1 1831575972 AKPFTHPIFUZZAM-WWMYMODYSA-N 496.358 0.557 50 20 JCGD C[C@@H](CC(N)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1831609492 PFGNXPAATWAMKB-BRLOGJFQSA-N 476.480 0.840 50 20 JCGD Cc1ncccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1832640485 RTYPRODFHGLRPC-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(=O)[nH]c1C 1833390388 WGJGOWBSTMWUGZ-DYVFJYSZSA-N 461.288 0.147 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800008 OKXVJHUAYRNQNI-UHFFFAOYSA-N 467.379 0.216 50 20 JCGD COc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801197 UADQATZLBLDPDG-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD NC[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)c1ccccc1 1835736992 PMVZAPIVCZSXMY-JOCHJYFZSA-N 493.612 0.613 50 20 JCGD CC(C)[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1 1835932092 NLXODINXWNSWTA-RLSLOFABSA-N 472.391 0.899 50 20 JCGD COc1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ccc(F)c1F 1835939681 XQXYKUGXDIUOLB-QHCPKHFHSA-N 490.268 0.037 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1835940149 WLXFQEVOBCXMOD-UQBPGWFLSA-N 466.343 0.549 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCCc3ccccc3F)C2)C1 1837455612 AEAARQZNVAFNCG-VWLOTQADSA-N 499.543 0.917 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1C 1837460075 SFTDSTWERDZKHM-DEOSSOPVSA-N 483.525 0.386 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1cnccn1)CCO2 1837486492 QEZXDJAICSURFJ-DOXZYTNZSA-N 470.368 0.907 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1 1837710271 RUTHRWWYGIIUDI-NRFANRHFSA-N 461.595 0.739 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837921021 SXRZXGFTODBJKV-AWEZNQCLSA-N 467.169 0.762 50 20 JCGD O=C(CCc1cnccn1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922071 INWWIRXSTSEKNN-UHFFFAOYSA-N 466.347 0.401 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)S)C2)C1 1838528143 HJNFGMDEEKFZMU-ZUOKHONESA-N 467.500 0.908 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528459 ZPIVIASJXYWQCZ-JLCFBVMHSA-N 492.485 0.115 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(-c3ccccc3)[nH]n1)CCO2 1838689155 PLNNKCRNCCKFFJ-RUZDIDTESA-N 490.325 0.140 50 20 JCGD O=C(c1nn[nH]c1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1838767420 HVKJPTMRZGWNDS-GXFFZTMASA-N 474.209 0.584 50 20 JCGD CCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054341 VBQZZNBJQLTNRP-XMMPIXPASA-N 491.589 0.216 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1839965395 XHDVFGIKMKAITG-BXTJHSDWSA-N 498.378 0.225 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1840076858 KUHVLZPHZPCKNY-LJQANCHMSA-N 481.384 0.298 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4)CC3)C2)C1 1840183143 SGQWFCNBVRVXHC-QHCPKHFHSA-N 458.559 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)C2)C1 1840184671 ANGUSEABDJFIOP-KCESLBEFSA-N 450.580 0.642 50 20 JCGD CN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841352905 SSZZEWSZRUEGEK-LSDHHAIUSA-N 474.986 0.551 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1842193939 NOLPLODLOPHNRP-UHFFFAOYSA-N 460.299 0.697 50 20 JCGD CSCC[C@H](O)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1846395643 RMODBTIPMVFGIR-SFHVURJKSA-N 463.604 0.650 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(N2CCCS2(=O)=O)c1 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1 1779101944 SCBNEZOJJBOJDT-CQSYHPDSSA-N 474.518 0.479 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1Cc3ccccc3O1)C2 1779372306 DXZGUKXHBILQPS-BPYKYCOYSA-N 479.537 0.816 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cc(=O)nc2sccn12 1779987617 FKSWIELRFAKPQY-PJIJBLCYSA-N 454.936 0.483 50 20 JCGD COc1ccc(COCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1782302767 IPFYIPVWDOSAMN-ZEQKJWHPSA-N 496.369 0.719 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1782921398 FPECLDBGCIQCIY-OSPHWJPCSA-N 454.307 0.828 50 20 JCGD CCOc1ccsc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1783394023 KREICCYWVOVIGH-IEZWGBDMSA-N 458.345 0.734 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@H]3OCCc4ccccc43)[C@H]2C1 1784398403 KPVBQJGZFFLXCV-QMZRJTEUSA-N 493.564 0.983 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)C[C@@H]21 1787508856 WWAXFEUXZDSIDW-QHDBSCRBSA-N 470.574 0.440 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ccc3O)C[C@@H]21 1788610051 YXQISQNPLOFHQD-KHDYIWLOSA-N 455.471 0.003 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)no1 1788669922 DKIPQXQTXPOQKY-VODUFIJXSA-N 461.346 0.929 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1N(C)C 1789817392 VBIWAJCRDJXDDX-LEDOBFOHSA-N 481.358 0.348 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2 1792868991 XOTDPLQPGFXLSM-RBGFHDKUSA-N 492.411 0.883 50 20 JCGD Cn1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc2c1-c1ncccc1OC2 1792976721 KZTXNGKWUGJBDU-KPEUIFRASA-N 460.918 0.782 50 20 JCGD CCS(=O)(=O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1793317847 AESBCCDHTCLYON-HBCWATKFSA-N 483.499 0.158 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(N(C)C)o1 1794602151 FOMFARHGQFATEL-LVTGYEAHSA-N 457.491 0.078 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc(C)c(C)[nH]c1=O 1794612299 OTMVUKKZFSHWKM-LCFLCXBCSA-N 453.503 0.773 50 20 JCGD CCCOc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1 1795735300 XCSJLBLQFMSFEV-HATOLVCRSA-N 452.316 0.672 50 20 JCGD CCOc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1OC 1795736930 RFESCTXMFYEXBV-NHKMSHSESA-N 482.342 0.220 50 20 JCGD CC(C)(C)OC(=O)N1CC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)C1 1796191340 AOENDOXFGZCQCG-REPLKXPHSA-N 457.336 0.485 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797756867 OKULWJKAJKIPCT-CCWDJLKJSA-N 490.561 0.193 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(Cl)c(F)cc1F 1799465238 FUDBQWSZAXPKQQ-DBWKPXFBSA-N 464.661 0.815 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2 1800970346 CMXPMPLALDWPIQ-JITAAIDCSA-N 467.950 0.009 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2csc(N)n2)[C@@H]1c1cccnc1 1807231682 BNLMNRHQDCTSIY-GUYCJALGSA-N 466.527 0.752 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1 1807358632 MPHDSCVORZNTRY-KEYYUXOJSA-N 459.894 0.386 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807372394 DWSWHNFTWGOVKN-UGKGYDQZSA-N 465.315 0.590 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1nccc2nc[nH]c12 1808132040 NVUROQSFJBJKBI-JTSKRJEESA-N 470.298 0.666 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1 1808410085 QNXFVBYPFLWGPH-OHTSJNNMSA-N 467.486 0.330 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1 1810298573 JAKAWJIEBSADKM-AUUYWEPGSA-N 490.480 0.202 50 20 JCGD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)cn2[nH]cnc(=O)c12 1811302620 ATSYZQIATZZOTC-QILLFSRXSA-N 458.906 0.645 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)[C@H]1SC(=N)NC1=O 1813070962 OVDHDCFYKGOZSE-ARKSPBFVSA-N 489.602 0.263 50 20 JCGD O=C(CCN1CCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1814265415 OPOOIHDEALHUIP-OFNKIYASSA-N 450.348 0.567 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1 1815347627 HMDWTJHTPWBHPD-MRXNPFEDSA-N 499.379 0.766 50 20 JCGD Cc1noc(C)c1CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350328 QIBNWUFGLMHZLW-OAHLLOKOSA-N 454.317 0.896 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361847 SLQQAOGPCNZPQU-YESZJQIVSA-N 483.355 0.804 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cscn3)sc2C1 1816989238 BPRHGUVOTTZBTC-AAEUAGOBSA-N 465.605 0.455 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CC[C@@H]3CCC(=O)N3C2)[nH]n1)c1cccc(B(O)O)c1 1817476887 GHWJZLNDOHMBHR-HQRMLTQVSA-N 479.346 0.796 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)[C@H]1SC(=N)NC1=O 1819403077 UNZLDZBHPMUKAQ-DRZCJDIDSA-N 499.557 0.517 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2c[nH]c(=O)cn2)n[nH]1 1820246151 BITJRVHOVXZBCC-OAHLLOKOSA-N 451.447 0.111 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccnnc3O)sc2C1 1821098491 HAZMLHDMTMZRLY-SECBINFHSA-N 454.472 0.177 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822410399 IYDWZNPFJQHRSB-DZGCQCFKSA-N 456.569 0.456 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1828128811 XABLXUPQMBKMPF-RDJZCZTQSA-N 458.349 0.354 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3nncn3c2)CC1 1828642565 NXPAVUBUNFXREL-NRFANRHFSA-N 461.331 0.956 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1828875995 NFOOJARTHBWOBP-FUHWJXTLSA-N 452.600 0.687 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1831644074 NMTYAEUGICOYTO-PXNSSMCTSA-N 473.979 0.963 50 20 JCGD C[C@@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1831651314 SJDOQCQVEQMIND-BXUZGUMPSA-N 466.340 0.829 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)CC2)CC1)[C@@H](O)CCl 1833310881 XKMASRLMOKXQPV-FQEVSTJZSA-N 475.977 0.951 50 20 JCGD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)nc1 1834263367 LRQXRVHYWKJVAR-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1834749545 YHRMHNVPRHLJFX-WIOPSUGQSA-N 466.343 0.630 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc4nc[nH]c34)CC2)CC1)c1ccc(B(O)O)cc1 1834798039 XPKQTZJGOLSLOH-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD Cn1ncc2cc(C(=O)N3CCC(N4CCC(NC(=O)c5cccc(B(O)O)c5)CC4)CC3)ccc21 1834799952 IBBJUJUCLQYFGT-UHFFFAOYSA-N 489.385 0.752 50 20 JCGD CC(C)[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835934223 QJEYQTLRNVOMSX-BVAGGSTKSA-N 480.370 0.876 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3nccnc3C(N)=O)CC2)CC1 1836400186 YFDDYXQMDSFUMP-FQEVSTJZSA-N 471.389 0.997 50 20 JCGD COc1ccc2oc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)cc2c1 1836818836 QCNKTERUJUHADC-VWLOTQADSA-N 494.309 0.505 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C(F)(F)F)ccn1)CCO2 1838087866 SKVLSYRWHNYGGR-FQEVSTJZSA-N 487.479 0.543 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1 1839200616 LCCJMNOQNVVUGP-WMLDXEAASA-N 491.270 0.759 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3ccoc13)CCO2 1839586147 LFVSXRFZIDNEOR-XMMPIXPASA-N 479.493 0.815 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1 1840153828 BQAUYOOGYRUPCO-ZOCZFRKYSA-N 475.970 0.706 50 20 JCGD C/C(=C\c1cccs1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182482 DQZVMWSPTGJMIX-OEHGHSTBSA-N 464.588 0.981 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4c(c3)CCCO4)C2)C1 1840184647 ZFDIMUMYPVHJEU-RUZDIDTESA-N 488.585 0.384 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cc1cccc(F)c1)NC(C)=O)CCO2 1840857140 KZVCXGLQFAGWTH-SXWKCWPCSA-N 499.967 0.583 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1 1841350139 JRKNTLLZIAUKKR-CVEARBPZSA-N 467.954 0.978 50 20 JCGD Cc1ncc(Br)cc1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1842186935 LNPJQWWGFTWXGY-UHFFFAOYSA-N 458.121 0.963 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C2 1846386469 QFUWINAOWAZPRI-QGZVFWFLSA-N 469.583 0.227 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1 1847259157 RMBMIEQCBUYNEJ-HOTGVXAUSA-N 472.575 0.741 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1csc(N2CCCC2=O)n1 12702460 QAPCYJNDOFCFRW-UHFFFAOYSA-N 450.546 0.875 50 20 JCGD COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)c(OC)c1 725872020 ULGUZXCYIHWPEQ-UHFFFAOYSA-N 459.459 0.225 50 20 JCGD C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 726382512 UDUHIOSYELLREX-CQSZACIVSA-N 484.538 0.927 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)c1cc(Br)c[nH]1 726710484 BUIBOIYIJWUQQN-UHFFFAOYSA-N 465.312 0.250 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCCS(C)(=O)=O)c2)cc1 727943145 XQSYECINTCPNIS-UHFFFAOYSA-N 470.529 0.485 50 20 JCGD COc1cc(OC)cc(C(=O)Nc2ccc(O)c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2)c1 728203775 NQOXDDPZIQMEAB-LBPRGKRZSA-N 477.495 0.857 50 20 JCGD NC(=O)c1cn(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc12 728330807 RYNMVHHPEMOWGQ-SFHVURJKSA-N 452.423 0.271 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)n1 728734195 WXFLFSIKIIYWGN-GFCCVEGCSA-N 472.570 0.599 50 20 JCGD O=C(COC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)NNC(=O)[C@H]1COc2ccccc2O1 730620423 IJXJGEMEGDYLSA-MGPUTAFESA-N 497.460 0.341 50 20 JCGD O=C(COC(=O)[C@H](c1ccccc1)N1CCC(O)CC1)NNC(=O)[C@H]1COc2ccccc2O1 731247382 DPXYEDYIJRMBMW-IRLDBZIGSA-N 469.494 0.715 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)N2CCOCC2)c1 745991747 GHFRCZMFJWJTMN-UHFFFAOYSA-N 469.564 0.240 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)CCOc3ccccc3)CC2)cc1 747177834 UZWNUIBWNBYLHI-UHFFFAOYSA-N 460.556 0.918 50 20 JCGD COc1cc(I)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1OC 750716714 UPZCTOBMLJNOEA-QMMMGPOBSA-N 468.269 0.504 50 20 JCGD CSC[C@H](C(=O)NNC(=O)CNC(=O)c1cccs1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 751211811 VLRZMLHDGACFAI-FRRDWIJNSA-N 452.558 0.532 50 20 JCGD Cc1cccc2c(=O)n(CCC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cnc12 792695326 CKOMYPVMQDIRHU-GOSISDBHSA-N 466.450 0.626 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1C 913450275 PVAIUCGUSIINQA-UHFFFAOYSA-N 463.512 0.969 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)Cc1c[nH]c2ccccc12 915787665 LPKPPPGJDFDFHM-UHFFFAOYSA-N 458.496 0.998 50 20 JCGD CC(C)CN1CCO[C@H](CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1 915922785 FOUQKNNNXLGPNI-GOSISDBHSA-N 467.592 0.772 50 20 JCGD O=C(Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O)NNC(=O)c1cc[nH]n1 916147795 CQBAKKIGEBPIFV-UHFFFAOYSA-N 498.503 0.641 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCNC(=O)c3ccc(Cl)cc3)nc2)CC1 916262284 HFARLWQBMFUIDK-UHFFFAOYSA-N 495.993 0.727 50 20 JCGD COc1cc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc(C(=O)O)c1OC 917724468 XOAYKSMZKDQGHR-UHFFFAOYSA-N 486.528 0.627 50 20 JCGD O=C(NNC(=O)N1CCN(CC(=O)N2CCc3ccccc32)CC1)c1ccc(-n2cnnn2)cc1 918001671 FDZWFYKTQWEPHW-UHFFFAOYSA-N 475.513 0.224 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1Cc2ccccc2CN1 1777988249 STZWWGNRLGFYSE-PPJWLVRDSA-N 477.370 0.208 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1778075855 HYGPQWYVJDIQNB-OHNQJVKOSA-N 463.934 0.764 50 20 JCGD Cc1noc(C)c1CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029092 QVJQQEJPDREIMJ-JOCHJYFZSA-N 456.503 0.366 50 20 JCGD Cc1nc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C(F)(F)F)o1 1779030232 KZRVTBYIWNQRKC-IBGZPJMESA-N 482.419 0.758 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779036889 ICFMFKFUHYTLRJ-XMMPIXPASA-N 481.509 0.619 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccnc2C(N)=O)C1 1779940613 UHBLMDHMCWEBOQ-XEKQOVJPSA-N 468.352 0.877 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CNC(=O)O1)CCO2 1780095594 QPVFBHINROQBRH-OXJNMPFZSA-N 462.415 0.072 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cocn1)CCO2)NC(=O)NCc1ccccc1 1780969928 OCSSWOCOMPVQJN-JOCHJYFZSA-N 456.503 0.464 50 20 JCGD O=C1Cc2cccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)c2N1 1781352857 UUYBGPOJFDIBQN-CJFMBICVSA-N 477.326 0.302 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc([N+](=O)[O-])c3)[C@H]2C1 1783439214 PARKFUULDBMUKG-WDSOQIARSA-N 461.519 0.490 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](C)Br)C3)C2)cn2[nH]cnc(=O)c12 1783536209 FKUMDNFURGGQTD-KZULUSFZSA-N 452.309 0.558 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)C1CC1 1783685489 NZGHSXPQLKDZBJ-LLLHUVSDSA-N 459.971 0.965 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C1CC1)CCO2 1783933213 RWFCLFJHYQDVAW-KOSHJBKYSA-N 495.621 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(Br)nc1F)CCO2 1783936147 HBWFVGJVIAUWCD-LJQANCHMSA-N 486.342 0.800 50 20 JCGD O=C1CSc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)ccc2N1 1784090895 QBAMLVKNWDDZOJ-UGQVUOCMSA-N 453.948 0.924 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1785127860 KAGDUNDXBFQSNQ-JOCHJYFZSA-N 458.707 0.786 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)OCCO4)[C@H]2C1 1787813674 PFHVSJKBROXKRW-ZWOKBUDYSA-N 460.531 0.424 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccc(F)cn34)C[C@@H]21 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Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)o1 1815490563 OWVIEXPCCJYYCW-JTQLQIEISA-N 456.488 0.302 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc2n(n1)CCCO2 1819087841 XBHKCFKIKSSWSW-GOSISDBHSA-N 464.291 0.688 50 20 JCGD C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1cncn1 1819802207 ZMAAGCKOEROTLD-WDEREUQCSA-N 455.504 0.220 50 20 JCGD Cn1nc2c(c1C(=O)Nc1cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n1)CCC2 1821529424 AKSFAIPNXFSYHL-LJQANCHMSA-N 462.319 0.931 50 20 JCGD C[C@](O)(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)C(F)(F)F 1824832300 ZGMHTUHGYBUJOE-PXNSSMCTSA-N 456.270 0.913 50 20 JCGD CN1CCN(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)CC1 1827054461 BAZUWFRYDRWUJK-QHCPKHFHSA-N 470.423 0.237 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827058234 UJHWGVKKBLRZPD-JXFKEZNVSA-N 458.368 0.307 50 20 JCGD CN(CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)CN)CC1)NC(=O)NCc1ccccc1 1827584522 GLFUJBLGTCPXRD-LEWJYISDSA-N 473.622 0.238 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(O)C3)CCO2)C1 1830577114 SIWKKJNNVCFVFJ-SQDGQLNESA-N 475.970 0.346 50 20 JCGD O=C(c1ncccc1Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731298 ISISUVUNCBNGJJ-GUYCJALGSA-N 462.728 0.514 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732479 YZEHHYPPAZEDJT-LDBYXDLTSA-N 453.923 0.306 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1 1830737124 ATHMXKWMTPAGFC-AUUYWEPGSA-N 461.943 0.100 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)ncn3)C2)C1 1832549246 JMHVUAYLHOMBJO-BTYIYWSLSA-N 499.952 0.384 50 20 JCGD CN1CCC(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1833132024 ABAUCGJAPBBWHZ-UHFFFAOYSA-N 470.423 0.284 50 20 JCGD CN(CC(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)C(=O)c1ccccc1 1833412465 KOVWTPBYXYIWOX-HXUWFJFHSA-N 464.994 0.930 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1 1833826769 WLRUADUKLFIWAF-FZKQIMNGSA-N 457.325 0.856 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(C)noc1C)CCO2 1834065446 FTXKJEWWPDDBHW-VCOZGABYSA-N 472.502 0.495 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccn1 1834798366 MIICINMWQZKTLT-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCc3ccco3)CC2)CC1)c1cccc(B(O)O)c1 1834800205 YVPWLIPAOZYNAO-UHFFFAOYSA-N 453.348 0.777 50 20 JCGD N#Cc1ccccc1OCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801444 JWPHLRUDZXOZSL-UHFFFAOYSA-N 490.369 0.502 50 20 JCGD CC(C)c1nc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)no1 1834819203 IJFKJLXNFJEOJE-GOSISDBHSA-N 459.341 0.977 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc4cncn4c3)CC2)CC1 1835737800 BISXWHCHNLORGT-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4sccc4[nH]3)C2)C1 1835930697 UUIKGOUTZZYJAV-QFIPXVFZSA-N 469.328 0.293 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1OC 1835932171 RDTBYEYHKCMJKF-VWLOTQADSA-N 498.341 0.076 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3C=CCN3)CCO2)C1 1836477157 ZFOYGYPWYUNBEH-QYWGDWMGSA-N 472.970 0.103 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)CC1 1837079872 QKKKOLQNMOIBPD-DEOSSOPVSA-N 494.353 0.819 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)C1=O 1837139315 ZYHLRMZTCSSFJW-KXBFYZLASA-N 484.278 0.582 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2 1837297653 YCQQNASTKRWKPX-KPOBHBOGSA-N 482.331 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@@H]1CNc3ccccc3O1)CCO2 1837355981 IQISZRQSOPZAPA-HOYKHHGWSA-N 489.573 0.079 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)CCO2 1837471239 XURCRMYLYWGWMK-CCQZOOGLSA-N 452.960 0.930 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](COC(C)=O)OC(C)=O)CCO2 1837503476 VJBAQGDAASTLJH-FRQCXROJSA-N 493.351 0.111 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1nc(O)n3c1CCCC3)CCO2 1837757829 GABZGXDQELOHDY-LJQANCHMSA-N 471.352 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3nc4ncccn4n3)CC2)CC1 1838226361 YOORHCJXTRGETF-UHFFFAOYSA-N 493.528 0.049 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528080 DLMYELKQTNHDOC-HJPURHCSSA-N 492.529 0.930 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528325 RACHCBCLTMUAHA-UYGSHGSRSA-N 492.529 0.964 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3C[C@H]3F)C2)C1)NC(=O)NCc1ccccc1 1839054093 GQIBNYGFXIDXSY-YYDVJCTNSA-N 477.537 0.147 50 20 JCGD Cn1ncc(Br)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201417 XEQVDKRMEZVCEQ-WFASDCNBSA-N 498.147 0.943 50 20 JCGD O=C(c1cnc2ncccn12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201513 ZJNHGVKDBHFHLA-SUMWQHHRSA-N 456.272 0.490 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)[S@@](=O)c1ccccc1 1839670825 CJWPKPFPVTVHCX-ZAAVIHTHSA-N 458.964 0.239 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839789527 HKHIHIWZIJISSH-OXJNMPFZSA-N 461.342 0.947 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1 1840154993 MDIWRMQEOCWNTR-IIBYNOLFSA-N 451.907 0.505 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185569 SDJXFWRKSFPIOI-UUOWRZLLSA-N 478.565 0.834 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncsc4[nH]3)C2)C1 1840185860 UCHYJRJJEIXRHR-FQEVSTJZSA-N 464.548 0.067 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3c(c1)CCCO3)CCO2 1840659710 HIZKWPHRBJKSOH-VWLOTQADSA-N 480.326 0.075 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCC(=O)NC2)C1)NC(=O)NCc1ccccc1 1841113863 ISUIXWPUYCUTJC-GOSISDBHSA-N 456.547 0.062 50 20 JCGD CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC[C@H]2C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841353957 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CON(C)S(=O)(=O)c1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1Cl 20910852 TVWSAYJCCCTMTF-UHFFFAOYSA-N 489.963 0.890 50 20 JCGD COC(=O)c1ccc(F)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 727350503 ORYONBYGZYDHKQ-UHFFFAOYSA-N 459.477 0.486 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)c1 728203928 PPEHVZSWBILUQT-AWEZNQCLSA-N 465.532 0.906 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1 728519562 LLINOJRKCKUIAQ-GOTSBHOMSA-N 477.565 0.888 50 20 JCGD O=C(NCCCN1C(=O)NC2(CCCC2)C1=O)NNC(=O)C1CCN(c2ncccn2)CC1 728943438 PCNKINNCEKBXTA-UHFFFAOYSA-N 458.523 0.278 50 20 JCGD O=C(NCCN1CCN(Cc2ccccc2)CC1)NNC(=O)C1CCN(c2ncccn2)CC1 728947501 ZMGIUMNOJJDUMK-UHFFFAOYSA-N 466.590 0.841 50 20 JCGD COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)cc1 729275010 JMQNHHVVFYJGRD-CYBMUJFWSA-N 484.556 0.219 50 20 JCGD C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)N3CCOCC3)ccc2Cl)C[C@@H](C)O1 745992793 KMDVNEUCMGQLMO-CHWSQXEVSA-N 460.940 0.825 50 20 JCGD COCCN1C[C@@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1=O 914461168 PQDULYJLZQZUAD-KRWDZBQOSA-N 463.494 0.701 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1ccc(Br)c(S(=O)(=O)NC(C)(C)C)c1 915139662 CFWQUOISERRREW-UHFFFAOYSA-N 463.354 0.812 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2ccc3ccccc3n2)cc1[C@@]1(C)NC(=O)NC1=O 917713086 DOKFOFDWWIKTIU-OAQYLSRUSA-N 469.479 0.921 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cc1ccc(C)nc1)c(=O)n2Cc1ccccc1 918257086 VDXLRBXLVQQZLJ-UHFFFAOYSA-N 475.509 0.521 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 919690566 PADCILWOLDBNLR-CYBMUJFWSA-N 466.969 0.343 50 20 JCGD Cn1c(O)nc2cc(C(=O)NNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)ccc21 920287129 DWKIRXWYPCCIJN-UHFFFAOYSA-N 487.538 0.694 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)NCCc3cccs3)c2)CCN1 920859415 LIHMTHLSTOXEGW-UHFFFAOYSA-N 451.530 0.055 50 20 JCGD CC(C)(C)OC(=O)N1CCn2cnc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2C1 1778368336 UTWHEECCUJZNNU-ZHRRBRCNSA-N 497.980 0.677 50 20 JCGD Cc1cc2nc(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)[nH]c2cc1C 1778921783 NSWXXTDPTYCKPM-DEOSSOPVSA-N 462.315 0.617 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969295 KSNPBNRJODUFHJ-DFBJGRDBSA-N 497.600 0.929 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cccc(-c4cnco4)c3)C2)C1 1781792801 NEGKOBKQTWENNG-XMMPIXPASA-N 461.283 0.779 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1)NC(=O)NCc1ccccc1 1782045227 UGZCKGAYUKETCZ-VWLOTQADSA-N 497.552 0.888 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCN3C(=O)c4ccccc4C3=O)C[C@@H]21)[C@@H](O)CCl 1784085103 CCIXXDFSQVPVNO-QZHFEQFPSA-N 477.945 0.642 50 20 JCGD COC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1784259825 NXYPIENACBYIJT-FQEVSTJZSA-N 464.431 0.320 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C[C@H]2C[C@H]21 1785590613 SNXPZULWVBYXLW-NRGSMNHXSA-N 499.373 0.208 50 20 JCGD Cc1ccccc1NCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1786943606 ZNBFRBAWGGHPRZ-LRQRDZAKSA-N 466.542 0.699 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21)c1ncn2nc(N3CCOCC3)ccc12 1787178357 IDSMYUMOTOKGAP-DZKIICNBSA-N 497.383 0.963 50 20 JCGD Cc1cn2c(=O)c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)cnc2s1 1788037101 UWOLQCLGYDGEOP-MXAVVETBSA-N 454.936 0.257 50 20 JCGD CN(C)C(=O)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1792629358 YHGVVHLLQVEJGS-AHHPBITISA-N 461.469 0.733 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)C1 1793082961 LUUMLBOHNYJOPM-AICCOOGYSA-N 494.358 0.902 50 20 JCGD CN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796367416 IERZTRMUQSMUJM-AUOOEQCUSA-N 492.976 0.872 50 20 JCGD CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2c(=O)[nH]c3ccccc3n2n1 1797103968 ZKUKXRMZTADOKB-OQMKEHIESA-N 458.906 0.791 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797753624 CJRHWIVQMDBSSE-VPTLXERWSA-N 490.524 0.091 50 20 JCGD COc1cc(C)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754054 KESGDKHSUIHULT-YVWYUNDQSA-N 453.499 0.519 50 20 JCGD CN(C)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1798885423 MRXZFKHAUBSWPO-CWPLJXCYSA-N 452.515 0.268 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1800761833 GNQGWFIHZQBTEF-OHTBPHCPSA-N 457.281 0.130 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1802053446 ZNFWQMAAVRGJFG-VLMUSUEPSA-N 459.971 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(S(C)(=O)=O)c1)C2 1802328845 GOWBOQMBDALWSW-BJWYYQGGSA-N 450.561 0.715 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365479 KEZRPEWJYFYWRU-UWJYYQICSA-N 488.288 0.577 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnn2c1CCC2 1812141047 UCZDWPDMWWGQBK-PGRDOPGGSA-N 459.315 0.538 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1nccc3nc[nH]c13)CC2)c1ccc(B(O)O)cc1 1815340304 ITKAVBVLKSAERB-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD Cc1nc2ncccn2c1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356769 QWXROWAQKRHQGH-HNNXBMFYSA-N 476.327 0.714 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n[nH]1 1815820430 YWYAJGLRTHSSTH-INIZCTEOSA-N 482.461 0.519 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3n[nH]c4c3CCCC4)sc2C1)c1ccc(B(O)O)cc1 1816783950 UIXXDVZJJMASNL-CQSZACIVSA-N 465.344 0.964 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)C1=O 1817476265 NSDILYNURCXWBO-GOSISDBHSA-N 487.281 0.844 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C/c1cnc[nH]1)CC2 1819801943 VRPQBLBAEUWQSU-FWEMWIAWSA-N 452.500 0.804 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)CN)CC2 1821304906 VEEVWCRUDVGLLW-GWCFXTLKSA-N 462.488 0.488 50 20 JCGD O=C(Cc1ccc2ncnn2c1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1822496111 IRHNTAXLFMWDCM-MRXNPFEDSA-N 476.327 0.334 50 20 JCGD C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2 1822863989 WRSAMIFFSCJPDV-VGDKGRGNSA-N 471.330 0.731 50 20 JCGD COc1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n(C)n1 1825475697 MMNJOLXEJRNGOZ-IBGZPJMESA-N 454.336 0.656 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)nc3sccn13)CC2 1826088289 VVCGCGATMDJPEJ-NSHDSACASA-N 489.583 0.811 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829705992 NNBZILGMPMQBFD-QAPCUYQASA-N 464.426 0.523 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)cc1F)CCO2 1830090423 VAEDGJPNEJRELF-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)CCO2 1830303822 LMPMBMAXBNKPNM-AUSJPIAWSA-N 463.959 0.610 50 20 JCGD O=C(CCCCCCCCBr)N1CCOC[C@]2(C1)CN(C(=O)C(O)O)CCO2 1830407745 ORDYAXHVDFOWSF-IBGZPJMESA-N 465.385 0.879 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nn1-c1ccccc1F 1830723818 QTTKVOFPUGPJPV-GCJKJVERSA-N 496.923 0.690 50 20 JCGD O=C(c1cc(Cl)nc2n[nH]cc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724276 XCCMYRJYDQBSSO-UGSOOPFHSA-N 458.302 0.281 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732008 OVNHMNVVWHEMMI-HNAYVOBHSA-N 462.330 0.803 50 20 JCGD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1831113551 SYWABGUKHAUUKC-WIYYLYMNSA-N 480.905 0.606 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1831655416 YINIKKJLRBADAX-NQIIRXRSSA-N 457.015 0.630 50 20 JCGD Cc1cn(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c(=O)nc1O 1831877258 VUDUXKNEIPQINA-SFHVURJKSA-N 476.578 0.250 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cn1 1833310450 IRBMVZPNTULWCN-SFHVURJKSA-N 452.939 0.653 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccn3)CCO2)C1 1833970954 GKRLRQORWGICNJ-BTYIYWSLSA-N 483.953 0.679 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835116466 QLXQODWKBOVIKD-LQKURTRISA-N 487.605 0.607 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C[C@]3(F)Cl)CC2)CC1 1835738163 KJAIGOLFBXSKNY-LAUBAEHRSA-N 466.945 0.795 50 20 JCGD O=C(Cc1ccc2c(c1)CCC2)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927145 IZKDHDJXCPINCO-AREMUKBSSA-N 478.354 0.168 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(F)CCCCC3(F)F)C2)C1 1835930347 GXESOPJVRWDDKW-SFTDATJTSA-N 484.280 0.354 50 20 JCGD CC(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835931382 PQCGPMRHXCNGKY-VWLOTQADSA-N 466.343 0.874 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835933974 IVEWBHPDEIXSKM-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)nn1 1836057465 SLNCLGBHPJBJDG-UHFFFAOYSA-N 461.567 0.043 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc[nH]c3[N+](=O)[O-])CCO2)C1 1836508332 WAGUHZMJNZLXIT-BDJLRTHQSA-N 460.285 0.561 50 20 JCGD CC(=O)c1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n[nH]1 1837365438 VVNWHDMAGDTYJI-UHFFFAOYSA-N 468.319 0.218 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1 1837459617 LUJMUNJUDWVZBX-QFIPXVFZSA-N 475.452 0.347 50 20 JCGD CC[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1 1837460367 DOECCDCYIOPGMD-QZTZHPFYSA-N 473.574 0.972 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921723 VUVTVKKYGBUMOL-UHFFFAOYSA-N 468.363 0.561 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncn3C)C2)C1 1838528096 FKFXMIOCWRNQCE-JOCHJYFZSA-N 487.469 0.637 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(N(C)C)c1)CCO2 1838925448 UPMXKLGSXPCIFZ-QHCPKHFHSA-N 461.563 0.196 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)c1ccc(F)cc1 1839039395 FOOVWAOOORVKJR-MBOZVWFJSA-N 459.877 0.994 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn3C)C2)C1)NC(=O)NCc1ccccc1 1839054425 YREGYGDSLWYFRJ-VWLOTQADSA-N 498.584 0.441 50 20 JCGD O=C(c1ccc(Cl)nn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200351 JDAVJKAZJQHDQZ-DOMZBBRYSA-N 451.680 0.891 50 20 JCGD O=C(c1ccc(Br)c(O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839329004 SFXCBVZJDXQNNS-QAPCUYQASA-N 477.739 0.824 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839881097 LLGJXENETYZLPU-GTCCEBARSA-N 496.402 0.974 50 20 JCGD CC(C)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1840001184 YBGZBXCZPJOYCM-SANMLTNESA-N 480.370 0.803 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1840032651 GJVFTDGRQDVSTK-ALKREAHSSA-N 455.353 0.191 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1 1840102973 FGSWKPHGQQKXQW-KKSFZXQISA-N 450.923 0.747 50 20 JCGD CCOc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)cnc2c1cnn2C 1840151551 FRZIBENRMSVQRV-VGOFRKELSA-N 495.964 0.691 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1840152860 WXNCMUROVQSRQO-YCRPNKLZSA-N 466.922 0.379 50 20 JCGD O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1840186504 NTJPTOYELYYCMJ-WYRIXSBYSA-N 475.329 0.253 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)Cn3ccc(=O)[nH]c3=O)c2)c(C)c1 29490268 GMVUDJFWFZUCHY-UHFFFAOYSA-N 471.495 0.415 50 20 JCGD O=C(NNC(=O)c1ccc(O)nn1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 36329669 RAVUYMPHRABPCN-UHFFFAOYSA-N 496.549 0.764 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(NS(=O)(=O)c2cccs2)cc1O 728202795 ATMOGEIIWIFUIE-JTQLQIEISA-N 459.527 0.450 50 20 JCGD COc1ccc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1OC 728214113 YFFOVBBOXGRXNM-UHFFFAOYSA-N 491.570 0.513 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)c1 728262610 HNKGFTWLFXLQRD-UHFFFAOYSA-N 492.963 0.703 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)Cc1ccc(NC(=O)c2ccc(Br)o2)cc1 729274486 MRUBOAJMNJBZBU-SNVBAGLBSA-N 487.332 0.922 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1 729275497 OSWMMFJVVYHBSO-NSHDSACASA-N 474.948 0.840 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl 729275691 QLPNJEQXFBNEQS-SSDOTTSWSA-N 473.360 0.133 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ncoc1C)N(S(C)(=O)=O)CC2 729515557 HWEGDAOZFPZMTJ-AWEZNQCLSA-N 452.489 0.710 50 20 JCGD O=C(CNC(=O)c1ccccc1I)NNC(=O)COc1ccccc1O 730835631 JNRNEPZGZDAMFS-UHFFFAOYSA-N 469.235 0.953 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c2ccc(Cl)nc2)n1 834300509 QNOUHZDLPBPWOQ-UHFFFAOYSA-N 475.936 0.102 50 20 JCGD COc1cc(C(=O)NNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OC(C)C 838617494 WFSITTQSDRNWQS-UHFFFAOYSA-N 454.447 0.747 50 20 JCGD O=C(Cc1ccc(-n2cnnn2)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 914837183 NBDZSGXVAJTKIO-UHFFFAOYSA-N 455.500 0.451 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br)N[C@@H]1CCS(=O)(=O)C1 919883854 FYVGEAHJYRRHCP-SNVBAGLBSA-N 495.377 0.021 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)NCCc2cccs2)c1OC 920860524 JJHCKJMCJMHCBN-UHFFFAOYSA-N 498.583 0.973 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc[nH]c2nccc1-2 1777892660 XMYGVYMWRIQIJI-HYBUGGRVSA-N 462.315 0.636 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1 1779000736 PNQSCIUCLDNJBV-NRFANRHFSA-N 450.612 0.641 50 20 JCGD CCSc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029624 VYNUVYHYGFGFMO-QFIPXVFZSA-N 470.555 0.949 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2cccnc2[nH]1 1779060473 WXIFQPBEBJGOIS-HYBUGGRVSA-N 462.315 0.684 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnnc3O)C2)C1 1779914444 GUCOGTNOKZDSND-XOBRGWDASA-N 469.926 0.758 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1781115743 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COCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1783663889 PPWOWFVKMACCKR-QFBILLFUSA-N 465.385 0.917 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC)CCO2 1783870374 BFTXZECJVOWLIO-JXSLOMFPSA-N 477.986 0.998 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCOCCNC(=O)OC(C)(C)C)CCO2)C1 1783933353 IUCJEITZICTVPF-QHCPKHFHSA-N 499.609 0.121 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc3cc(Cl)ccn13)CCO2 1783933626 BDIDFJNUQFEHNL-NRFANRHFSA-N 462.938 0.804 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cncc(C(F)(F)F)c1)CCO2 1783934815 HMRGUHOAYLGJJC-LJQANCHMSA-N 457.453 0.917 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)N3CCCC3)[C@H]2C1 1784997853 SAVGWJIKWKKBED-KEMROHCCSA-N 486.573 0.503 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@@H]4C[C@@H]4N3C(=O)OC(C)(C)C)C2)C1 1785590968 ITVPLCBANQQTEW-MNFWLRKXSA-N 493.605 0.587 50 20 JCGD 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c[nH]nc2c1 1796170462 ZEDWMSHEGQQUQB-UCNOBMHRSA-N 463.498 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Nc1ccccn1)C2 1796441348 CAFVHUPOAFXAIP-RAJLIZLZSA-N 467.530 0.606 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@H]3C)C2 1796441966 KLRMFWJPVNHZEV-GLAOESOLSA-N 467.530 0.797 50 20 JCGD Cn1c(=O)n(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c2ccccc21 1798440547 PIQPWSLSMWGSNO-MUJYYYPQSA-N 477.525 0.291 50 20 JCGD COC(=O)NCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799869097 CWSZMQKTSZNHSY-BCDXTJNWSA-N 460.535 0.327 50 20 JCGD COc1cccc2[nH]cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)c12 1800004153 LYRXTARQMBCZIR-YEZVWNJWSA-N 457.531 0.753 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800434833 DKWDOZIJAZXZGV-OREBXVKISA-N 498.374 0.647 50 20 JCGD 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CN1CCCn2nc(C(=O)NC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)cc2C1 1812287670 JWKIPJUYTTZFOM-YADARESESA-N 496.616 0.806 50 20 JCGD CCOC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CC1 1812467821 GBCJZUROYJCWGI-XLIONFOSSA-N 459.547 0.804 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nncn3c1)CC2)c1ccc(B(O)O)cc1 1815344178 MGUIMRZCXPUFAX-HNNXBMFYSA-N 462.300 0.405 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816673760 HJBSTMPXWKFOBE-SFYZADRCSA-N 481.336 0.668 50 20 JCGD CCS(=O)(=O)CC(=O)N[C@@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817275902 GNRROVNXMYJIHI-IVWKQIGUSA-N 480.572 0.624 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccnc3c2OCO3)[nH]n1)c1ccc(B(O)O)cc1 1817472638 XQTNQCCBVKCWPX-KRWDZBQOSA-N 463.259 0.833 50 20 JCGD Cn1cc(CCC(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cn1 1819794847 FOLNHYHYNVPCRX-ZDUSSCGKSA-N 468.543 0.734 50 20 JCGD COCCOCCOCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825773360 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O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1 1835938290 RPJNEUFBXMJSGO-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1836670984 NNUJSOHHVNGGCW-CJNGLKHVSA-N 461.401 0.609 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](COC(C)=O)OC(C)=O)CCO2 1837497293 UDQVFKJBRFWLCV-ZWOKBUDYSA-N 462.927 0.345 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)NC(=O)c3cnccn3)CCO2)C1 1837605555 BIBPOIRJGMDBTF-GCKMJXCFSA-N 467.954 0.459 50 20 JCGD O=C(Cn1cc(Cl)cn1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919318 GJIZOLHXMYQLFI-UHFFFAOYSA-N 474.754 0.529 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc4cncn4c3)CC2)CC1 1837921192 KHSWLJPNZVBPHY-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)c1 1838927210 HIGOSWSSTWHUHH-MSIOFZDNSA-N 483.525 0.899 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203351 IRWZHPBYVPYSSA-DHSIGJKJSA-N 460.300 0.996 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1 1839477155 ZQKCPGOKYPZOMV-JXFKEZNVSA-N 492.953 0.553 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1 1840031678 ZIOLCUHEUOTZGJ-IFXJQAMLSA-N 456.337 0.873 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1840034324 HXBLBWTZPMCSRB-QVKFZJNVSA-N 499.358 0.689 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1840034922 AUOWTIBQAWIMKV-UGSOOPFHSA-N 457.325 0.355 50 20 JCGD CCOc1ccsc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183158 SRJRALDHUHIZFX-NRFANRHFSA-N 468.576 0.590 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@@H]43)C2)C1 1840184849 BMTQWRILZNTZMH-HOUBMWHVSA-N 488.610 0.704 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn2[nH]cnc(=O)c12 1840188868 HWXSPIDUTKYPDE-SFHVURJKSA-N 458.302 0.205 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccc3F)CCO2)C1 1840546490 YYNGXBKFJWEPFK-XMMPIXPASA-N 485.516 0.527 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840716819 UMSHEHRLUDZOEP-MHECFPHRSA-N 471.558 0.757 50 20 JCGD CC(C)(C)OC(=O)NCc1ccnc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1842256415 AODAYVCAPIUSHB-UHFFFAOYSA-N 494.357 0.917 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@](C)(O)C(F)(F)F)C2)NC(=O)NCc1ccccc1 1845038364 UUILGDJZMOHBRR-IBGZPJMESA-N 471.480 0.849 50 20 JCGD Cc1cnc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)cn1 1845038431 BBLWJRNDDJBYQL-UHFFFAOYSA-N 451.531 0.948 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846116756 NZVGFZRUZZDZCU-GOSISDBHSA-N 469.347 0.440 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)COc2ccc(C)c(C)c2)c1 15705812 APNHCSLGBWINOJ-UHFFFAOYSA-N 464.544 0.722 50 20 JCGD C[C@@]1(c2ccc(CNC(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)cc2)NC(=O)NC1=O 726281697 CBXZFNRCNKJQLW-VWLOTQADSA-N 493.568 0.784 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c1ccc2c(c1)COC2 726671423 SYEPGEYEMNGKGN-UHFFFAOYSA-N 497.913 0.662 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCN3C(=O)COc4ccccc43)cc2)CC1 728213297 JBSGUULVFKNWNL-UHFFFAOYSA-N 473.555 0.882 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@H]3CC(=O)N(Cc4ccccn4)C3)cc2)CC1 728214785 SJQTUXYCAGWZBF-KRWDZBQOSA-N 472.571 0.510 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)COc3cc(Br)ccc32)n1 728726419 YYDGDGYSNCTMSS-UHFFFAOYSA-N 497.327 0.873 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nc(-c2cccs2)n(-c2cccc(F)c2)n1 729274892 GUWQZQYGYYIHDR-JTQLQIEISA-N 452.493 0.834 50 20 JCGD CCN1CCCC[C@@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 729301482 CKKJUSJJTDGPPE-LJQANCHMSA-N 452.577 0.662 50 20 JCGD CN(CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccccc1 743845239 CASXVAIOGIFDEV-UHFFFAOYSA-N 460.556 0.924 50 20 JCGD C[C@H]1CN(C[C@@H](C)C(=O)NNC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)C[C@@H](C)O1 747725075 FJWUAOFYOYLXBO-KFWWJZLASA-N 457.622 1.000 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)cc1C 748466163 VPQZJHUMVYPQBY-UHFFFAOYSA-N 467.530 0.706 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc(C(N)=O)s1)c(=O)n2Cc1ccccc1 749387143 RLKGRTYVRGIKGA-UHFFFAOYSA-N 495.521 0.050 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCC2)c1 751208904 JGYNXQVOOSASQS-UHFFFAOYSA-N 454.505 0.863 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cnc2sccn2c1=O 768229903 FNPBLTDMYIVUBD-UHFFFAOYSA-N 491.551 0.171 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2nc(O)c3cnn(C)c3n2)c1 822744197 ODVZYVKTNLLROW-UHFFFAOYSA-N 475.531 0.493 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCCNS(=O)(=O)c2ccccc2)c2ccccc2c1=O 916295830 VPTQBWONLDIGFX-UHFFFAOYSA-N 458.500 0.339 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H](c2ccccc2)N2CCOCC2)c1 916509470 PEYYAQDDRRSDML-HXUWFJFHSA-N 475.571 0.954 50 20 JCGD O=C(Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O)NNC(=O)c1cnn[nH]1 917392527 GKHNRBOSNMZMCR-UHFFFAOYSA-N 499.491 0.036 50 20 JCGD CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1 917917589 CTONQJNYRHFZRO-UHFFFAOYSA-N 471.536 0.800 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3O)cc2S1(=O)=O 918361366 CZOXULTUFPRNTA-UHFFFAOYSA-N 453.860 0.911 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccnc(-n2ccnc2)c1 918550975 VXGVFUGTTDNJKW-UHFFFAOYSA-N 484.538 0.682 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNC(=O)c2ccc(F)cc2)c1 919916273 FWGQKTTVCLDHGM-UHFFFAOYSA-N 451.480 0.450 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccccc1-n1nccn1)CCO2 1779036987 LFIQFEASORLSCD-HSZRJFAPSA-N 476.497 0.023 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1[N+](=O)[O-] 1779036998 LWLUYJGMOWZDDI-HSZRJFAPSA-N 482.497 0.588 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2 1779374600 RAGADVFNWRQWES-AUSIDOKSSA-N 498.496 0.740 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)n(C)n3)CCO2)C1 1780095088 FZRQGMLOIPMDSB-NRFANRHFSA-N 473.442 0.717 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(S(C)(=O)=O)ccc3F)C2)C1 1782151138 DLBVJIFQRHTPFN-BEFAXECRSA-N 462.927 0.927 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(-n2nccn2)c1 1783935380 ONZBZJKUWOUMMG-QHCPKHFHSA-N 469.546 0.392 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)C=CC3=O)C2)C1 1784117083 YQPYISJDPAQTAN-CBFKJKJLSA-N 470.432 0.627 50 20 JCGD CC(C)N(C)CC(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1784774294 GCYWNMIODBQOCW-XMMPIXPASA-N 474.606 0.503 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C\C(=O)NC3CC3)C[C@@H]21 1785076441 HECYYWNAUQLGOH-MSJFBKSJSA-N 499.008 0.933 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785595980 HLKSVLXPWIOURN-ZYKLXPEUSA-N 499.373 0.279 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)[C@H]2C1 1787125814 WSJDXXIAZDPYCB-QQCJEOGWSA-N 489.997 0.590 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncnc3C)C[C@@H]21 1787508886 ZXZDCHQYIABTRL-YKNBRYRPSA-N 453.503 0.512 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cc(F)c3)[C@H]2C1 1789643489 WJNCLIOVVNSICD-NXXSPTCGSA-N 459.453 0.870 50 20 JCGD COC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1789982718 WGEZQOOMRQNCSK-YSSFQJQWSA-N 496.524 0.771 50 20 JCGD Cc1cn(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)c(=O)nc1O 1792225216 HINUMFSYAQZERL-UHFFFAOYSA-N 476.298 0.385 50 20 JCGD Cc1ccc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1 1792253319 NGULHXNQJWEYJC-UFYCRDLUSA-N 473.574 0.078 50 20 JCGD CCSc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1792396015 KPDPEROLMSBQRF-HGKCTWBKSA-N 455.345 0.390 50 20 JCGD Cn1ncnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878351 WEGDBPBXIPVFDC-CRWXNKLISA-N 456.931 0.150 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](N)CCC(N)=O)C2 1794142447 AOSAFISZBNRETF-AICCOOGYSA-N 459.975 0.350 50 20 JCGD COc1ccc(C(=O)CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1795136713 IGNBCUPAHBQDRG-NHKMSHSESA-N 480.326 0.241 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)c(Cl)c1)C2)c1ccc(B(O)O)cc1 1795734203 IZKPKCNTUATVHT-XOIINTDNSA-N 464.114 0.585 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccccc3F)CC1)C2)c1cccc(B(O)O)c1 1795740710 FHLRTGLLPNXTBH-UPHUGPLXSA-N 452.291 0.441 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1sc3nccnc3c1N)C2 1796440254 JRLVTYKCJLKVJO-MJXOOREPSA-N 496.553 0.611 50 20 JCGD COc1ccnc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1OC 1798439930 OBUPKBKMNASTHL-BTTYYORXSA-N 454.487 0.663 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl 1799278836 YYIVKFAJORACSG-IQWHIPCCSA-N 460.362 0.283 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCC(=O)N1C(=O)OC(C)(C)C)C2 1800980852 GMCKKJKVZYZXGI-JRBZFYFNSA-N 473.954 0.756 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1)C2 1800982674 IPEOMGZPMZGJOM-SFNKJDCFSA-N 489.013 0.383 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCn1ccnc1 1801304717 YXWFHCHTFGWQQA-KLQCHYFMSA-N 455.519 0.387 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCNC(=O)OC(C)(C)C 1802123540 OCNCJUFRVKIKNB-CWPLJXCYSA-N 469.583 0.254 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1 1804042753 KFUKNZDDSWAZOI-GDBMZVCRSA-N 497.210 0.436 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C1=O 1807360256 IXOXOXVJAKGRSN-VGOFRKELSA-N 498.304 0.530 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2cnc3ccccn23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807363066 AIQCWDAMZLJSOS-NLFFAJNJSA-N 483.337 0.971 50 20 JCGD CC(=O)NCC(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1807452958 LMLCJGVNOSBDMO-URXFXBBRSA-N 495.584 0.570 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809970773 AOLOSKFHNQOAAH-UHFFFAOYSA-N 494.353 0.674 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(=O)Nc2cccnc2)[C@@H]1c1cccnc1 1813072222 CFFBDTDRUKZXSN-LAUBAEHRSA-N 467.530 0.494 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813075104 XLILNRRXMIFZBY-HYBUGGRVSA-N 493.605 0.530 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1814218093 BOHBDZUHCLJGSG-OVWQWFNUSA-N 497.980 0.456 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)C(=O)OC(C)(C)C 1814234706 MXUFIPBSLAYHFE-OAHLLOKOSA-N 488.375 0.916 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)[nH]n1)c1ccc(B(O)O)cc1 1817470299 OILQLRUBJUSCIQ-CYBMUJFWSA-N 486.187 0.751 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472083 HDCUCVHTRUBMOT-LIRRHRJNSA-N 491.317 0.004 50 20 JCGD COCc1oncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1817800868 JEWJWFWEMXPPTK-JTQLQIEISA-N 471.499 0.816 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nc2ccccn2n1 1817805765 VSIKKRALTMQOPK-KRWDZBQOSA-N 459.275 0.752 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCNC(=O)c1ccc[nH]1)CC2 1826080492 NKUXHQPSYGHJHV-CYBMUJFWSA-N 475.575 0.576 50 20 JCGD O=C(C1CC(O)C1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548208 FQIVZVBRZAYKPN-DBGYWNFCSA-N 479.961 0.809 50 20 JCGD CN1CC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCN3C(=O)OCc2ccccc2)C1 1828551890 XDPMIQPUKTXXPE-XXBNENTESA-N 478.977 0.600 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)N1CCN(C)CC1 1830238243 NAUFOPLDFQVHNM-AUSIDOKSSA-N 470.423 0.236 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1831994092 QVQUTAXOXRCQJP-WMLDXEAASA-N 453.305 0.865 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1 1832425125 DNBDHTCBXSUWLL-HNAYVOBHSA-N 460.369 0.629 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(n3)OCCO4)CC2)CC1)[C@@H](O)CCl 1833310555 NAOBUETZAJAJGG-KRWDZBQOSA-N 452.939 0.638 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc4ccnn34)CC2)CC1)c1ccc(B(O)O)cc1 1834799152 PELFTNWLZHNIEM-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD CC1CCN(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1835734890 VNJHXIWXCMPXIV-UHFFFAOYSA-N 485.633 0.602 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccc4o3)C2)C1 1835930720 WAMPDJGWOSMTJD-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3ccccc3=O)CCO2)C1 1835991942 CUBCAMLFXAOFHF-KXBFYZLASA-N 456.337 0.336 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1 1836337474 DALNHQNKXVSSNF-UTKZUKDTSA-N 456.971 0.942 50 20 JCGD COC(=O)CSCC(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1836873381 OMWQJNSBCANXOG-UHFFFAOYSA-N 472.608 0.264 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)ncn3)CC2)CC1 1836940837 SRNGZGQDCCCGBX-UHFFFAOYSA-N 469.502 0.107 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CCc3cn[nH]c3)CC2)CC1 1837159983 RMMYJGSLYQFNOK-UHFFFAOYSA-N 469.546 0.653 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1F 1837456941 SZUOETIGKLDDND-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3noc4ccccc34)C2)C1 1837457720 NJQKFZIYWLLZIC-DEOSSOPVSA-N 494.508 0.139 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920787 FJZMPIUVSGWSAK-DHIUTWEWSA-N 498.385 0.734 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(-c3cnccn3)c1)CCO2 1838593510 YURPCLGELCSVQN-VWLOTQADSA-N 496.568 0.587 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)nn1 1838758430 IBPKSZQUTWYTEO-FQEVSTJZSA-N 453.616 0.955 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1OC 1838931955 UGRQWCBYYMTKBZ-DEOSSOPVSA-N 499.524 0.086 50 20 JCGD COc1cc(C)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1839254639 GPHIGNVNCBOXIP-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD COc1c(C)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1839393813 IVSQQCVQEZTTKB-RUZDIDTESA-N 497.552 0.694 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3cccc(Cl)c31)CCO2 1839740744 SKPLQHONNKUWAL-CPJSRVTESA-N 498.772 0.820 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1840075840 DSMNBDMBXFFRML-NRFANRHFSA-N 464.987 0.778 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1840152449 ILFQMBNQWXXPAM-VGOFRKELSA-N 478.933 0.490 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1 1840183660 RZCRYURETSICKM-JOCHJYFZSA-N 450.511 0.198 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ccoc4c3)C2)C1 1840185476 RORSDHXHMMLXCC-HSZRJFAPSA-N 458.515 0.876 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840186947 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O=C(CNC(=O)c1c(F)cccc1Cl)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 730584920 HUSMSHUUBFCHAM-UHFFFAOYSA-N 498.920 0.691 50 20 JCGD O=C(COC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 730619201 DDJNEJGVZDCRLU-INIZCTEOSA-N 484.421 0.723 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1cccnc1)N(S(C)(=O)=O)CC2 754573269 BNWUIVTULMBWSI-QGZVFWFLSA-N 477.543 0.878 50 20 JCGD CCc1ccccc1NC(=O)CN1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1 807134581 CEFHQNOCFZLWIG-UHFFFAOYSA-N 477.529 0.835 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)cc1C 825164230 JQRYQCQYZMVKDU-QFIPXVFZSA-N 455.446 0.996 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc1OC 916392489 ZGSFNSMLLCBOFQ-UHFFFAOYSA-N 469.498 0.810 50 20 JCGD C=CCNC(=S)NNC(=O)[C@H]1CC(=O)N(c2ccc(S(=O)(=O)N(CC)CC)cc2)C1 916559398 AVLYDUFFVIVNMC-AWEZNQCLSA-N 453.590 0.751 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)cc2O)cc1[C@@]1(C)NC(=O)NC1=O 917757886 GAPGZOAGAOBSQO-GOSISDBHSA-N 468.875 0.732 50 20 JCGD O=C(NNC(=O)N1CCN(C(=O)COc2ccc(F)cc2)CC1)c1ccc(-n2cnnn2)cc1 918779209 GRKXVSPLSCDFEG-UHFFFAOYSA-N 468.449 0.379 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1)N[C@H]1CCS(=O)(=O)C1 919885566 MAACTTXYVIRHBF-ZDUSSCGKSA-N 470.504 0.758 50 20 JCGD C[C@@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 919885816 RUZRNCURIYVLNT-UKRRQHHQSA-N 458.562 0.381 50 20 JCGD CS(=O)(=O)c1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc([N+](=O)[O-])c1 920273529 LBHCPZWEDCCNQP-UHFFFAOYSA-N 475.527 0.972 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)CCO2 1779029826 ZHFARIVSESOBBO-QVNIBDNGSA-N 479.537 0.425 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)CCO2 1779295347 JSCLGDKICOTSGQ-HXUWFJFHSA-N 469.636 0.921 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc(O)[nH]3)C2)C1 1779645322 QFMIYYLHKLOFRN-FQEVSTJZSA-N 459.415 0.706 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc[n+]([O-])cc3)C2)C1)NC(=O)NCc1ccccc1 1779887014 DECTUAGUMKHBJY-DEOSSOPVSA-N 482.541 0.110 50 20 JCGD Cc1nc(F)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779903061 KABPAHRYCOQGFC-WZONZLPQSA-N 470.505 0.969 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cccc(OC4CCOCC4)n3)C2)C1 1779904848 YKVIHBKJTOHYFI-VWLOTQADSA-N 495.341 0.077 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@@H]3CCC(=O)N3C2)C1 1780609672 BUSFWIUXQSMUTP-IPRDPGLQSA-N 477.606 0.274 50 20 JCGD Cc1nnsc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967914 COESDRXHEICSBW-JOCHJYFZSA-N 487.586 0.636 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)Br)C2)C1 1783540151 SIJRJDJOKKGCEH-QFBILLFUSA-N 481.384 0.296 50 20 JCGD C=C1C[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)N(C(=O)OC(C)(C)C)C1 1783937414 KHTOJSYOQQENKR-UUOWRZLLSA-N 493.605 0.755 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1783939283 BTOMQCNXNGQMMW-QHCPKHFHSA-N 476.530 0.055 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCNC(=O)c3ccccc3)CCO2)C1 1783939520 GWCOLKZKRUYHBK-QHCPKHFHSA-N 459.547 0.009 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1785683032 LSXHRHQTKVPNAW-DLKVLKDVSA-N 492.367 0.910 50 20 JCGD COc1nccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508931 TXVWSFAXPFWVMA-AGJPEOOQSA-N 469.502 0.213 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790179523 SYVXDMGXIZXROR-MMTXMSQFSA-N 496.524 0.049 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)ccc1C 1790199497 SPXWQGDRYJVVEP-XJABCFGWSA-N 494.552 0.859 50 20 JCGD Cc1cccc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]43)n[nH]c12 1790479641 CSNJHMMBJXDVQS-SZMVWBNQSA-N 456.547 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC(c4ccccc4)=NN3)[C@H]2C1 1790547229 XZNUMHHQXGSHQC-VHHKXPHXSA-N 491.552 0.045 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790575391 ACTDXUXYSQQBHH-OQRYQMPQSA-N 466.542 0.552 50 20 JCGD C[C@H](CBr)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1792987274 MDKQSEFKWFWEGD-YIYPIFLZSA-N 495.378 0.103 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1 1793050183 RWSJGLRXVBYGIZ-LNDDQJNNSA-N 485.491 0.970 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)C(C)C 1793115176 CPOMJLILPREMKG-COZGXFGHSA-N 486.997 0.596 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)C1=NN(c2ccccc2)C(=O)C1 1796190957 INXHOKGOAZDQBJ-FNLKRUPLSA-N 460.299 0.411 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCOCC2)n1 1796618512 VLVVJOCWFVPFTQ-UPHUGPLXSA-N 462.623 0.973 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1797155037 PLPSGEAANVWSIU-ZQNQSHIBSA-N 481.924 0.820 50 20 JCGD COc1ccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(F)c1 1797753819 GGFMKLAWTSCXTI-CIQMAITOSA-N 483.500 0.749 50 20 JCGD CN(C)c1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797753920 BZTNUAAUGLPINK-FEJSZKPUSA-N 480.569 0.587 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)C2 1799218001 RXEUBMMKTREWOP-CLLJXQQHSA-N 496.440 0.212 50 20 JCGD C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1799276300 ISPQKGIGZZPKGD-KRXQYRFLSA-N 470.419 0.484 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C2 1800975079 HQVVNESCQQEYKA-LORHWOILSA-N 458.964 0.476 50 20 JCGD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)[S@](=O)c1ccccc1 1801275786 NVXFSHMNJPPSTN-PTHBEVMPSA-N 454.357 0.815 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)n1ccccc1=O 1807374382 HEWCAUZBCLMNHV-DHJUGAMNSA-N 474.326 0.504 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]2c2cccnc2)CC1 1808667596 BXNKWORZWSQTLD-NEWSRXKRSA-N 484.370 0.942 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)N2C)[C@H]1c1cccnc1 1808759777 NHDHPEOSEILUTJ-GHMZSNGMSA-N 479.541 0.842 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809969493 WRXHIJVIWKFUMA-UHFFFAOYSA-N 450.304 0.019 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(O)nc2)[C@H]1c1cccnc1 1810302299 HTBNHCJEAOBKMT-QRWLVFNGSA-N 461.482 0.814 50 20 JCGD Cc1nccn1CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810306093 SRERJRYSXZQOAV-DYESRHJHSA-N 462.514 0.605 50 20 JCGD COCc1c[nH]c(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1811350733 XBASARKOVZAPFN-SIKLNZKXSA-N 462.315 0.869 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1nn[nH]c1C(F)(F)F 1811557769 PETPCWKEMKXDFO-YOEHRIQHSA-N 488.235 0.532 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H](CNC(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1 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C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476269 NVPQIKKSEJKDKA-LIRRHRJNSA-N 491.317 0.004 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)[nH]n1 1819403148 WBOHYRBQEJCKIZ-RDJZCZTQSA-N 483.558 0.741 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(C)C(=O)C(=O)O)CC2 1825451455 LHGPDIJBVVUSOI-IUCAKERBSA-N 461.338 0.772 50 20 JCGD O=C1CC[C@@H](C(=O)N2CCN(C(=O)OCc3ccccc3)[C@]3(CCN(C(=O)[C@H](O)CCl)C3)C2)N1 1828877661 ILUDUEGNZVODLN-IXFSTUDKSA-N 492.960 0.317 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1 1830719847 MHRAEMAPCDVMMX-LZJOCLMNSA-N 469.922 0.140 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733931 WZIOUWJDKNRHAM-KKSFZXQISA-N 453.923 0.298 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831387515 QHFQTMMWFHPYAG-PNLZDCPESA-N 487.981 0.613 50 20 JCGD 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466.343 0.296 50 20 JCGD N#Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccc1F 1836409176 QSDBOWQGJYWSEP-UHFFFAOYSA-N 492.360 0.805 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)c2c1 1836923728 QKIMBLYHDSANTO-VWLOTQADSA-N 493.325 0.240 50 20 JCGD Cc1cc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(C)c1 1837460391 FXKINQNXYSXURP-RUZDIDTESA-N 481.553 0.994 50 20 JCGD CC(=O)C(=O)N1CCC(OC2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1837625232 PQKSEEPOPDNKQD-UHFFFAOYSA-N 473.574 0.920 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1837710162 LQCAMKQXBMVBQH-HXUWFJFHSA-N 450.568 0.102 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)nn1 1838829524 CULNOMKQGCHVSE-AUUYWEPGSA-N 471.352 0.976 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CCO2 1839384988 UBCHXGCWSQJOEH-BXTJHSDWSA-N 463.959 0.693 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1 1839967638 SQLIZFFIOXUGSM-QFBILLFUSA-N 456.337 0.960 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3C1)CCO2 1839992326 FVLHDXPEHWDMPZ-IBVKSMDESA-N 493.564 0.560 50 20 JCGD CC(C)c1nc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)no1 1840031569 URTZKUACQIHGTL-ACJLOTCBSA-N 459.341 0.975 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840038704 QCDXZWQSURJIAS-DRSNIGMVSA-N 489.997 0.690 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2)C1 1840149483 QVKYAAHZZNAXLC-AUSJPIAWSA-N 463.959 0.610 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4[nH]ccc4s3)C2)C1 1840184459 NYWXDCKLTXMLPT-NRFANRHFSA-N 463.560 0.672 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3Cl)C2)C1 1840185858 ZFVBSEDGDACEIC-NRFANRHFSA-N 470.929 0.922 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840739375 CKFNXRRJSMKIIY-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD CC(C)[C@@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)N1Cc2ccccc2C1=O 1841587328 HIFDEFZSJOPFSQ-QFIPXVFZSA-N 475.354 0.864 50 20 JCGD COc1cc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc(OC)c1OC 1843012303 APXKUZCZNVQZLP-BJMVGYQFSA-N 480.326 0.923 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(CCNS(C)(=O)=O)cc1 12702884 HHIYAMBFMDKPAT-UHFFFAOYSA-N 467.573 0.455 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNS(=O)(=O)c1ccc2c(c1)COC2 727720314 KMQQZGFDISUTRA-UHFFFAOYSA-N 495.579 0.680 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccccc2O)CC1 730781298 JOWZAHRVKSNWEW-UHFFFAOYSA-N 451.505 0.359 50 20 JCGD Cc1cccc(N2C(=O)N[C@H](CCC(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)C2=O)c1 730865887 OIYFRMOUNUIDGJ-OAHLLOKOSA-N 473.511 0.898 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C(=O)N3CCCC3)CC2)cc1 748247647 TYYOVUJBPQCDSZ-UHFFFAOYSA-N 450.517 0.060 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 846753226 PQDILIAUTNPPQX-QGZVFWFLSA-N 477.495 0.112 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1S(=O)(=O)NC(C)C 912852245 XAMFJUFZOVDTNF-UHFFFAOYSA-N 483.572 0.750 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNc2ccc(OC)cc2)o1 915064827 SWZWXMMUTVPGJI-MRXNPFEDSA-N 494.526 0.878 50 20 JCGD CCn1cc(C(C)=NNC(=O)Cn2c(=O)c3c(ncn3CCOC)n(Cc3ccccc3)c2=O)cn1 920984094 ALTRCIVDNRVBTE-UHFFFAOYSA-N 492.540 0.811 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)nc(O)n2)C1 1778018348 DNRPOCIAWROIPR-GULRJVMGSA-N 485.501 0.149 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)ncc1[N+](=O)[O-] 1778248923 ZNRYPVNBWRZMKR-AUSIDOKSSA-N 497.512 0.738 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc2[nH]ncc2c1 1778939820 YFJULTWFPQNCPJ-AUSIDOKSSA-N 463.303 0.079 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)cn3)C2)C1 1779426689 KITIQCDHJZRHOI-HXUWFJFHSA-N 489.330 0.600 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1 1780184269 VCIBTGZRCWFSRI-VWLOTQADSA-N 487.520 0.899 50 20 JCGD COC(=O)Nc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1780833044 AAGACFIPHFKBIJ-PXDATVDWSA-N 495.341 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CCCn3c(O)nc4ccccc43)C2)C1 1780921309 KWFVYGSUJMXYNX-DEOSSOPVSA-N 486.573 0.725 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnoc1)CCO2)NC(=O)NCc1ccccc1 1780969399 ZDSFTGXBUYUAHN-QFIPXVFZSA-N 456.503 0.464 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1781351193 JCZFVKVXLXKEPV-KUHUBIRLSA-N 478.384 0.877 50 20 JCGD O=C(c1nc2c(Br)cc(F)cn2n1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1782559733 OSTGXYXLKZCHLR-PXAZEXFGSA-N 490.717 0.674 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(-c2ccccc2)on1 1783420475 YKUKBSFZQCHXEB-LEDOBFOHSA-N 475.310 0.929 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1 1783838747 DUDHRZORJRBLGG-XUZZJYLKSA-N 450.300 0.204 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)cc3)[C@H]2C1 1783840156 JQEJVMKXDMLGKH-UNGBVBFUSA-N 483.525 0.885 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2 1783933448 JODSHWTWQSOQQL-OPAMFIHVSA-N 467.567 0.199 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cn(C)nc1C(F)(F)F)CCO2 1783934720 LQAKTVSDZNWRLV-GOSISDBHSA-N 460.457 0.255 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783946704 GAPVXZXUZQGNHO-KPZWWZAWSA-N 454.351 0.896 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)COc3cccnn3)C2)C1 1784458491 IIXLAAHVKRZWPB-QFIPXVFZSA-N 485.453 0.833 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccc4n3)C[C@@H]21)c1cccc(B(O)O)c1 1786983395 RAVFGTWBDAJIBQ-ZJBJCVSYSA-N 460.299 0.217 50 20 JCGD N#Cc1ccc2[nH]nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)c2c1 1786985278 YAJYFFNGCOTNRI-LRQRDZAKSA-N 473.298 0.021 50 20 JCGD 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(C)nn(C)c3C)[C@H]2C1 1791634219 XXJHQVWEGFRGFY-VPOFNPCUSA-N 483.573 0.693 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccc2)on1 1792406279 HTRBACLTCQKULO-FAQVEIGNSA-N 455.515 0.918 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2 1792874438 PGOTUSPVPPITDK-XGYYKPKNSA-N 492.411 0.883 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)[C@@H](F)C1 1792974866 GANVCECIEDIACD-IAFLNBNSSA-N 477.961 0.771 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1n[nH]cc1I 1793113438 JLXURNVLLUEWFR-PKIKSRDPSA-N 452.680 0.866 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(=N)N)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796363134 RHHFUGRUSYLWAL-KHMAMNHCSA-N 492.980 0.267 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1ccnc1)C2 1796445618 FXANGIAXAMZMRH-KLQCHYFMSA-N 455.519 0.387 50 20 JCGD 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JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N[C@@H]1C[C@@H]3CC[C@H](C1)N3C(=O)CCC(=O)NN(C)C)C2 1802337961 FWYNPRFYSQAPGC-FJIDUMEYSA-N 488.589 0.633 50 20 JCGD COC(=O)c1ccc(OCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)cc1 1802344363 YFWMKIHKUGOLKH-BCDXTJNWSA-N 460.531 0.863 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1 1804948953 ILGKYJBFJUJUAV-FIMQGSNUSA-N 491.508 0.934 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361137 HKZAUPBCIQRQGA-UWJYYQICSA-N 470.298 0.666 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807363679 CFVXTRRENXPWDG-CVDCTZTESA-N 461.331 0.664 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807364020 GVZMPWNVNYWCHE-OXQOHEQNSA-N 464.243 0.896 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377281 ZZBFCAABCTWNNT-XLIONFOSSA-N 486.297 0.143 50 20 JCGD 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CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833028266 MULCNTOBONPYHS-VWVPQACVSA-N 468.938 0.467 50 20 JCGD CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1833214356 UENJHOSGSBFNRJ-UHFFFAOYSA-N 452.920 0.548 50 20 JCGD COc1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1F 1833485711 POGGFSYMRVHPET-GUYCJALGSA-N 464.263 0.990 50 20 JCGD CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1833713794 CKRAWVKYFWCWHB-SFHVURJKSA-N 463.044 0.306 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cn2ccccc2n1 1835299112 QMULKCCVIQQGRY-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD COc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1 1835924119 PLQXGPRUQVPFIA-UHFFFAOYSA-N 460.579 0.648 50 20 JCGD Cn1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ccc1C(F)(F)F 1835928322 KPAPUEKQUQVHMZ-OAQYLSRUSA-N 495.263 0.108 50 20 JCGD O=C(c1nc(-c2ccccc2)ns1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836249882 MTKUBHOIJBWZOB-MGPUTAFESA-N 466.947 0.875 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1)[C@@H](F)Br 1836414086 WDIUCHQEMYWAJQ-HUUCEWRRSA-N 468.389 0.826 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1 1836815057 JBRDWJWLKWBOKN-SGTLLEGYSA-N 452.309 0.811 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3sccc3[nH]1)CCO2 1837132495 BUDKEWVTTAYZAL-NRFANRHFSA-N 463.560 0.672 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cc[nH]c4cc3F)C2)C1 1837459531 IFXMRUVUHDVUSP-DEOSSOPVSA-N 496.499 0.689 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cccn1 1837920994 PYZAHQAZCZRQQC-QGZVFWFLSA-N 454.336 0.436 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3nc4ncccn4n3)CC2)CC1 1838227274 NWXZSBJUVFRRTA-MRXNPFEDSA-N 450.927 0.990 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1838435607 XPMURMMQURAKPT-HOTGVXAUSA-N 466.348 0.827 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1 1838605141 QMWQFRDSGINESY-IIBYNOLFSA-N 479.921 0.766 50 20 JCGD CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1838990198 QDNGMTWSFOKCSI-DEOSSOPVSA-N 452.316 0.313 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839133291 JBLYMJGTDNZWBW-SIKLNZKXSA-N 465.909 0.973 50 20 JCGD O=C(c1c(O)cc(O)cc1O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839373019 RYGZHWOASMPUMG-YOEHRIQHSA-N 463.256 0.564 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1 1839556403 UOCZVFWJAYRHOW-JLTOFOAXSA-N 454.886 0.797 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2 1839636609 RMTNHMNFZLZEHO-KLHJMIIUSA-N 479.375 0.992 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)CCO2)C1 1839914317 YYSXOWYQIWZHDQ-VXEMUYFQSA-N 471.558 0.581 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1839964206 KARBAPQPLOSNFK-RLFYNMQTSA-N 475.409 0.643 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1 1840033817 ROPJVTWGFGGHCO-XCLFUZPHSA-N 466.332 0.783 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nc2nccn12 1840035168 IHJUCPMMBLCCOG-IFXJQAMLSA-N 466.336 0.891 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)c3ccc(OC)cc3)C2)C1 1840149658 WPCAVOQUWRFCET-WFXMLNOXSA-N 456.923 0.439 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)nc3C(F)F)C2)C1 1840152677 PNTZSWLEDZHTGB-ACJLOTCBSA-N 450.870 0.682 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C#N)cc(OC)c3)C2)C1 1840153979 GZBMVQOERLUPIJ-RXVVDRJESA-N 451.907 0.891 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccccc3)C2)C1 1840156296 MEJIBILHHOCVRG-XMSQKQJNSA-N 467.950 0.517 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840714595 ZUTWWCGVCKQSRW-IQGLISFBSA-N 477.326 0.377 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCc1c[nH]c3ncccc13)CCO2 1840871494 KUSLDDQETZQORM-XMMPIXPASA-N 486.573 0.325 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840881731 LJCFXPOMQVRCEQ-OSAWLIQMSA-N 475.970 0.346 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)C[C@@](C)(O)CC(=O)O)C2 1844693353 VVHARUKXYAFIOH-HXUWFJFHSA-N 463.443 0.953 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2)NC(=O)NCc1ccccc1 1845038920 IUDYPAMNYKTPFB-UHFFFAOYSA-N 470.490 0.481 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@H](C(=O)NNc3nnc(C)c(=O)[nH]3)CC2=O)cc1 11335339 HXVCWLULQQZUHM-CYBMUJFWSA-N 463.520 0.000 50 20 JCGD O=C(COC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1 728345780 QWYMOEHNWRIRFZ-BXUZGUMPSA-N 475.376 0.680 50 20 JCGD COc1cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc(I)c1OC 728433671 DOVPAIJJOUIIII-MRVPVSSYSA-N 455.274 0.696 50 20 JCGD C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 728960101 UKSUGJYTHVNNJJ-SFHVURJKSA-N 472.594 0.452 50 20 JCGD O=C(NNC(=O)[C@@]12CCC(=O)N1CCS2)c1cccc(S(=O)(=O)N2CCCCC2)c1 811882569 MDZSTGSESSVBTP-IBGZPJMESA-N 452.558 0.688 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cn(CCO)nc2C2CCOCC2)c1 856581298 DLTMFUYCOPGVHW-UHFFFAOYSA-N 493.586 0.875 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)s1 896223316 VBYGCUKZPICYAX-HNNXBMFYSA-N 461.529 0.647 50 20 JCGD CCOC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nc1C 914837162 KXAPVVUHYKHQNI-UHFFFAOYSA-N 476.511 0.662 50 20 JCGD C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C2=O 915789063 BUQUMVYOFWYAJD-YBTHPKLGSA-N 499.977 0.885 50 20 JCGD CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1 916383838 UXHNQLNLNJQJMI-UHFFFAOYSA-N 475.593 0.085 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1 1778030303 VYRZLDGRTNTOKX-YVWKXTFCSA-N 468.950 0.731 50 20 JCGD Cc1cnc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cnccc3C(=O)NN)C4)cnn2c1 1779021538 XFTRFVDBRQKKFM-NTKDMRAZSA-N 492.540 0.478 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)[S@@](=O)c1ccccc1 1779037362 XVIORKGKOPLWMJ-BFLKYVHRSA-N 485.566 0.325 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779296421 RRHATZRPLLMODT-IIBYNOLFSA-N 472.659 0.910 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnnc2O)C1 1779965775 USDIJZFRAONCSK-MIBZKUIYSA-N 469.502 0.444 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CCN(C)C(C)=O)CCO2)C1 1780095514 QKGYEZYMWKBTSU-JOCHJYFZSA-N 476.486 0.832 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2cnc3ccccc32)C1 1782099597 RWHXIKGZVCDUME-PXDATVDWSA-N 491.552 0.863 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1783936342 GMWQHKOIMSQMTR-CQLNOVPUSA-N 469.542 0.099 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)N1CSCSC1 1783936585 XLPNVRUTZWPDFQ-KXBFYZLASA-N 459.638 0.232 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784094492 OKOBJQJWYUXDHR-FPMLTQPBSA-N 471.982 0.679 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1784243345 BMEWIEMXKBAWCF-RUZDIDTESA-N 465.359 0.509 50 20 JCGD CCSc1cccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984764 HANSSEPCKAYBJG-WDSOQIARSA-N 469.372 0.781 50 20 JCGD NC(=O)c1ncccc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1787013641 LBFKATHRBQXPRR-UHFFFAOYSA-N 458.283 0.922 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(F)c(F)c4)CC3)[C@H]2C1 1789703920 WRSQRPATLZLZOE-BPXKWBHBSA-N 484.308 0.970 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](COC)NC(=O)OC(C)(C)C)C[C@@H]21 1791254774 RMPKQJLMXFYRNB-WOYTXXSLSA-N 477.986 0.760 50 20 JCGD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)co1 1794769353 PVYRYTZHBHOVTJ-RMFSNUHRSA-N 470.530 0.532 50 20 JCGD O=C(Cc1ccc2ccccc2c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1795153011 ROWQXIUBYFQWRS-BRTYFSMRSA-N 458.323 0.966 50 20 JCGD CCSc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732618 CMWPGIFDJLLWDU-HGKCTWBKSA-N 455.345 0.390 50 20 JCGD CC(=O)N[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)c1cccc(Cl)c1 1795734999 GZPLBKKDEXHBHD-GMQQQROESA-N 499.760 0.100 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccc(F)cc1F)C2)c1cccc(B(O)O)c1 1795737610 ASGOYRJMRPLEAC-USGNIVHTSA-N 476.310 0.640 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccncn1 1796521072 PVXIVJDJXGEQGA-HBCWATKFSA-N 455.427 0.827 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797754064 KPZNZWYZTJLJNV-CWPLJXCYSA-N 466.498 0.161 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccnc(Br)c1 1798019582 IBBZKLUPELMEHD-JLVBRIDZSA-N 474.120 0.041 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C(C)(C)C)nn1 1798706061 NZWUBJCTYDWXTB-FJABVQHVSA-N 470.534 0.370 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c(O)c1OC 1799664617 JSDOOXRAEINMND-RVQRMFQJSA-N 499.524 0.747 50 20 JCGD NC(=O)[C@@H](N)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800436362 WRDLFBQBEJAVHU-OREBXVKISA-N 481.391 0.175 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1800802195 KXHIAEPTFCKVMJ-BJWYYQGGSA-N 453.260 0.854 50 20 JCGD COC(OC)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1803347380 FXKNJCKNMJLIAU-SWUPIQEVSA-N 456.503 0.840 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n[nH]1 1805254043 FQLAESTVPDWSPS-UTKZUKDTSA-N 461.287 0.321 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CNCP(=O)(O)O)CC2)C1 1805383352 QZRWEMDEFYIODM-CYBMUJFWSA-N 454.302 0.973 50 20 JCGD CN(C)c1cncc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1807363468 PFWJFHCVGIWWQY-CVDCTZTESA-N 473.342 0.856 50 20 JCGD Cc1cnn(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1 1807664854 HYGKNHIQAPUVHA-UTKZUKDTSA-N 462.514 0.605 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1 1808174310 YMIXIBGLDSCSPT-KKSFZXQISA-N 485.508 0.756 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1 1808597995 XHDAHCXTLBQMLR-JTSKRJEESA-N 482.541 0.956 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H](F)Br 1808662136 WLGREJOQECTKLK-UAGQMJEPSA-N 464.100 0.772 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1815228979 PZFPWHFDFMWQLS-LRDDRELGSA-N 477.547 0.395 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOC2=O)[nH]n1)c1ccc(B(O)O)cc1 1817471160 BSSPXPJIWWZHEN-KRWDZBQOSA-N 455.280 0.238 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)C1=O 1817476267 NSDILYNURCXWBO-SFHVURJKSA-N 487.281 0.844 50 20 JCGD CCOc1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nn1 1817476304 APROMZUBTRYXTP-SFHVURJKSA-N 464.291 0.898 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cnn4cccnc34)sc2C1)c1ccc(B(O)O)cc1 1818987752 SQLRQKHJWAIFMR-CQSZACIVSA-N 462.300 0.405 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1819898456 KNPUDSKMWJRUOB-MGJNZBDHSA-N 472.332 0.578 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(CCO)CCO)n[nH]1 1822026527 JHAYBCSLXRQCBU-RDTXWAMCSA-N 450.367 0.925 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3c1OCCC3)CC2 1826089730 MQNHTHJEAXLJIB-GFCCVEGCSA-N 461.548 0.721 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1830539829 IXJHAOAXVHINLD-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725183 GUENOUDTKJQYEU-PNLZDCPESA-N 489.997 0.832 50 20 JCGD O=C(CCc1cnc2[nH]ccc2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830737015 CKPUDPXUKKCJAQ-DYESRHJHSA-N 450.923 0.552 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832072484 HCPWFJPMPPBINB-HSZRJFAPSA-N 492.259 0.096 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3=NN(C)C(=O)CC3)CCO2)C1 1832371438 PUWVUOMEEFFEDZ-FZKQIMNGSA-N 459.341 0.082 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc(OCF)cn1)CCO2 1833568851 QVLYPDOCQLKGEO-QGZVFWFLSA-N 461.288 0.637 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CNCP(=O)(O)O)CC2)CC1 1834666563 VFSJWKLXOYJVET-KRWDZBQOSA-N 473.338 0.519 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nn[nH]c3C(F)(F)F)CC2)CC1)c1cccc(B(O)O)c1 1834800913 AAPPMOPEYOJPKX-UHFFFAOYSA-N 494.283 0.002 50 20 JCGD CC(C)n1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835737954 ONJLMEWFQAULFH-UHFFFAOYSA-N 482.589 0.962 50 20 JCGD CC(=O)NCC(=O)N1CCC(N2CCC(NC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CC2)CC1 1836107506 UYEFKZPYAQVTGM-UHFFFAOYSA-N 489.529 0.841 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1)[C@H](F)Br 1836412846 YNPJHEGNVUNATM-AWEZNQCLSA-N 460.304 0.764 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837456037 AZDBNHYARFVSSR-HSZRJFAPSA-N 485.545 0.020 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461576 YSZUPAAFNPTYRA-VWLOTQADSA-N 481.553 0.615 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1837715938 SILSSPOGGNNSJU-HXUWFJFHSA-N 482.566 0.064 50 20 JCGD COCCOCC(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1837767243 NRVZEPDSOREHEM-KOEQRZSOSA-N 477.562 0.782 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1839717949 SUBURMMVIYREQE-YWZLYKJASA-N 470.910 0.620 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1 1840144255 VZESESIMJUGNGP-MFCZKXCZSA-N 473.364 0.982 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4sc(C)cn4c3=O)C2)C1 1840152376 GWFMJCDNPJBRRY-MGPUTAFESA-N 484.962 0.388 50 20 JCGD Cc1nc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)s1 1840182971 XWWOTIIVKUZHKJ-OAQYLSRUSA-N 467.592 0.132 50 20 JCGD Cc1ccc(SCC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840184628 YJZRCXMAGCJDLN-QHCPKHFHSA-N 478.615 0.917 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1cccs1 1840374335 VSXJAYFQYJWNJB-OPAMFIHVSA-N 458.345 0.302 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)[C@H]2OCC[C@H]21 1841353675 JUOYCXFPKRZGIC-ZJIFWQFVSA-N 457.955 0.814 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1841436986 NLEGUJYYGZFFJB-UHFFFAOYSA-N 450.300 0.603 50 20 JCGD O=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CN1Cc1cccs1 1843010651 OSHMQOINBZAFIX-QGZVFWFLSA-N 467.356 0.294 50 20 JCGD O=C(c1cccc(OCC(F)(F)F)n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010722 VVQLDARNYBRKSW-UHFFFAOYSA-N 463.221 0.833 50 20 JCGD O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014302 VZWFEQOQPTYVQT-UHFFFAOYSA-N 451.244 0.340 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)N(Cc3cccs3)C1)C2 1844263408 AROAWQMZRLFPRI-OAHLLOKOSA-N 482.566 0.612 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844361502 QWVLBHBNIMQJQH-SFHVURJKSA-N 472.590 0.841 50 20 JCGD CC(C)CNC(=O)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038753 OQHNZXJPFFQDCS-UHFFFAOYSA-N 458.563 0.308 50 20 JCGD CO[C@H](C)[C@@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)N(C)C(=O)OC(C)(C)C 1845092397 UPKYEOWYDJHRRI-APWZRJJASA-N 489.378 0.454 50 20 JCGD C=CCOC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1846365745 STKOBKTXDJKZQA-LSDHHAIUSA-N 488.969 0.595 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1 9931150 WWIFLSJUTIHISX-CQSZACIVSA-N 467.525 0.692 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@H](C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)C(C)C)cc1 17194808 ASPZHNNTQODEIN-KRWDZBQOSA-N 457.512 0.996 50 20 JCGD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1 26957266 ZHVPWGXKWDEKBO-LBPRGKRZSA-N 467.500 0.849 50 20 JCGD COc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1 726682796 SWFSUUJIJKZGPZ-MRXNPFEDSA-N 470.438 0.956 50 20 JCGD COc1ccc(CC(=O)NNC(=O)c2cccc(C#N)c2)cc1S(=O)(=O)N1CCOCC1 728827899 DWJBTUPEYHYOIA-UHFFFAOYSA-N 458.496 0.591 50 20 JCGD C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)C2=O 728845667 OBGXFVQKLQRFGN-WNSKOXEYSA-N 471.562 0.977 50 20 JCGD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1 729258455 XBFCPCRIJPJZBN-OAHLLOKOSA-N 455.475 0.762 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)c3cccnc3)CC2)cc1 913108723 HGIZJKRDCRETQI-UHFFFAOYSA-N 459.528 0.464 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccco2)c1)c1ccc(-n2cnnn2)cc1 913156046 QTEJAPXIQHMRBL-UHFFFAOYSA-N 467.467 0.809 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)C2CCN(C(=O)N3CCCC3)CC2)cc1OC 915554800 MBVCCLHTVREKPJ-UHFFFAOYSA-N 462.503 0.936 50 20 JCGD C[C@@H](NC(=O)C1CCCC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916096286 BFNXAOHQLMNUSB-CQSZACIVSA-N 452.533 0.163 50 20 JCGD Cc1n[nH]cc1CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916259786 KPLNLCMARIFYRY-UHFFFAOYSA-N 450.521 0.316 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC3CCC4(CC3)OCCO4)nc2)CC1 916412451 FMZRAWRWADITBX-UHFFFAOYSA-N 454.553 0.330 50 20 JCGD O=C(NC[C@@]1(N2CCOCC2)CCSC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916637237 WDHFFYMMNOGJEU-NRFANRHFSA-N 497.643 0.623 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)c2ccc(C(=O)NNC(=O)Cn3nc(C)cc3C)s2)n1 917392207 TVFCRIZRNXEUIY-UHFFFAOYSA-N 472.531 0.297 50 20 JCGD Cc1ccc(F)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 917718386 YGOOMAUOQHZJJF-UHFFFAOYSA-N 457.505 0.778 50 20 JCGD O=C(CCn1cnc2sc3c(c2c1=O)CCCC3)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919890074 ZKQWGMWVNOMGCD-NSHDSACASA-N 453.546 0.244 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)NCCc3cccs3)c2)CC1 920861288 PFBXEFGBNUNSPF-UHFFFAOYSA-N 479.584 0.788 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1 1778464399 QXHRDBXBJYFHCS-IBUSPFOHSA-N 464.486 0.307 50 20 JCGD C[C@H]1CCc2c(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)n[nH]c21 1779030304 NVEPDPZQROURTN-XMHCIUCPSA-N 453.503 0.215 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780939803 JNVMJFGDUYRJAO-KZULUSFZSA-N 471.377 0.505 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccc(O)nn2)C1 1781491813 JQMSZQCRYTYJOX-WBJRCKAQSA-N 499.528 0.209 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1OCC1CC1 1781883467 MTWAJZNOBGJKFH-AREMUKBSSA-N 494.353 0.921 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)cc1O 1782125975 REMSNMGZBDCKJJ-CYUILNSLSA-N 496.524 0.928 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1783537548 TYUJTUWDFPXPGU-VBKZILBWSA-N 451.365 0.997 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1783538565 UYKHZVGBYWDQPR-PIGZYNQJSA-N 455.334 0.983 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1785097606 PQKWGSCBQBULEV-QHCPKHFHSA-N 451.288 0.082 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(OCF)cn3)[C@H]2C1 1785685222 WCANUVMWDAINIG-AYZFKNHXSA-N 487.492 0.510 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cnccc1C(F)(F)F 1786002331 QBHJPZBKGFBSSK-FNHZYXHNSA-N 477.248 0.687 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nc3F)C[C@@H]21)c1ccc(B(O)O)cc1 1786980048 CNIQXECGPTXKAN-JQFCIGGWSA-N 461.686 0.461 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4ccccc34)C[C@@H]21)c1cccc(B(O)O)c1 1786982782 BESPCUOREYYPNG-HYVJGQCMSA-N 459.311 0.822 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C[C@@H]21)c1cccc(B(O)O)c1 1786983555 RZWDOLQDZBHQTH-ZZMFMQDLSA-N 466.265 0.692 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984202 PTRMDOPAGCSBCD-SZMVWBNQSA-N 468.344 0.291 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786985099 LPNVZNJFTMXSMY-CQOCVSQPSA-N 468.334 0.978 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ncsc1Br 1787548072 IJGTXOOGTIOSEQ-QEJZJMRPSA-N 494.176 0.493 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610289 WAZNUPNMNVQKSU-MBIOBJJBSA-N 458.346 0.515 50 20 JCGD Cc1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)ccn1 1788611704 SJVZOGAXPLWKRT-YYWHXJBOSA-N 466.542 0.615 50 20 JCGD CN(C)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1789527983 AOTBYRAETVJDAV-NYVOZVTQSA-N 451.332 0.340 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21 1791061620 ZNBUGWGDSGHVGL-DHMWGJHJSA-N 485.404 0.655 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)C[C@@H]21 1791251698 PURPWWSGZOJQOW-KANFNMMFSA-N 472.991 0.866 50 20 JCGD C[C@@H]1[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CCN1C(=O)OC(C)(C)C 1792983558 OSVKKXYROBGGLO-RGGMIXCSSA-N 459.971 0.821 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C1 1793112551 RFRMJEOBCDRCRM-NEMWNAMBSA-N 459.971 0.842 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)OCO2 1795312379 JVAHBAIGHJUXFC-JKWNGSSESA-N 481.509 0.681 50 20 JCGD COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1C 1795737140 WPBWNPJWQOEAEJ-BBIADKPPSA-N 452.316 0.129 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cn2cc(Cl)ccc2n1 1796849033 CGYPYBFRUBVUKY-YVWYUNDQSA-N 468.706 0.185 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnc2s1 1796908255 YKBHAGMCSGEUGW-ZSBFGKGUSA-N 466.523 0.812 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(O)nc2ccccc12 1796913056 AXJLQAWLWHNADI-MFKICJERSA-N 461.283 0.137 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748668 QRZUKSVODGQCOQ-FAQVEIGNSA-N 495.536 0.308 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNc1ccc(F)cc1)C2 1797750910 XFRSWGQSJIRUKC-VTEUUUEMSA-N 456.478 0.140 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(Cl)c1 1797753985 HGFOZVWQWHNIAV-DBWKPXFBSA-N 473.917 0.864 50 20 JCGD CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)no1 1798220232 KLUFLEOUULSBDI-OPMZPASUSA-N 484.557 0.786 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800434830 DKWDOZIJAZXZGV-CNMWIUBYSA-N 498.374 0.647 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)C2 1801010593 KGKIRHBZBIGSPM-ZRAXVTTISA-N 457.531 0.142 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1[N+](=O)[O-])C2 1801012365 AHWPDTVHKYHLNG-IVWMJMPLSA-N 451.455 0.310 50 20 JCGD O=C(CN1C(=O)CNC1=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1 1804094858 VESNUXRYUZHTOZ-GLQYFDAESA-N 456.272 0.330 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n(C)n1 1804923349 AVCGNUPTUKQWBS-LAUBAEHRSA-N 463.303 0.137 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1805024128 GOAANANGCBWHFC-IPELMVKDSA-N 480.974 0.941 50 20 JCGD O=C(CNCP(=O)(O)O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1 1807026091 QGMMSBURWSIRJR-FPMFFAJLSA-N 467.232 0.503 50 20 JCGD Cn1cc(F)cc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373942 DRTFCFRPYMFKOR-UTKZUKDTSA-N 450.279 0.872 50 20 JCGD CN1CCN(C2(C(=O)NC[C@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)CC2)CC1 1807950100 KIJRWHHBGXUDKD-NFBKMPQASA-N 485.633 0.240 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808205398 XHPOSIIUQPZMNU-YYWHXJBOSA-N 479.371 0.108 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810293243 BEUTXONYFGMVAH-ZXUOCUECSA-N 454.531 0.807 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)C(=O)C(=O)O 1812392949 WERVAIBRNWVZQN-YJBOKZPZSA-N 450.568 0.482 50 20 JCGD CCCNC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813068253 KGOPWOPDZHXHOB-MBSDFSHPSA-N 460.579 0.767 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347949 YZKMTSGATMBNOE-CJNGLKHVSA-N 453.333 0.582 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCC3)CC2)c1cccc(B(O)O)c1 1815356724 NKBVUUAQPQDJPJ-CQSZACIVSA-N 451.317 0.505 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472459 SWIPHZGGGFDVNQ-SFHVURJKSA-N 462.275 0.429 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472475 UEBHNPBMPOVDFA-KDOFPFPSSA-N 455.324 0.700 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817477413 YVSGHSUOQOHJRT-GUYCJALGSA-N 458.280 0.957 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1SC(=N)NC1=O 1818098618 XCJFDSIAECOJCA-XNJJOIOASA-N 484.347 0.198 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)/C=N/N3CCCCC3)sc2C1 1819776518 DWGBTMFXFCRJNV-ZGUVFNMESA-N 470.559 0.839 50 20 JCGD O=C(CN(CCO)CCO)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2 1825327791 QTKYEJBJLPEMMW-NOZJJQNGSA-N 453.334 0.032 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H](O)N2CCOCC2)CC1 1827680190 FTQBDZKBYYNWTH-GSLOIJSKSA-N 488.589 0.391 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)COc2ccc(O)nn2)CC1 1828924702 YTPACBOFKXUPMU-SFHVURJKSA-N 483.529 0.493 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)CC1 1831147632 FQOMNFZFJRHDLN-RUZDIDTESA-N 490.413 0.997 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)CC1 1831147634 FQOMNFZFJRHDLN-VWLOTQADSA-N 490.413 0.997 50 20 JCGD CNC(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1831279246 GTFLBECIKCMQDP-XXFFJTNUSA-N 462.453 0.464 50 20 JCGD O=C(/C=C/c1ccoc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833752389 GIZKVZZTLNNFAN-SNAWJCMRSA-N 451.332 0.858 50 20 JCGD CCOCC(=O)NC1CCN(C2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1834482733 ACJFWHWFQVVHLU-UHFFFAOYSA-N 488.633 0.941 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cccc1 1834799145 PADJYOOYZGLBKC-SFHVURJKSA-N 452.364 0.614 50 20 JCGD CCc1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1835838897 JJADGYDFGSPJKK-UHFFFAOYSA-N 470.404 0.884 50 20 JCGD Cc1scc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1C 1835935336 OSOHFFMLCDNBSL-QFIPXVFZSA-N 458.345 0.429 50 20 JCGD CC(C)n1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1836183172 VTMQZEBXBQCWCP-UHFFFAOYSA-N 482.589 0.962 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4nscc34)C2)C1 1837460016 QQYZTJGQORTXQW-HSZRJFAPSA-N 496.549 0.679 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837634134 XIFGJYDRBOPWAR-HNDWEXJHSA-N 498.374 0.939 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1837717973 UDMIPZRZCRJPHB-IIBYNOLFSA-N 450.612 0.823 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1839153162 CLGOFMKWAABGBV-MOPGFXCFSA-N 459.330 0.713 50 20 JCGD C[C@H](NC=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839166030 CZMJQUZIZHUXTA-CZPMCIAXSA-N 462.453 0.463 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)c(F)cc3F)CCO2)C1 1839288572 MWYJNRZWTDUWST-JOCHJYFZSA-N 493.442 0.486 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1 1839578640 LFSDWZYEBXWDII-BUXKBTBVSA-N 499.387 0.979 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839752732 RFZXIWJRCGINLZ-JXFKEZNVSA-N 461.342 0.947 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1840033354 AZZNCSSVDSVIAJ-VHKYSDTDSA-N 482.331 0.961 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H](C)NC(=O)OC(C)(C)C)C2)C1 1840152806 UKZAGWCMEPLOHG-WHSLLNHNSA-N 477.986 1.000 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1 1840182502 KCWUBMNFNBRQCY-FQEVSTJZSA-N 460.522 0.641 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3c[nH]c4ccccc34)C2)C1 1840183855 DUFIVGOZDNQDOQ-VWLOTQADSA-N 485.585 0.930 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1N(C)C 1840185668 UVVXAVFZAYCESG-XMMPIXPASA-N 491.589 0.204 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1 1840342413 WAZFQOZZWBHVNS-RTMAMBHISA-N 469.502 0.013 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(CC(C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)=NO2)C1 1841353791 PLCUOKNZYLBWNH-YCRPNKLZSA-N 470.954 0.945 50 20 JCGD C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011914 KENNUSZHKNYTOE-HXUWFJFHSA-N 483.374 0.880 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012590 DFRPGQUPWRSYFA-IBGZPJMESA-N 497.361 0.043 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCN1C(=O)c1ccc(F)cc1)C2 1844263309 PDQVWYLCEYYZFR-FQEVSTJZSA-N 494.527 0.946 50 20 JCGD COc1cc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c([N+](=O)[O-])cc1O 1844737296 UINHQJURBKARJC-UHFFFAOYSA-N 455.232 0.120 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1F 1845262016 ZHAHCJJCTKGJBT-HSZRJFAPSA-N 467.306 0.374 50 20 JCGD O=C(NNC(=O)c1ccc(COc2ccccc2)o1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 45293582 DDRBMZXOJAPBNL-CQSZACIVSA-N 474.495 0.785 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1ccc(Cl)cc1 726670028 CLZAJBCRORZGLU-UHFFFAOYSA-N 467.887 0.653 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CN3C(=O)CCOc4ccccc43)cc2)CC1 728213393 KFRWGGLETMTOIF-UHFFFAOYSA-N 473.555 0.882 50 20 JCGD COCCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 728341856 YFTIKYJFKUKKMX-SFHVURJKSA-N 478.479 0.251 50 20 JCGD O=C(COC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)c1cccc(Cl)c1 729947044 UCTYZMROVOBFQD-UHFFFAOYSA-N 462.802 0.978 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCc1cc(C)no1)N(S(C)(=O)=O)CC2 747305447 WFFJRWHGGOLEAK-INIZCTEOSA-N 481.531 0.780 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(-n3cnnn3)cc2)c2ccccc2c1=O 747406707 JDVQRPHUEPXDKK-UHFFFAOYSA-N 454.472 0.406 50 20 JCGD CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NNC(=O)C(=O)N3CCCC3)CC2)cc1 748462985 UPBBLJADUDTYNH-UHFFFAOYSA-N 451.549 0.402 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1)c1ccc(-n2cnnn2)cc1 807135554 KPHKWGYSTSJMOF-UHFFFAOYSA-N 496.553 0.512 50 20 JCGD Cc1c(/C=C(\C#N)C(=O)OCC(=O)N2CCc3cc(S(N)(=O)=O)ccc32)cc(C#N)n1C 913287273 ZGEPEBCJHQOWJV-FRKPEAEDSA-N 453.480 0.892 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NCCCN(C)S(=O)(=O)CC)c2ccccc2c1=O 916580054 BRJBFFKZYSQLAU-UHFFFAOYSA-N 466.564 0.812 50 20 JCGD Cc1ccc(-c2cc(C(=O)NNC(=O)c3cc(S(=O)(=O)N4CCOCC4)cn3C)n[nH]2)cc1 917178592 YIIIWXVROWIGSH-UHFFFAOYSA-N 472.527 0.819 50 20 JCGD CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(OC)c([C@]2(C)NC(=O)NC2=O)c1 917720555 JOMLKPZLELYNFP-NRFANRHFSA-N 492.510 0.537 50 20 JCGD COc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCN(C(C)=O)CC3)c2)c1O 919757034 SIIJUGSSYIANRE-UHFFFAOYSA-N 476.511 0.328 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(OC)c(OC)c1 919820594 RUNOTFRMHYWSAW-UHFFFAOYSA-N 451.501 0.771 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C(=O)C(=O)NC3CC3)CC2)N(C)c2ccccc21 919845570 GNNFLDPREJVYAB-UHFFFAOYSA-N 464.526 0.606 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1)N[C@@H]1CCS(=O)(=O)C1 919885923 PTFINKVODMKLCW-CYBMUJFWSA-N 470.504 0.758 50 20 JCGD O=C(NNC(=O)c1ccc2c(=O)n(-c3ccccc3F)c(S)nc2c1)N[C@H]1CCS(=O)(=O)C1 919888855 HJZOCMJCDQWVJP-LBPRGKRZSA-N 491.526 0.945 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1cccc(CS(C)(=O)=O)c1 1318089551 VJLRYJJBVAFGHS-UHFFFAOYSA-N 467.573 0.977 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1csnn1)C2 1778091527 JDXIMBZINGMLDJ-FBNGPRBQSA-N 459.532 0.800 50 20 JCGD COc1cscc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1778336643 KRLDJOLSVWZYOZ-DENIHFKCSA-N 458.345 0.878 50 20 JCGD COc1cncc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1 1779371152 JHPJWQVZZNSKSO-PXDATVDWSA-N 496.568 0.849 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1 1779610980 PKILAYQNPSVQCL-JOCHJYFZSA-N 455.519 0.288 50 20 JCGD CCc1cc(C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)nn1C 1779833460 IFIMEBFDPAMCPG-VWLOTQADSA-N 497.600 0.772 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1780200670 HBFPLUZPUWKBHY-OAQYLSRUSA-N 475.578 0.974 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1nc3ccc(C(F)(F)F)cn3n1)CCO2 1783933918 MUKGYNOLFZAIRX-HXUWFJFHSA-N 497.478 0.565 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935403 QTCUNUQDVODQBC-NRFANRHFSA-N 467.954 0.950 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)[C@H](O)C1 1784084468 TUJPIUKPJNQJKP-FRMKIJSPSA-N 489.997 0.184 50 20 JCGD N#Cc1ccccc1OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1785379767 DXIPWQOTBGUXJK-QHCPKHFHSA-N 464.482 0.079 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCOC3)C2)C1)NC(=O)NCc1ccccc1 1785497623 WOWFXJKOUKFMEC-RDPSFJRHSA-N 473.574 0.589 50 20 JCGD C[C@@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)n[nH]c21 1786979758 PBNOPGLNOLGYBG-UVDFWXMISA-N 452.320 0.046 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cnccc4c3)C[C@@H]21)c1cccc(B(O)O)c1 1786983624 YLUFEMWYQVTXHI-PMVMPFDFSA-N 459.311 0.822 50 20 JCGD CCn1nc(C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1787289438 CEAIMAHFXGMLAV-FNHZYXHNSA-N 455.519 0.117 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)[C@H]2C1 1790625751 ZYFVKSLQUNYTNJ-RLTCUEGQSA-N 457.556 0.975 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc(C)c1O 1791936606 JPOTWZJFNHTGFF-YSSFQJQWSA-N 467.526 0.915 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2 1792867619 IDXWMLIBDLOJLI-RBZJEDDUSA-N 491.427 0.849 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1794113809 GRRUENPEGKAIRC-CENPHQPOSA-N 497.980 0.364 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCSC(=N)N 1795587808 GTVMXFSKVUSDKQ-IVWMJMPLSA-N 479.515 0.740 50 20 JCGD Cc1cc(Br)cnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732507 NNZRKMDOELZXPK-CCWDJLKJSA-N 488.147 0.349 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188656 DPUSASVHKJKONO-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD O=C1Nc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)cccc2C1=O 1797539789 HXJYXNDZJUMRAB-GDGVSTKUSA-N 454.252 0.715 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3ccncc13)C2 1797754079 SPJJADIQZRDWIE-VPTLXERWSA-N 460.494 0.750 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cc2nn[nH]c12 1798620232 ZQTBZSBAWWZTBG-KSPBDQMDSA-N 463.926 0.188 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc([N+](=O)[O-])[nH]1)NC(=O)NCc1ccccc1 1798748511 SKICZTBDWUOUOA-UPHUGPLXSA-N 499.528 0.472 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)cn1 1799095346 ODSSOPRQKDVZRE-JHDGKUDLSA-N 496.568 0.640 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799349569 YWUJJDSARJTJAV-XXUMUBMXSA-N 482.347 0.542 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)C2 1801010847 ZMVBFCXGPDELET-UPHUGPLXSA-N 471.558 0.368 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1cncn1 1801355679 JPJTVPQUGZKCPS-RBGFHDKUSA-N 470.958 0.561 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cc1cccc(F)c1)NC(C)=O 1802042525 ZLOMYJKQTIVQFZ-DLRXZHIHSA-N 469.941 0.716 50 20 JCGD Cc1nc(O)c(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nc1C 1804871920 BKQJXZRQACOSET-LAUBAEHRSA-N 469.546 0.887 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1 1804948692 DKSGHGFDXUAABT-IIBYNOLFSA-N 456.503 0.173 50 20 JCGD CN1CCN(CCC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1806914834 NQOOEHKDYSGXEI-XXBNENTESA-N 494.600 0.037 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)CN)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807037409 KPYPEMMAGLHHOP-KNQAVFIVSA-N 453.547 0.392 50 20 JCGD Cn1ccc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810303694 UUTXJIZLSKOLJU-IIBYNOLFSA-N 462.514 0.376 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810305198 JAUHVDRDKYRHRF-VGOFRKELSA-N 476.541 0.982 50 20 JCGD COc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1OC 1811645204 QJKJLUHXGFRQCN-AVRDEDQJSA-N 490.325 0.807 50 20 JCGD C=CCNC(=O)/C=C\C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1814437194 MMUUMEZIXJMSDV-LPADLIQXSA-N 451.292 0.254 50 20 JCGD C[C@@](O)(C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(F)(F)F 1817474175 OACUUQWKVKVGRK-RDTXWAMCSA-N 454.214 0.709 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)[nH]n1)c1cccc(B(O)O)c1 1817477340 TXWBZOSFTFYYNF-QFIPXVFZSA-N 488.357 0.792 50 20 JCGD COC(=O)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1 1818223489 SEVAPALCXVPBPL-IBGZPJMESA-N 477.286 0.891 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)c1ccco1)CC2 1819790116 FLNOJEMLCGFIBO-QLJPJBMISA-N 456.484 0.694 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1824634595 GCYGADDCYKIAFU-OAQYLSRUSA-N 457.380 0.762 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc[n+]([O-])c2)CC1 1825379898 SYXHUDYUDIRCQI-HXUWFJFHSA-N 452.515 0.866 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CC[C@@H](N)C(N)=O)CC1 1827680850 IXKNEZMCUWBCPC-PACTWVOPSA-N 473.578 0.333 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1827971774 MJMGBPGUXQSSTG-HNNXBMFYSA-N 488.375 0.964 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924506 VMENSTVPOCNLBO-KXBFYZLASA-N 456.547 0.609 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1830364130 ZQTRNSVGNIAUQW-NRFANRHFSA-N 485.006 0.613 50 20 JCGD O=C(c1cccc(OCC(F)(F)F)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830723937 ACXGMUIVZXOYSM-KBXCAEBGSA-N 481.855 0.692 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2 1832499617 VLCVADGQNYLYDW-KLHJMIIUSA-N 454.907 0.537 50 20 JCGD Cn1ncnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549494 SGVHIPSLXGASPM-VBKZILBWSA-N 486.957 0.017 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnc[nH]3)C2)C1 1832549707 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1835940300 MBNQJQYTMRXSMX-UHFFFAOYSA-N 454.336 0.470 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(O)c1 1836245078 BXOLBOXTQMKDSX-UHFFFAOYSA-N 481.358 0.580 50 20 JCGD Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)no1 1837156910 ISWXAAYBEOIXQP-UHFFFAOYSA-N 471.518 0.231 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1 1837460341 BVZXDTMRRRFODL-QHCPKHFHSA-N 489.479 0.276 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1837609599 VUBNXOXFGWUEGO-GKCIPKSASA-N 488.372 0.288 50 20 JCGD Cc1ccn(C)c1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919083 BUCMOJRAMNWTHQ-UHFFFAOYSA-N 453.348 0.939 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837921049 VJAYCYSVPXVIHQ-QFIPXVFZSA-N 473.379 0.283 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837948762 HPYMWEGGYALHPV-ZWKOTPCHSA-N 461.302 0.481 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)C(C)(C)C)C2)C1 1838526742 BFIZYOVBKIAGLT-WMZHIEFXSA-N 493.513 0.997 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)CCO2 1838826669 UAIAAFJKKAUAPP-GQBLCDNYSA-N 487.473 0.127 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1839148383 XHLALDGLISKJRF-LAUBAEHRSA-N 453.971 0.806 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839651285 VNQDODXNNOIXIG-HXUWFJFHSA-N 452.584 0.423 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)[S@](=O)c1ccccc1 1839674182 ODDKUSWCNAIHPV-VHKJGPOGSA-N 494.614 0.012 50 20 JCGD CN(C)C(=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839743248 GFFGHKWEFCZKDP-KYIYGJGQSA-N 462.453 0.416 50 20 JCGD NC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802584 DEAKBOHYRSGBSC-JXFKEZNVSA-N 483.363 0.117 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1839966461 FPKUQNVHCZZNAQ-BEFAXECRSA-N 471.352 0.909 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)C2)C1 1840150627 NXTDKQLFUVOLHE-WHSLLNHNSA-N 477.986 0.857 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1840154638 ASIWGVPFENAMBA-XOBRGWDASA-N 484.962 0.450 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840184712 BZYZURWPRIAFQA-QHCPKHFHSA-N 464.538 0.506 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840297924 DOKNSRUOPFAVHD-DFBJGRDBSA-N 466.343 0.315 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(Cl)c1 1840734337 ILPDXOQWRAHIGI-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cn2ccc3ccc([N+](=O)[O-])cc32)C1 1841509463 YQNCCKCTQPHPRF-UHFFFAOYSA-N 462.271 0.747 50 20 JCGD CN1CCN(CCC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)CC1 1842827533 SKYZIRGTPUWQDI-KRWDZBQOSA-N 472.030 0.959 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014006 MUUZNPNROWJSBY-HSZRJFAPSA-N 471.363 0.831 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)c1)C2)NC(=O)NCc1ccccc1 1845038748 NTQWXLDLANMKPA-UHFFFAOYSA-N 468.514 0.656 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C)C1 1846202304 CMFSONGLEBUEOJ-INIZCTEOSA-N 451.568 0.962 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H](C[C@@H]1CCOC1)NC(=O)OC(C)(C)C)C2 1846384902 WXKKNURXCOAWRO-ZWKOTPCHSA-N 495.621 0.883 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847562889 DFFKXYVVSHJZEM-TYXVVTFGSA-N 457.955 0.547 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)c1ccccc1O 17576539 BEMFLTYBSLFCLK-UHFFFAOYSA-N 460.512 0.467 50 20 JCGD COc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1 726682794 SWFSUUJIJKZGPZ-INIZCTEOSA-N 470.438 0.956 50 20 JCGD CC(C)(C)OC(=O)[C@H]1CC(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)=NN1c1ccccc1 728803672 AHYAEIOIIZEGHC-XJKSGUPXSA-N 450.517 0.545 50 20 JCGD O=C(NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F)c1csc(N2CCOCC2)n1 729835904 RRDGMERYVULLLH-UHFFFAOYSA-N 487.510 0.773 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)c2ccccc2c1=O 730517074 RAURMXWGCFLUGT-KRWDZBQOSA-N 483.550 0.937 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)NCCS(=O)(=O)N2CCSCC2)c1 730672827 OTACCJUNKUAWEO-UHFFFAOYSA-N 481.394 0.780 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccccc2O)o1 730778752 MFGXZOCJMAZGGL-CYBMUJFWSA-N 481.483 0.541 50 20 JCGD Cc1nc([N+](=O)[O-])cn1CCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 747120331 GQOHATQPDBVCAR-UHFFFAOYSA-N 494.530 0.291 50 20 JCGD O=C(C[C@@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1 748246548 CHUVCIUGIWMUDW-INIZCTEOSA-N 486.554 0.492 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1)C(=O)N1CCCC1 748247172 VERIMRGDVSGOPU-UHFFFAOYSA-N 499.593 0.577 50 20 JCGD CSc1nc2nc(C)c(CC(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)c(C)n2n1 762985018 RMOHHITVBZVRIV-UHFFFAOYSA-N 463.545 0.704 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)CN2C(=O)[C@H]3[C@H]4C=C[C@@H](C4)[C@H]3C2=O)cc1 860424506 HWPNYGMNVZGMBB-UOVPBQLFSA-N 466.523 0.676 50 20 JCGD Cn1c(=O)n(CC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c(=O)c2ccc(C(F)(F)F)nc21 915795014 IOMWQJZBMFVCFH-UHFFFAOYSA-N 466.332 0.483 50 20 JCGD COCCOc1ccc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1OC 915957548 MKZDXBJZAWQRNZ-UHFFFAOYSA-N 451.505 0.145 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCCN(C)S(C)(=O)=O 916580407 WNOGGUBIJPSILW-NSHDSACASA-N 451.343 0.828 50 20 JCGD CN(CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)c1ccc(Br)s1 919886794 VCWBFSRXTHBYMF-MRVPVSSYSA-N 453.340 0.100 50 20 JCGD O=C(NNS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-])N[C@@H]1CCS(=O)(=O)C1 919961256 YSGPGQAWFSGFQD-MRVPVSSYSA-N 457.284 0.037 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4cnccc4c3)C2)C1 1777861392 QWSOOBOWXWDZLB-DEOSSOPVSA-N 460.494 0.991 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)o1 1779366948 GPMYOKGTHPUPOQ-WZONZLPQSA-N 484.513 0.678 50 20 JCGD Cc1cc(/C=C/C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)no1 1779372362 GBGNGVCGYQTMOM-VFCPGPMVSA-N 468.514 0.822 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2)C1 1781340973 AEARHPHUBGIQEQ-KSMMKXTCSA-N 478.384 0.875 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc3n(n1)CCNC3=O)CCO2 1782864476 MQKIUDGMWPPKQW-OMHSXHNCSA-N 496.474 0.955 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ncc(Cl)cc1Cl 1783428346 JHJZFYBBNRQREG-OWQGQXMQSA-N 478.141 0.975 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1coc([Si](C)(C)C)c1)CCO2 1783936536 XDFASDLUROGLAP-NRFANRHFSA-N 450.612 0.641 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)[C@@H](O)C1 1784084471 TUJPIUKPJNQJKP-WJWMFLMHSA-N 489.997 0.184 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C[C@@H]21)[C@H](O)CCl 1784090831 DDFKLMCMMYHCJA-FATJJJSSSA-N 455.851 0.517 50 20 JCGD O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21 1786408809 CEPAXIGSRFQQDV-QEJZJMRPSA-N 485.404 0.656 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786983445 PRMQRXUECWGUJU-NHKCCNDQSA-N 478.354 0.772 50 20 JCGD CC#C[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)c1ccc(O)cc1 1786983797 SLWLNYPUPJBTGU-NBMBROAQSA-N 490.365 0.863 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Br)cn3)C[C@@H]21)c1cccc(B(O)O)c1 1786984273 XLBIRJRCKWRDFV-FNHZYXHNSA-N 488.147 0.431 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCO4)C[C@@H]21)c1cccc(B(O)O)c1 1786984939 BUODNFHGZYUJLU-RRPUWOKSSA-N 464.327 0.137 50 20 JCGD CC(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724631 DVBLYIBFIYZRKC-ACRUOGEOSA-N 475.590 0.737 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1n[nH]c2cccc(F)c12 1790482995 AQJFBFSMVIKWLI-QOKNQOGYSA-N 466.278 0.289 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncn3-c3ccncc3)C[C@@H]21 1791288608 LNZNOZPJNQXEMQ-QRFRQXIXSA-N 469.546 0.234 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1C 1793654787 PFPDHAGAYWYNNL-FAQVEIGNSA-N 467.526 0.448 50 20 JCGD CC(C)n1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1C(=O)O 1794757621 SUHCSSJNLZDPQU-BJWYYQGGSA-N 454.292 0.408 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nc[nH]c12 1796141391 FAAUBXCBVVXFNL-UTRJNVLQSA-N 463.498 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])c(O)cc1C)C2 1796443758 GZENUTIOLMUZSX-JXZJUKCJSA-N 498.496 0.946 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(C#N)c1)C2 1796444173 YYFROHRAHVIBQR-ZCZLHUBVSA-N 480.500 0.963 50 20 JCGD Cc1nc2ccccn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1796836896 COUOGUJQUHJZGS-CCWDJLKJSA-N 463.498 0.158 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)C2 1797753620 BYTJQKYONKIXFR-IVWMJMPLSA-N 472.433 0.249 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCS1(=O)=O 1800388519 BXKSYMXNXQJERA-QRJUGERDSA-N 494.010 0.285 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2 1800756204 HIYICOVXKMSRSY-UXXRCYHCSA-N 477.400 0.602 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)ccc3c1OCO3)C2 1801011680 YPKLXRXYDIIEJJ-DBWKPXFBSA-N 466.922 0.645 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)C[C@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1803007574 DKPFUQOLZYEGOL-UZMCECQYSA-N 466.336 0.717 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC2(CCCN(C(=O)C[C@@H]3NC(=O)NC3=O)C2)CC1 1806849112 WHJVMPRHKBKHCS-GJZGRUSLSA-N 499.996 0.948 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc3snnc3c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360688 LSWLUIXKARCGGQ-OXQOHEQNSA-N 488.338 0.795 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCN2CCCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371089 PHJMZIIFSLBIEK-XUZZJYLKSA-N 464.375 0.957 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1 1809237485 ZRUWKGMVBSMSMF-QAPCUYQASA-N 486.496 0.151 50 20 JCGD Cc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810293198 AVUDPCKTHUEROM-OXJNMPFZSA-N 462.514 0.755 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n[nH]1 1810301736 BCWXRYZIDXJVHD-IERDGZPVSA-N 462.514 0.674 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CSc2ncccn2)[C@@H]1c1cccnc1 1810303993 ZJCSZVJEOVBQBH-OXJNMPFZSA-N 492.565 0.982 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C(=O)CNC(N)=O)[C@@H]1c1cccnc1 1811359323 LYSKTBLSZVAXBE-FOIQADDNSA-N 484.469 0.903 50 20 JCGD CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1812773176 ANYPOTXALWJMAV-JKIFEVAISA-N 466.336 0.813 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1812810787 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NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1ccccc1=O)CC2 1819794728 BYLLKFXBKZBODF-LBPRGKRZSA-N 467.511 0.229 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C)CC1 1824108381 FQENOZRANUJBOX-RBUKOAKNSA-N 497.637 0.865 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3c(c1)CNC3=O)CC2 1826087480 DWYBKQVYQWYRML-AWEZNQCLSA-N 470.555 0.985 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052293 SSASSKLTRMSBNE-YADHBBJMSA-N 488.346 0.095 50 20 JCGD O=C(COc1ccc(O)nn1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053539 SYLFOHNZUHILPB-IBGZPJMESA-N 468.319 0.174 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(=O)n2O)CC1 1828925062 CVMPCBAEIVDJIC-SFHVURJKSA-N 468.514 0.631 50 20 JCGD CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCN2C(=O)OCc1ccccc1 1829133725 QZKBGUUQRICELW-DEOSSOPVSA-N 480.525 0.771 50 20 JCGD CC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CNC(=N)N)C2)C1 1829220657 BTROYOBXACVUNV-HTAPYJJXSA-N 478.981 0.939 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)ccc1F)CCO2 1830192192 VIDNUPPWMZLHIS-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCc1cnc3ccccc3c1)CCO2 1830442124 HQIPJSSMJIROPK-AREMUKBSSA-N 497.596 0.997 50 20 JCGD CCOc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cnc2c1cnn2C 1830723588 QHFZOBVSTPXAFY-IERDGZPVSA-N 481.937 0.037 50 20 JCGD Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)nn1C 1830945691 PLCXJWDHAIEBPI-LIRRHRJNSA-N 457.369 0.758 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnn(-c4cccnc4)c3)CC2)CC1 1834004844 VLMDDBZHCIGWER-UHFFFAOYSA-N 496.616 0.826 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1 1834422519 SDXYDCGCJKMVNM-CQSZACIVSA-N 481.457 0.671 50 20 JCGD CO[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccc1 1834797884 HUCWOSXJTYBRDG-DEOSSOPVSA-N 479.386 0.939 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccnc(F)c3)CC2)CC1 1835737077 KMJLWJLJSDZZDC-UHFFFAOYSA-N 469.521 0.718 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc4cccn4cn3)CC2)CC1 1835738209 ZPEIUTUJRGMKCU-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1 1835844395 GUXJXTCKPAYLPS-LJQANCHMSA-N 456.660 0.561 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3C(F)(F)F)C2)C1 1835931614 TXECAQBLWDZQGV-NRFANRHFSA-N 493.247 0.164 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)cc21 1836717013 DNHCMMNQWGOPNA-SFHVURJKSA-N 467.954 0.229 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCCCN3C)CC2)CC1 1836729187 SQUUZEMSEDUUFF-FQEVSTJZSA-N 451.612 0.842 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456450 MWSZSLCKDRGXAT-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H](N)c3cccnc3)C2)C1 1837711248 AFRWDJVZTKMNIC-NQIIRXRSSA-N 450.612 0.779 50 20 JCGD CCc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)s1 1837721426 VSLSGWDALQBJLO-IBUSPFOHSA-N 488.570 0.910 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)[nH]1)CCO2 1837766637 KYUVEKQCIZLTRK-LJQANCHMSA-N 475.468 0.477 50 20 JCGD O=C(Cc1ccccc1O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921583 QTGNSKCUIHFODX-UHFFFAOYSA-N 466.343 0.927 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1 1838079902 RYJGOBFYMFTBEY-MZJWZYIUSA-N 499.528 0.634 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838353184 GRMLGXOYBZQOIJ-XMSQKQJNSA-N 483.949 0.309 50 20 JCGD Cc1n[nH]cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1838683841 AYXTXLSVCAKKKQ-DEOSSOPVSA-N 499.572 0.134 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1 1839137108 XAFXBQBDOZINGP-KKSFZXQISA-N 485.921 0.856 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])CCO2)C1 1839234186 XXSMFJRMYRAXKO-DYESRHJHSA-N 485.921 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c(C(C)(C)C)c3)C2)C1 1840183451 FJIOWGGJVTUNDD-QHCPKHFHSA-N 463.579 0.755 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc4c(c3)OCO4)C2)C1 1840184170 WKCKTWZRKFBFIB-DEOSSOPVSA-N 490.557 0.177 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)c3ccccc3)CCO2)C1 1840800700 OSRFRDHBZSOHJG-XMSQKQJNSA-N 467.950 0.517 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2 1840951152 HHMRGIDJWWQTES-NHCUHLMSSA-N 458.506 0.561 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)N1C(=O)OC(C)(C)C 1841011239 JMZVNBYROZETNV-LPHOPBHVSA-N 471.363 0.971 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c[nH]c1C 1841455972 QSWMYUVYQPEJGN-UHFFFAOYSA-N 482.541 0.948 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CNC(=O)c1cccnc1)C2)NC(=O)NCc1ccccc1 1845038459 DQZZVEDUZJAYSQ-UHFFFAOYSA-N 493.568 0.361 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(CS(C)(=O)=O)cc2)cc1OC 9839360 ZCIKAVFWMOHQHJ-UHFFFAOYSA-N 450.469 0.866 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)cc1 16786010 RDXXDZYTHZXXGD-MRXNPFEDSA-N 479.536 0.886 50 20 JCGD C[C@H]1Cc2cc(C(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)ccc2N1S(C)(=O)=O 17161207 BFBNOAOUZLXARL-LBPRGKRZSA-N 476.467 0.923 50 20 JCGD CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 726152463 PTZIKWJLLVFFHZ-UHFFFAOYSA-N 476.920 0.244 50 20 JCGD COc1cccc(N2CC[C@H](NC(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cn3)C2)c1 728221056 NAOQUGCJSGPBMJ-KRWDZBQOSA-N 489.602 0.931 50 20 JCGD O=C(COC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1 750183378 RDTOZVOVTHKYJG-MRXNPFEDSA-N 484.421 0.933 50 20 JCGD CNC(=O)NNC(=O)CCNS(=O)(=O)c1cc(Br)ccc1Br 920212543 OSNREQWJIXKZEJ-UHFFFAOYSA-N 458.132 0.840 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1 920271590 PKULJIHJKDORSD-UHFFFAOYSA-N 486.554 0.544 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2F)cc1 921295227 KASRYRIMZUXOHK-UHFFFAOYSA-N 493.560 0.168 50 20 JCGD O=C(Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O)NNC(=O)NC1CC1 1317918570 WVUQBMADDMMCTK-UHFFFAOYSA-N 487.520 0.949 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1778052274 BKBXIIGAYGUQHY-GXYOHSSGSA-N 477.986 0.640 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Cn1cncn1)C2 1778091231 RNFGTVKLVAXIGW-IERNEYDSSA-N 484.561 0.562 50 20 JCGD CC(C)(C)OC(=O)N1CC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)C1 1778758744 OWAURMCRYKBRBO-GCKMJXCFSA-N 459.971 0.967 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1 1779028880 PEYWUIKLXCFTNX-HSZRJFAPSA-N 476.497 0.023 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(F)(F)F)[nH]3)CCO2)C1 1779031799 FVNDYCUGDBZAAY-LJQANCHMSA-N 466.420 0.789 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)C3=Cc4ccccc4NC(=O)C3)CCO2)C1 1779032446 KAZXKRUAYKPIEF-RUZDIDTESA-N 490.520 0.554 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2 1779201767 WTLBRGBMTUKYTG-SRCQZFHVSA-N 450.330 0.350 50 20 JCGD Cc1cccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n1 1779371104 NFLUUXDTXIOANO-AUSIDOKSSA-N 452.515 0.830 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1[nH]cc2c1CCC2 1780007070 XIOKDEPNTTXCNP-HYBUGGRVSA-N 451.332 0.625 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2s1 1782298184 VYCLOQXFGSXYRL-QFIPXVFZSA-N 453.329 0.975 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1783614851 GFVVVGSEYCKKQZ-BZIRYSOJSA-N 494.358 0.877 50 20 JCGD COc1ccc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(F)c1 1783658712 VUXNXIVVCZZHBS-ISTCRNMPSA-N 483.500 0.990 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21 1783844160 IOBWCGGNEJPHAR-VFTHGPRRSA-N 472.369 0.949 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(N3CCOCC3)cc1)CCO2 1783935620 WQDDDDDKUMQLOX-XMMPIXPASA-N 473.574 0.340 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1 1783936161 RTYJZKZFFHXKPX-HSZRJFAPSA-N 464.538 0.970 50 20 JCGD O=C(COc1ccc(Cl)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784421514 IPJOGQQFDYITIR-XERREHJYSA-N 490.724 0.831 50 20 JCGD C[C@@H](CC(N)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785075306 FWRIDSFWAHWTAM-QXKUPLGCSA-N 474.986 0.610 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785097290 FTDWZQLTSDWPPO-HSZRJFAPSA-N 451.288 0.082 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)C[C@@H]21)c1ccc(B(O)O)cc1 1786979588 BATABQNJQZMFFV-BKEOGYBKSA-N 478.379 0.848 50 20 JCGD Cc1csc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786980223 XDPFGIBUMUJCHE-YYWHXJBOSA-N 456.373 0.962 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981663 DTUUGKQFDJXIFE-XERREHJYSA-N 483.286 0.196 50 20 JCGD Cc1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)ccn1 1786983406 OXZHWAJNOSNQCR-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4ncccc34)C[C@@H]21 1788610040 YKCHISQPMYETIV-GKCIPKSASA-N 475.509 0.535 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccoc4c3)C[C@@H]21 1788610457 TVOQPJLGWZBELQ-ROOHIHILSA-N 464.482 0.733 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc(-c2cnccn2)c1 1789265203 GAFHDTBYKDHGEC-SSPYTLHUSA-N 486.337 0.731 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(N)=O)[C@H]2C1 1790851878 BVFIGFBWKVCKEW-OWQGQXMQSA-N 462.459 0.379 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792981893 YWELIXGDVSABAF-CKBPBPHLSA-N 459.971 0.823 50 20 JCGD CC(C)(C)n1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cn1 1794349471 HYCOEXKTGMVZES-JLVBRIDZSA-N 455.519 0.154 50 20 JCGD O=C(CN1C(=O)COc2ccc(Cl)cc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796187900 KKUAGGLBHUTIDS-REPLKXPHSA-N 497.744 0.697 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796189843 HXNOIODCCIGSQA-REPLKXPHSA-N 463.299 0.616 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(O)cc1)C2 1796439853 IHCDJBKGMSNSRG-QTLLOYRASA-N 469.498 0.495 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1797729255 UYWVYOINFWCDPI-HATOLVCRSA-N 456.424 0.621 50 20 JCGD Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(C(F)(F)F)o1 1797750513 DFAJEPJBKYHYNZ-GNXNZQSNSA-N 482.419 0.517 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097187 HTCZGQAWDMAYQH-KMQSCTNJSA-N 474.606 0.262 50 20 JCGD CC(C)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)C(=O)OC(C)(C)C 1801008839 DOSSRLWIRAKICN-UPHUGPLXSA-N 483.610 0.595 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(C(F)(F)F)cn1)C2 1801009663 ZVPULYVVCWLJIY-USGNIVHTSA-N 485.507 0.996 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/C(=O)NCc1ccccc1)C2 1802334978 VCOCOGBCCUPXST-PHUPPOLUSA-N 455.559 0.870 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C1)C(=O)NC[C@H]2C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1804462430 KYQQSGGMNFZRMX-WRDSOISUSA-N 499.008 0.598 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1805407204 BDSVJHLCWIIVNK-LJQANCHMSA-N 489.378 0.097 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364259 DNEXZAWTUVDYPW-CVDCTZTESA-N 464.331 0.094 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)no1 1808388765 NLPVDCKYFQUUJI-MBSDFSHPSA-N 491.313 0.406 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCn2ccnn2)[C@H]1c1cccnc1 1808416125 FATHRGXDZWRZAZ-TYTKVZDVSA-N 477.529 0.903 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@@H]1c1cccnc1 1808416659 CMUAUWKNDVRORN-SCOYTIDWSA-N 492.496 0.736 50 20 JCGD COC(=O)CSCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810294269 JBQSUBHLGOCWKK-QRWLVFNGSA-N 486.554 0.306 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1 1810301840 CREWFPVZXHAAAU-LIRRHRJNSA-N 478.469 0.950 50 20 JCGD Cc1nc(N)sc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339827 QSVZARCUWHUFSD-GFCCVEGCSA-N 457.346 0.710 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)n1ccccc1=O 1815344314 SUHPUTWFLGSMRC-CZUORRHYSA-N 466.328 0.472 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N[C@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)c21 1815360620 KKKSLSWFDMGAFI-AWEZNQCLSA-N 491.338 0.955 50 20 JCGD Cc1[nH]nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c1F 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CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1830732457 YNGPINDWYZDJQH-WQTXXOFMSA-N 489.997 0.690 50 20 JCGD O=C(c1cccc(N2CCOCC2)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732939 COGAHVCPPOQYQJ-DENIHFKCSA-N 467.950 0.193 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831872021 ZSWQVIVAMVKOFP-AEFFLSMTSA-N 473.640 0.307 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn(C)c3=O)CCO2)C1 1831881613 ZVAPUFDMTUZWOP-KUHUBIRLSA-N 456.337 0.486 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3O)C2)C1 1832549130 GHZXSGGLMHIYJK-KSFYIVLOSA-N 498.964 0.989 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1 1832590957 QRTUWHYRMIQWRW-UWJYYQICSA-N 472.007 0.816 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833397051 REVALRBFLCJDRM-FXAWDEMLSA-N 473.979 0.963 50 20 JCGD Cc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1F 1833709721 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N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(CN(C(=O)C#CC(=O)O)CCO2)C1 1840044598 NLLMVKSJIFCKFG-KYIYGJGQSA-N 459.405 0.416 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](NC(=O)OC)c3ccccc3)C2)C1 1840149246 JRLJHUCLGNRANY-SVMVAKDDSA-N 483.949 0.794 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1 1840152729 RGZFIGRDUATUJJ-FOIQADDNSA-N 451.911 0.362 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cc(O)ccc4n3)C2)C1 1840184502 QZVNXHXKOYPAEB-XMMPIXPASA-N 485.541 0.383 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc4cnccc34)C2)C1 1840185329 LMSLDIFPZONTLJ-HSZRJFAPSA-N 470.530 0.073 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840895267 NHTDJLCEZBCMBZ-PXAZEXFGSA-N 494.433 0.334 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)CC2=O)c1 1841008232 KRCLJPHZQGQDOB-GOSISDBHSA-N 477.326 0.245 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014956 UKGMHCOZTGJHKN-MZNJEOGPSA-N 469.347 0.583 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039949 XKYOMKRBDBOLKN-FQEVSTJZSA-N 472.590 0.841 50 20 JCGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](CC(=O)OC)NC(=O)OC(C)(C)C)C1 1846213627 QJKPLBKARQNQAH-UONOGXRCSA-N 461.943 0.900 50 20 JCGD CCOC(=O)N(CC(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2)Cc1ccco1 1846531279 VQNCPYYNGCPKRG-UHFFFAOYSA-N 463.535 0.815 50 20 JCGD CC(C)(C)OC(=O)N1Cc2nccnc2C[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1846555046 XWEMYPHMAXIVKW-DLBZAZTESA-N 479.965 0.942 50 20 JCGD CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C1 727765346 WEZOZZYKJKGXDA-LJQANCHMSA-N 487.538 0.896 50 20 JCGD N#Cc1ccc(CS(=O)(=O)CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 728329224 LFAOQMBCAOJXEF-GOSISDBHSA-N 473.463 0.004 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c(Br)cc1F 728503459 PWCLSNXXCPGXTN-ZETCQYMHSA-N 473.298 0.119 50 20 JCGD CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)Cc1cccnc1 728891746 FIAKQJOUVWOAGE-FQEVSTJZSA-N 462.528 0.936 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1Br 728985727 PTXJYCLSLMHMJX-UHFFFAOYSA-N 483.348 0.564 50 20 JCGD CC/C=C(\C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CCOC)n(Cc2ccccc2)c1=O 747150200 YXNJZUOBGKEANJ-LZYBPNLTSA-N 468.514 0.558 50 20 JCGD CCN1CCN(CC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)C(=O)C1=O 747778342 FTWFZYFGRGKJTP-NRFANRHFSA-N 463.538 0.452 50 20 JCGD CCOc1ccccc1C(=O)NCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 757661897 QHUXYOISPJXQDI-GOSISDBHSA-N 457.439 0.346 50 20 JCGD O=C(COC(=O)c1ccc(=O)n(Cc2ccccc2)n1)NNC(=O)c1cccc([N+](=O)[O-])c1 847194817 HVDPGGYJHNEMQP-UHFFFAOYSA-N 451.395 0.818 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1 849366665 UPHULOHMQFVMCH-UHFFFAOYSA-N 491.570 0.655 50 20 JCGD O=C(NNC(=O)c1cnc2c(c1)c(O)nc(=O)n2C1CC1)c1cccc(S(=O)(=O)N2CCCC2)c1 879296560 UQEMOBSJWDTPNL-UHFFFAOYSA-N 498.521 0.691 50 20 JCGD 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Cn1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)CCO3)C2)n1 1839743452 RRDVIQUZPGSYRZ-AGBQBWRISA-N 472.452 0.770 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCCC3=O)C2)C1 1839966701 NPMVRDODDPZBSY-BEFAXECRSA-N 460.369 0.629 50 20 JCGD CCOc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1OC 1840086398 PFSAENCJFGFTAU-JTSKRJEESA-N 470.950 0.693 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)C2)C1 1840150133 GCUFVEIQFWLSAE-VFNWGFHPSA-N 477.986 1.000 50 20 JCGD CCc1[nH]nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1Cl 1840184124 UDXMCYMCHFAWIU-HXUWFJFHSA-N 470.958 0.069 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncoc4c3)C2)C1 1840184513 RQIXYCXMSTXTKV-JOCHJYFZSA-N 459.503 0.271 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840184711 BZYZURWPRIAFQA-HSZRJFAPSA-N 464.538 0.506 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185838 UBTHZBZUTNAMQP-GNBRFLJNSA-N 462.547 0.821 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCSC)CCO2)C1 1840200355 DZLWRUWUCWDDQT-GRDNDAEWSA-N 453.399 0.730 50 20 JCGD COc1ccc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840655325 PVKPYLUQESWMMU-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)[C@H](O)C1 1841351042 FMXWMKZWORXXMR-MDOVXXIYSA-N 459.971 0.798 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)[C@H]2C1 1841353665 JJDHNVIDVKVCRF-QKPAOTATSA-N 457.955 0.671 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCCC12CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1844379373 TXLRTWAGYDZYRB-LSDHHAIUSA-N 468.652 0.221 50 20 JCGD CO[C@@H](C)C(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1846402719 ASDLKUSOMJXJJA-LPHOPBHVSA-N 489.378 0.041 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1847783882 CGVKTFQSPFMENP-ZLIFDBKOSA-N 482.515 0.663 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(OC)c(S(=O)(=O)N(C)C)c2)cc1OC 10790581 WSUDAKIXUQSKMA-UHFFFAOYSA-N 495.510 0.581 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCn2cnc3sccc3c2=O)cc1OC 12873782 UMCGOZPQJBJUGA-UHFFFAOYSA-N 460.468 0.870 50 20 JCGD O=C(NNC(=O)c1cccnc1N1CCOCC1)c1cccc(S(=O)(=O)N2CCCC2)c1 14236410 ONWJFSVAIAOKEQ-UHFFFAOYSA-N 459.528 0.778 50 20 JCGD O=C(CSc1ccc(S(=O)(=O)N2CCOCC2)cn1)NNC(=O)c1ccc(F)cc1 22885893 YJTNQSWJJHABKN-UHFFFAOYSA-N 454.505 0.795 50 20 JCGD Cc1ccc(-c2cc(C(=O)NNC(=O)NCCC(=O)N3CCN(c4ncccn4)CC3)n[nH]2)cc1 726710730 PPUUXLUGCUSMJE-UHFFFAOYSA-N 477.529 0.858 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)N2CCOCC2)c1 728262744 JEVDOFAIMGKHAS-UHFFFAOYSA-N 454.958 0.606 50 20 JCGD O=C(NCCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1ccc2c(c1)OCCO2 729233879 YRPPJMWQGRKFQD-UHFFFAOYSA-N 455.519 0.794 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1)N[C@H]1CCS(=O)(=O)C1 743884754 JYZUKLGEVWGYNJ-ZDUSSCGKSA-N 472.570 0.358 50 20 JCGD COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)c2ccc(C#N)cc2)CC1 747103503 NHMMQLBSQPXGBW-UHFFFAOYSA-N 489.510 0.916 50 20 JCGD CC[C@H](C)[C@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)N1CC[C@@H](B(O)O)C1 864233707 JUTOZRKLKAKMTN-AHIWAGSCSA-N 473.788 0.810 50 20 JCGD COc1ccnc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cc(OC)c2OC)n1 914761993 GZQGNYVQPVXMGB-UHFFFAOYSA-N 453.477 0.280 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NC[C@H](C(C)C)N1CCN(C)CC1 916258214 NTDNFFFZHUBRCH-MRXNPFEDSA-N 453.613 0.504 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3ccc(Cl)cc3O)n[nH]c2n1 918361175 ANDJARRKTQQLFN-UHFFFAOYSA-N 465.927 0.717 50 20 JCGD Cn1c(=O)n(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc21 928973155 MKGYAOYPJNDXPP-SFHVURJKSA-N 454.439 0.261 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cn1ncc2ccccc2c1=O 1248578883 UWHNOOOJWLHIDL-UHFFFAOYSA-N 499.549 0.198 50 20 JCGD C[C@H](Nc1nccs1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1778074032 QYUWFYRJCSIFJK-GCKMJXCFSA-N 466.608 0.830 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(F)c1 1778283583 BHQDSRLZCWZYOW-DEOSSOPVSA-N 470.306 0.590 50 20 JCGD COC(=O)c1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)s1 1780530049 SOSWTPHBSGOLDB-WZONZLPQSA-N 494.614 0.964 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1csnn1)CCO2)NC(=O)NCc1ccccc1 1780970513 ZMXNBFQNVNXIFF-NRFANRHFSA-N 473.559 0.328 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c(O)cccc34)C2)C1 1782505840 WPTISCJIHIVCSR-DEOSSOPVSA-N 476.493 0.696 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCNC(=O)c2ccccc2)C1 1783102197 WOSJHNNOCLRIBL-CJFMBICVSA-N 487.601 0.693 50 20 JCGD COc1ccc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(F)c1 1783658961 FEUWGYOOXLMSDU-YFTVHVBSSA-N 468.290 0.671 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2 1783682658 SOUNNVBEIOQTDH-OAQYLSRUSA-N 476.643 0.364 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783881867 NNTYRMSEFUELKI-XMSQKQJNSA-N 481.981 0.416 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCn3nc(C)cc3C)C2)C1 1784318564 KEGIETQKQYXNRU-DMUURETOSA-N 469.546 0.854 50 20 JCGD CN(C)C(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1786739069 VDCRMNVKAQCSAF-AJNGGQMLSA-N 460.959 0.186 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c([N+](=O)[O-])c1 1786981632 AHQXYLXNZBBXGF-XJABCFGWSA-N 497.313 0.119 50 20 JCGD Cn1ncc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)cccc21 1786983664 ZYSQODSGNOLJPG-BUKVSMQUSA-N 462.315 0.160 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C[C@@H]21 1791291238 QLJDXHSHAJPDAS-ZWOKBUDYSA-N 469.546 0.438 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccoc1I)C2)[C@@H](O)CCl 1792977690 ZVETUERDLXIPOJ-QCMRWSPLSA-N 468.675 0.687 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)nc1Br 1792980221 GKUVKFZPPAMNDL-QPPBUOOMSA-N 462.728 0.656 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccoc2C1 1793121913 ZBDUUBDZLROXGA-IHSNIMORSA-N 453.499 0.286 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)C2)c1ccc(B(O)O)cc1 1795734245 KYFIJXGKIGSHLP-ZSQJQDDOSA-N 464.352 0.458 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc(C)c1C(=O)O 1795736329 ZJZJLGFPNAPLIA-RMFSNUHRSA-N 466.299 0.198 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccoc1I 1795937425 UHEYRMGQTZIVCK-RBLKWDMZSA-N 468.675 0.687 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)C1 1796190194 ZNRFERFKYHFEGR-ACDBMABISA-N 469.347 0.795 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796192369 DQYXQGXBXMCWTN-RDGPPVDQSA-N 491.419 0.875 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)cnc1O)C2 1796439842 GTCJHRWPQJYZLL-IZJYNLIKSA-N 474.905 0.778 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CNc3ccccc31)C2 1796440292 KHHAYJVADWHSTK-SGHZCDGCSA-N 464.526 0.919 50 20 JCGD CN1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)CC1 1797237606 OZRGRJYJWKBRJU-TVLHWSJOSA-N 473.524 0.709 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1797279255 HMZRLEWGRUSLKX-SGQRUEDASA-N 463.934 0.525 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncsc1Br)C2 1797751008 ZHUHXOVNBMDWDP-DDFAGTSDSA-N 495.359 0.421 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccncc2)[nH]n1 1798149732 LPERXLSWMGKEFT-VPTLXERWSA-N 455.519 0.048 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)c1ccccn1)C2)NC(=O)NCc1ccccc1 1799094734 HOWDHGCCKGBYNX-YDLSIGKMSA-N 495.584 0.017 50 20 JCGD Cc1cc(Br)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799498551 KVGQWNLGZYIEGX-CWPLJXCYSA-N 487.159 0.954 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1800404460 KOVXLKJGKQCWNL-USGNIVHTSA-N 487.944 0.793 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c2cc(O)ccc2n1 1801011735 ZLFQSYYKWDJLHB-RSQQPWMTSA-N 469.542 0.825 50 20 JCGD O=C(COc1ccc(O)cc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1802886155 BYJMPRSIMKECBH-CYFREDJKSA-N 475.310 0.866 50 20 JCGD Cn1ccc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1807512851 PGIVXIZGJYQDFQ-IERDGZPVSA-N 462.514 0.376 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)Cn2ccnn2)[C@@H]1c1cccnc1 1807676810 LVOJOSREAFZGEX-PWCMAEROSA-N 463.502 0.513 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1809227626 ZKVMQWZECRWKEA-AUSIDOKSSA-N 461.331 0.664 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@@H]1c1cccnc1 1810299440 QJLSFTTUEWVEFR-MGPUTAFESA-N 494.487 0.809 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1CCC(O)CC1 1813193629 HTDXTHAPMQFYGI-ZIVFUPILSA-N 451.332 0.632 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1813334437 GHBBIZXXZAIHIP-JCHJZTRSSA-N 462.938 0.158 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)CC2)c1ccc(B(O)O)cc1 1815337277 QHUUMVGQHAEPRC-SNVBAGLBSA-N 489.212 0.404 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361845 SLQQAOGPCNZPQU-IXDOHACOSA-N 483.355 0.804 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cn3cccnc3n2)[nH]n1)c1ccc(B(O)O)cc1 1817471895 VEGGTCUKOVDILT-SFHVURJKSA-N 459.275 0.752 50 20 JCGD CN(C)c1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cn1 1820832947 RZZWUYDGWRKMDZ-INIZCTEOSA-N 465.344 0.824 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1823125497 XCOHRHVZJRIHNH-OAHLLOKOSA-N 453.333 0.631 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)C1 1830725047 CZASIROSAUXDSX-VGSWGCGISA-N 487.981 0.610 50 20 JCGD C=CCCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(O)n1 1830725832 SEZQSROPPXUHFH-DYESRHJHSA-N 453.923 0.576 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1831464037 NYBKAPMCFNHHQE-XYPHTWIQSA-N 459.392 0.360 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCCCC2=O)CC1 1831765797 HOCPZSUXYBBWFH-FQEVSTJZSA-N 470.574 0.931 50 20 JCGD CC[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1833262677 SNIZVFSJLHHOHU-QFIPXVFZSA-N 488.633 0.675 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn(-c4cccnc4)c3)CCO2)C1 1833621507 MHERMWVGLDPTCM-GHTZIAJQSA-N 463.922 0.591 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C3CCC(CO)CC3)CC2)CC1 1833721704 YKIRDJJAKJPKEH-UHFFFAOYSA-N 486.617 0.669 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1834801179 SHGJPCTZTCNYGN-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD Cn1cc(F)cc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835247847 ZNFLPHUXJGFTIY-UHFFFAOYSA-N 456.327 0.343 50 20 JCGD O=C(CC1Cc2ccccc2C1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933838 HCYUUVWETOVDJL-AREMUKBSSA-N 478.354 0.242 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1 1836118777 RBUGGTDRULCPPR-QHCPKHFHSA-N 489.479 0.276 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nccc3[nH]ccc13)CCO2 1836447714 CGJDHHPGGYTPCN-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1836525907 CYUBQHFAPRGJHN-FXAWDEMLSA-N 452.870 0.770 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)C3=NNC(=O)C3)CCO2)C1 1837366280 RQNXVSKCCUQZBF-CMBCZCRSSA-N 473.436 0.204 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCCCn3cccc3)C2)C1 1837459063 IIFNHRJFOWWFSB-DEOSSOPVSA-N 484.557 0.427 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1 1837717971 UDMIPZRZCRJPHB-HRAATJIYSA-N 450.612 0.823 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920788 FJZMPIUVSGWSAK-GOTSBHOMSA-N 498.385 0.734 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)cc1)CCO2 1838977215 VVLOTILCELQKDG-JOCHJYFZSA-N 492.259 0.769 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(C)CCCN1)CCO2 1839122097 PZYSNTGTLKLHNB-PKTZIBPZSA-N 490.513 0.732 50 20 JCGD N#Cc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839420925 NCUIGIXYVNGFML-HSZRJFAPSA-N 482.472 0.080 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ccsc3[nH]1)CCO2 1839521808 HSEAXDSYRJNBAD-NRFANRHFSA-N 463.560 0.672 50 20 JCGD CN[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2)C(=O)O 1839743474 SUGNIFHBXPVODO-KTIAIDQTSA-N 492.479 0.391 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1839801065 SDWSQJVZTXDVGA-NQIIRXRSSA-N 488.990 0.079 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1839965486 ZQENIWLQALUZNS-DNVCBOLYSA-N 466.336 0.973 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1840153144 FWENKEJMBUYMMY-ZLGUVYLKSA-N 467.906 0.431 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2 1840542444 XCSOLRGUBPRVNX-WQMGSUCASA-N 456.348 0.407 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(Cl)c1)CCO2 1840709895 NLVCCMIVIVUBJS-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD C[C@@H](C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1)N1CCN(C)CC1 1841925176 UOEMFWZOBZDODY-IRXDYDNUSA-N 472.030 0.958 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2CCN(Cc3ccccn3)CC2)C1 1842095017 QTTDSTFTAQJDIQ-UHFFFAOYSA-N 456.591 0.870 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2ccc(O)cn2)C1)NC(=O)NCc1ccccc1 1842573783 ZFANPDSBVJNINB-UHFFFAOYSA-N 452.515 0.950 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)CN3C(=O)CN(C)C3=O)cc2)cc1 725906158 PYECZZLWGCZCBH-UHFFFAOYSA-N 487.538 0.471 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=S)NCC1CCC1)c(=O)n2Cc1ccccc1 727270846 NJMZZMIBDHRLEH-UHFFFAOYSA-N 499.597 0.350 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(COCC(F)(F)C(F)F)c1)N[C@@H]1CCS(=O)(=O)C1 727797327 PDFRBOSZWSNNPY-LLVKDONJSA-N 477.458 0.783 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@@H]1CCCOC1)N(S(C)(=O)=O)CC2 727849312 XLJYKHJDNHEDKR-GDBMZVCRSA-N 455.533 0.527 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N[C@H]2CS(=O)(=O)C[C@@H]2N2CCOCC2)N(C)c2ccccc21 728698319 OBFGXURHEONSIE-PXNSSMCTSA-N 487.582 0.271 50 20 JCGD CC(C)N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c1 729274768 CKSAWCLQZURXJN-JTQLQIEISA-N 454.958 0.068 50 20 JCGD O=C(CSCC(=O)N1CCOCC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 904220548 BNFNIGXVWMBSAF-UHFFFAOYSA-N 495.561 0.798 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccccc2)cc1 914781704 LTFIVHCRUFYZDZ-UHFFFAOYSA-N 468.557 0.084 50 20 JCGD CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-] 916237654 OGQCRLRSWVPTEU-UHFFFAOYSA-N 451.461 0.755 50 20 JCGD O=C(NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCC2)c1)N[C@@H]1CCS(=O)(=O)C1 919885257 LFVIHLZQWUERIG-GFCCVEGCSA-N 464.953 0.256 50 20 JCGD CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1778077069 FAZCKQOYLGMVAB-ZOCZFRKYSA-N 475.970 0.442 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4c(c3)CCCO4)CCO2)C1 1779032091 LKOMLHCUJBFWLQ-VWLOTQADSA-N 479.537 0.696 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnc3nc2O)C1 1781256823 XCANGVGWWBQLGN-HOYKHHGWSA-N 484.557 0.836 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCO2 1781383328 KZMZUXVINSAZDT-GHTZIAJQSA-N 480.986 0.156 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1 1782163198 APLLUGAGOLEDNS-XMMPIXPASA-N 490.524 0.332 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1783230740 ZIZDKHXHUIKARR-WZONZLPQSA-N 460.336 0.083 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)CCO2 1783533544 ZNSTWKXZYJOMLP-VPCSNGCSSA-N 490.395 0.970 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(F)c1[N+](=O)[O-])CCO2 1783934707 KTVBASMFKJCPAJ-HXUWFJFHSA-N 451.455 0.550 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784091776 BRCPZAMITIKEGB-JONQDZQNSA-N 459.971 0.823 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(Cl)c3)[C@H]2C1 1785692622 OCTCHYXMAICXHD-UVBJJODRSA-N 474.905 0.346 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H]3c3ccc(F)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786983765 ZMVXOSLWNNADKX-YPWFZXRJSA-N 466.318 0.903 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786986867 NZCZUWYIKSQSCO-XJABCFGWSA-N 470.306 0.350 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3nc(C)no3)C[C@@H]21 1787509147 WBCYJSPMCMAEPJ-OTTMNBPASA-N 457.491 0.034 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)c4nncn4c3)[C@H]2C1 1788559952 KWXYVRRGTPWKEE-QRTARXTBSA-N 477.953 0.349 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCc4sccc4C3)C[C@@H]21 1788611525 JIBYNAYXKCOMRJ-VDGAXYAQSA-N 498.609 0.398 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1791019222 HQZAAAFQBZQMGY-WOYTXXSLSA-N 471.982 0.823 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21 1791142853 RDRXJPDTKKVFEC-FHWLQOOXSA-N 479.014 0.927 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1792618911 KOGHDSFNTVFMHC-WOZUAGRISA-N 472.590 0.886 50 20 JCGD O=C(CCc1ccc(C(F)(F)F)cn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1794098679 UTBIHJJPLSKXFE-VPTLXERWSA-N 491.275 0.616 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)C(C)(C)O 1796371255 SIININJFCYVJGT-ITGHMWBKSA-N 451.923 0.775 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)CO3)C2 1796442158 UDIQLEPJFYYTDU-CNWLLUGOSA-N 494.508 0.355 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1797754004 OGFPNYMGZCCSFX-DPIQGUFMSA-N 475.889 0.267 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1797891057 FJMMEUBVDRGNAC-REPLKXPHSA-N 471.363 0.875 50 20 JCGD N#Cc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1Cl 1798590428 VPJOYKLKHRUFEV-CWPLJXCYSA-N 453.691 0.408 50 20 JCGD CCO/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799098287 GLEHHZKYVHUIFP-BNTBUHNESA-N 459.547 0.472 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc2nscc12 1800034323 YEIYXPOAXTYRGL-YVWYUNDQSA-N 451.313 0.493 50 20 JCGD O=C(COCCOCCOCc1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1800848346 YKDSEGJQIIHUKI-XAPVIXHLSA-N 484.977 0.426 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1802019239 XBWAGIZHHWLFPU-XLWJZTARSA-N 461.943 0.681 50 20 JCGD CC1CCN(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1803389169 VQCVHAHXGMFATR-URXFXBBRSA-N 464.375 0.813 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cc2ncccn2)[C@@H]1c1cccnc1 1804692663 ODJDPUAJYLSTSF-KKSFZXQISA-N 460.498 0.432 50 20 JCGD CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1804917600 SLMCOTCZWINHGL-AVRDEDQJSA-N 475.314 0.584 50 20 JCGD N=C(N)SCCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807122643 STDDQJQZNSYVHN-LPHOPBHVSA-N 455.349 0.098 50 20 JCGD Cn1cccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1=O 1807363758 QIIJVELQEJZRNF-RXVVDRJESA-N 460.299 0.094 50 20 JCGD N=C(N)SCCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366435 ZEESQVGKBULGQB-QFBILLFUSA-N 455.349 0.098 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccn2c(O)nnc12 1808188313 DCVQBARFUCYKRY-YLJYHZDGSA-N 486.297 0.143 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)C(=O)c2ccco2)[C@@H]1c1cccnc1 1810295437 STQZFQABPUXUNY-DNVCBOLYSA-N 462.466 0.876 50 20 JCGD Cc1cnn([C@H](C)C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1 1813380323 STJMOZGXMAKHHP-PIPMEXSNSA-N 461.331 0.847 50 20 JCGD Cn1cccc1C(=O)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813476033 MUBCOPSWMCPXGK-RXVVDRJESA-N 460.299 0.302 50 20 JCGD CCN1CCC(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1814242043 JSZDVYZYGUMYSF-GGAORHGYSA-N 464.375 0.813 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1 1814649196 VMSZXZCTAABLMG-AWEZNQCLSA-N 452.581 0.150 50 20 JCGD CCC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1815104600 SOOLXYRWHHUCHR-MLGOLLRUSA-N 456.507 0.629 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(=O)NCC(C)C)CC2 1817280482 XXRGAMAOHJKQCX-PKCARXMOSA-N 473.559 0.961 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817473984 JQAFFTCJMDTNPM-GUYCJALGSA-N 462.337 0.076 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)N1C[C@@H]2C[C@H]2C1 1819569811 MBBXKKAYPGWAQN-VWNJHIHFSA-N 454.361 0.389 50 20 JCGD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)n1cnnn1 1828925926 VWJQVFMCQJPYIE-KBXCAEBGSA-N 455.523 0.166 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1829119395 WNNFRBXGXDXEBK-OALUTQOASA-N 453.584 0.130 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(F)(F)C1)CCO2 1829654779 UWPRUBFZMOMOAK-VLIAUNLRSA-N 467.473 0.191 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1830358641 QBQUVQKWQIRNIZ-FQEVSTJZSA-N 473.979 0.820 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)CCO2 1830429275 UAXVQLMLWNRRCE-SKPFHBQLSA-N 476.549 0.759 50 20 JCGD COc1ccc2nc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2c1 1830727893 JQVXQROMTCGMOJ-UGKGYDQZSA-N 463.918 0.913 50 20 JCGD CN(C)[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(Cl)cc1 1830735266 FQOCVSPPOBHBGP-BBTUJRGHSA-N 474.385 0.999 50 20 JCGD Cc1nn2cc(CC(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)nc2s1 1832109991 WSAYOCKFVUGCEE-WMLDXEAASA-N 490.355 0.789 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cnccn3)C2)C1 1832549872 ULWZAUTUQIYHHA-JTSKRJEESA-N 497.980 0.608 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(O)c3)C2)C1 1832551134 DBRPXMUCSLSRIS-HTAPYJJXSA-N 498.964 0.989 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccn4cncc34)CC2)CC1)c1ccc(B(O)O)cc1 1834798580 MZZBYGMVALDDKV-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)CC2)CC1)c1ccc(B(O)O)cc1 1834798848 FDTBJJRHQMZFHT-HBMCJLEFSA-N 455.389 0.427 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCCn3ccnc3)CC2)CC1)c1ccc(B(O)O)cc1 1834798911 HMOMWMYBUKCDAG-UHFFFAOYSA-N 467.379 0.229 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)COC3CCCCC3)CC2)CC1)c1cccc(B(O)O)c1 1834800644 USQAEKDLPAWNHB-UHFFFAOYSA-N 471.407 0.901 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cn2[nH]cnc(=O)c12 1834823774 JYTKIUHXAXYLFC-LJQANCHMSA-N 482.335 0.186 50 20 JCGD CC[C@H](NC)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835118375 VKABQZRZLDROFT-FQNOVECQSA-N 459.595 0.690 50 20 JCGD C[C@H]1CCc2c(C(=O)NC3CCN(C4CCN(C(=O)c5cnccc5C(=O)NN)CC4)CC3)n[nH]c21 1835360541 NRBZINLPXJLUAH-HNNXBMFYSA-N 494.600 0.957 50 20 JCGD Cn1c(=O)n(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c2ccccc21 1835454453 FBJFVQYQVGKKOH-HXUWFJFHSA-N 477.993 0.511 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835930500 JWGYKKKVIHFYAA-VWLOTQADSA-N 490.325 0.002 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3csc(C(F)(F)F)n3)C2)C1 1835930959 AXYDKIXMRPTTMN-IBGZPJMESA-N 499.276 0.226 50 20 JCGD CC(C)[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)CC1 1835932093 NLXODINXWNSWTA-UMEGOILYSA-N 472.391 0.899 50 20 JCGD Cc1cc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C)c1 1835934413 RISKTKMCWDZGOB-VWLOTQADSA-N 466.343 0.675 50 20 JCGD O=C(c1cc2sccn2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935791 RIKABWQOCKTPLB-JOCHJYFZSA-N 469.328 0.064 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(=O)C(O)O)CC2)CC1 1836107479 QJEVUGLJGFFBJY-UHFFFAOYSA-N 464.475 0.016 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1 1836392270 JGYSWYZLBZRXDC-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837459963 PRXNXCZOPSQUPE-HSZRJFAPSA-N 453.499 0.377 50 20 JCGD N#CCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837460097 UNSJQBKGRZUXEF-DEOSSOPVSA-N 478.509 0.135 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccco3)C2)C1)NC(=O)NCc1ccccc1 1839054178 KKWSAHJMSJYLIR-DEOSSOPVSA-N 485.541 0.696 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)C1 1839109244 YRXZHHIFHRWRMJ-ODCFSMADSA-N 479.933 0.205 50 20 JCGD O=C(CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)N1CCCC1 1839199537 XUOBSHHFYWGCNE-SJLPKXTDSA-N 464.332 0.536 50 20 JCGD O=C(Cn1ccnn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839801943 IPQHHYDACBFGBT-NQIIRXRSSA-N 492.374 0.741 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(=C/c3ccco3)NC(C)=O)C2)C1 1840155211 SUKXSFIURYDBPE-AVCTXIMKSA-N 469.922 0.467 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185084 IDJQKYGALIZRDY-WZONZLPQSA-N 461.563 0.090 50 20 JCGD Cc1cc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F 1840708420 GYKDBZVTLGTHFU-JOCHJYFZSA-N 468.501 0.716 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H](O)c2ccco2)C1)NC(=O)NCc1ccccc1 1841071318 FCRWTOJTJFYEJL-FQEVSTJZSA-N 455.515 0.863 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1841248482 LKXNFJXNWVZLJZ-UHFFFAOYSA-N 492.536 0.283 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)C1CC1 1843012907 RJZSUZJGSYRHFP-IBGZPJMESA-N 471.363 0.877 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccc(O)nn1)C2)NC(=O)NCc1ccccc1 1845038500 JPAOGDLLPIHFCV-UHFFFAOYSA-N 453.503 0.345 50 20 JCGD C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)C2=O 10693093 PPXAWWSVXZKQHB-DHZVRSILSA-N 474.470 0.018 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1 21191487 XEKPHOAJABWCHN-YJBOKZPZSA-N 495.941 0.861 50 20 JCGD Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 106038430 RMALJRBEVMLNEH-UHFFFAOYSA-N 469.527 0.862 50 20 JCGD Cc1nc2n(n1)C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCCCC3)c1)CC2 727229520 SSHADUFZJLVIFN-INIZCTEOSA-N 461.548 0.720 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)cc1 728014392 CMHWKYNIUJRRBN-UHFFFAOYSA-N 486.959 0.773 50 20 JCGD C=CCNS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1F 728323843 SMDQXDXACYHFMB-QGZVFWFLSA-N 493.469 0.434 50 20 JCGD CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1Cl 728373812 BPORCJDODXJSLZ-LLVKDONJSA-N 451.954 0.613 50 20 JCGD N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728845309 GEXCKIRIQSSWBE-UHFFFAOYSA-N 457.516 0.346 50 20 JCGD CC[C@@H](C)[C@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)NNC(=O)c1cnn[nH]1 729456576 UAVMCCNTOPLJRJ-BMIGLBTASA-N 485.954 0.314 50 20 JCGD O=C(NC[C@H]1CN2CCC[C@H]2CO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 729620439 YKKZMRVSKAYPQY-IRXDYDNUSA-N 451.549 0.278 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)C(=O)N1CCCC1 748246960 IKUFDKWTXUDKLC-UHFFFAOYSA-N 450.561 0.954 50 20 JCGD COC(=O)c1csc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 749151153 GQOQGJLURBTATN-UHFFFAOYSA-N 473.554 0.943 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)c1 807135482 JFVSNUFHZFWSKH-UHFFFAOYSA-N 484.542 0.640 50 20 JCGD CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 811881167 VNQKUICAJDGRLV-UHFFFAOYSA-N 480.568 0.762 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cnn(C)c1C)N(S(C)(=O)=O)CC2 824202419 KNNPKEZNIBEHKQ-INIZCTEOSA-N 465.532 0.456 50 20 JCGD Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1C 913151497 LUEVKCUZCRTONZ-UHFFFAOYSA-N 494.595 0.827 50 20 JCGD COc1ccnc(NNC(=O)c2cc(O)nc3ccc(S(=O)(=O)N4CCOCC4)cc23)n1 914762538 NDYSCBXAVDFTAD-UHFFFAOYSA-N 460.472 0.517 50 20 JCGD CC(C)c1noc(CCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 915059795 VLRFJPBWJFKJPX-UHFFFAOYSA-N 479.559 0.927 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(C(N)=O)cc1)c(=O)n2Cc1ccccc1 915948136 OESFRTCZWSXMDY-UHFFFAOYSA-N 473.493 0.677 50 20 JCGD COCc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 916426941 ZINSALAHKJPWBH-UHFFFAOYSA-N 462.528 0.998 50 20 JCGD CCC(=O)N[C@@H](CCSC)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 917392055 NUQIGUYHWTVBSK-INIZCTEOSA-N 456.590 0.880 50 20 JCGD COc1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)c1O 919755923 LMOJFDMTPHHBGC-UHFFFAOYSA-N 478.527 0.563 50 20 JCGD O=C(CSCc1nc(O)c2c3c(sc2n1)CCC3)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919884352 ILVZCFGDGOIONU-VIFPVBQESA-N 471.586 0.636 50 20 JCGD CN(C)C(=O)Cn1cc(C(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)nn1 920243048 ABALICOPAZGQKR-UHFFFAOYSA-N 452.471 0.785 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc2ccccn12 1778580949 FFIVYVIJUSUWKN-HYBUGGRVSA-N 462.315 0.455 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1779403174 DMFKRCSHGWEJRA-ATNYBXOESA-N 481.315 0.686 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1779956602 YYRNCNIYCOZGKV-APPDUMDISA-N 455.334 0.983 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1 1780711781 CZAJZOQIQSEWKT-XLQHLMKVSA-N 454.351 0.801 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)CC1 1780774953 QFQVWXXVJQXTNS-HHXXYDBFSA-N 477.375 0.355 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780777072 MGMOSQGVOFCMIH-RNCIANSQSA-N 453.305 0.807 50 20 JCGD CCOc1c(F)c(F)cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1F 1782012248 DMLFIXANNMKNAG-QHCPKHFHSA-N 492.259 0.940 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1783343452 JFXNBVSRGVMTET-VQZRKKFQSA-N 483.363 0.996 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCO3)C[C@@H]21)[C@H](O)CCl 1784092588 NFXQFJLXAVLOCE-WHZJULEDSA-N 465.978 0.467 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784096482 XHTLYANTFIBFNS-HILJTLORSA-N 499.996 0.425 50 20 JCGD Cc1cn(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c(=O)nc1O 1785351272 JIIGUPRMHNUWFN-XIKOKIGWSA-N 457.325 0.118 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1 1785514763 FXLUFSMTDOUZAH-NQCMUKECSA-N 465.906 0.807 50 20 JCGD C[C@@H]1[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CCN1C(=O)OC(C)(C)C 1785744786 XESQAFWLTMSZQH-NXMSCROESA-N 495.621 0.835 50 20 JCGD Cc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786980146 NORFTASIIACZIE-PMVMPFDFSA-N 450.344 0.901 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C[C@@H]21)[C@@H](F)Cl 1787446779 BZKZFKOIAUOSBK-LWWSYDQCSA-N 462.869 0.699 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788609956 FYUCRISQFVISEW-YSSFQJQWSA-N 496.524 0.771 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C[C@@H]21 1788610956 CFKDPYQUKVRPSZ-LFRPXUGBSA-N 490.524 0.377 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4cnccc34)C[C@@H]21 1788611211 OWUNXMRXVAPFDR-GMVOTWDCSA-N 463.498 0.469 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)nc1 1789723512 SHKWYKFWWOLOKT-JBACZVJFSA-N 481.358 0.521 50 20 JCGD NC(=O)c1nccnc1C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1789947541 HSWJJHKKVMOXDT-UHFFFAOYSA-N 459.271 0.317 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792981571 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CN(C)c1ncc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1 1807365635 ZEWGRYYLSMPYNX-XLIONFOSSA-N 463.303 0.449 50 20 JCGD Cn1nc2c(c1C(=O)N1CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]1c1cccnc1)CCC2 1807372524 FZLHHKAFBKXYGZ-XMSQKQJNSA-N 473.342 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1 1807408353 KQXCDFLETCVLQG-JPYJTQIMSA-N 499.535 0.685 50 20 JCGD O=C(CCc1cncnc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807499641 HWYZIXYVAWTAPL-NZQKXSOJSA-N 459.315 0.504 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CN2CCN(C)CC2)[C@@H]1c1cccnc1 1809601591 JGAAQMIGDSGQPI-ZXQDWRTKSA-N 494.600 0.469 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccccc2C(N)=O)[C@@H]1c1cccnc1 1810305020 IOUFUOPNWPIQBP-IIBYNOLFSA-N 487.520 0.812 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc(-n2cccn2)nc1 1810993402 HZPZRSYGRPWEPY-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1812346050 FRSZVYQFLWVYLQ-IAAVTCLWSA-N 459.934 0.901 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812716325 MIEHPSSBQHHLJI-AOIWGVFYSA-N 471.396 0.548 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813069536 ZMBMDEMDZSYFKY-KDOFPFPSSA-N 460.564 0.667 50 20 JCGD N[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccn1 1815012142 UAUFTYRPVUBGJI-KBXCAEBGSA-N 451.317 0.144 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnn(-c3cccnc3)c1)CC2)c1cccc(B(O)O)c1 1815355041 MLMZZLMFAWNLOL-QGZVFWFLSA-N 488.338 0.943 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3c(c1)CNC3=O)CC2 1819798041 RRKRMPLFFWXDKJ-CYBMUJFWSA-N 491.533 0.925 50 20 JCGD Cn1cccc1C(=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1822866486 DRFQSDIHXLPGIS-INIZCTEOSA-N 464.486 0.936 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1 1825454767 TVWKZXSTPVQVDJ-JOCHJYFZSA-N 499.398 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@](C)(O)C(F)(F)F)CC2 1826084060 ZAUXDOMPUBVBPA-ABKXIKBNSA-N 451.471 0.741 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828926915 UGIDIFRCWALUBR-FOIQADDNSA-N 458.563 0.785 50 20 JCGD Cc1ccc(OCCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1830206817 AULKLQUHVMOXOC-XMMPIXPASA-N 476.574 0.593 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)NCCC#N)C2)C1 1830537308 DDFUNJUZJHWEAL-DNVCBOLYSA-N 459.385 0.756 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830733412 LIVKGPCJHKNUFT-JKSBSHDWSA-N 489.997 0.690 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1831202146 NSRVTOAEAKFRMI-MOPGFXCFSA-N 452.379 0.986 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C3=CCCS3)CC2)CC1 1833508626 GBDOTPOKQWAIAY-UHFFFAOYSA-N 458.588 0.891 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(O)n3)CC2)CC1 1834198795 HLVPKVFBYQRDHV-UHFFFAOYSA-N 467.530 0.285 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(C(F)F)no3)CC2)CC1)c1cccc(B(O)O)c1 1834799953 ICQOJLYYBWXVHJ-UHFFFAOYSA-N 476.289 0.791 50 20 JCGD O=C(CCc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1834836893 HLMWXRAMPAFRFC-DEOSSOPVSA-N 452.316 0.069 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3Cc4ccccc4N3)CC2)CC1 1835738331 XCZBFJGAJUKVFF-QHCPKHFHSA-N 491.596 0.907 50 20 JCGD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837797332 GRAURAZHBQBEPA-FZMZJTMJSA-N 450.221 0.078 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838527145 JNOSFFRTLIPFJX-QMHKHESXSA-N 489.481 0.628 50 20 JCGD O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1838627563 GBRHQUGHZKHUGG-YJBOKZPZSA-N 459.814 0.928 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C3CCCC3)CCO2)C1 1839178409 ASGIYIXBYJSUNZ-AWUSRGSFSA-N 457.531 0.502 50 20 JCGD O=C(c1cnn2c1OCCC2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839518082 HKCPWVPGNQDRIE-SUMWQHHRSA-N 461.288 0.426 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840077569 BPSSRQFQGVDASF-AEFFLSMTSA-N 485.347 0.203 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1 1840154651 BOLVZNKNPHSWGD-FOIQADDNSA-N 451.911 0.362 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)S)CCO2 1840162114 MLYCZFDBEDEFTO-XCLFUZPHSA-N 467.500 0.908 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccc4o3)C2)C1 1840184616 XJINNJUKIUTDEZ-QHCPKHFHSA-N 458.515 0.876 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)cc3)CCO2)C1 1840728105 LAPWMBIAWQFTNR-GHTZIAJQSA-N 453.923 0.969 50 20 JCGD O=C(c1cccc(OCC(F)(F)F)n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013377 BLFOFYSXSFHSES-UHFFFAOYSA-N 463.221 0.833 50 20 JCGD O=C([C@@H]1CN(Cc2ccccc2)CCO1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014098 XDBLQDTWOAYWCW-QFIPXVFZSA-N 463.343 0.084 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cccc(OC3CCOCC3)n2)C1 1844605746 LWAJLHVNTRKUJJ-UHFFFAOYSA-N 465.315 0.450 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846154856 DNTBYHPTGKTGJD-BWTSREIZSA-N 469.347 0.296 50 20 JCGD CC(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1846253387 SJMICXOBGYOPGR-DLBZAZTESA-N 489.013 0.989 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)Nc2ccccc2F)cc1 16786105 NRQYYXRYBMDNGL-ZDUSSCGKSA-N 455.489 0.822 50 20 JCGD CS(=O)(=O)N1CCCc2cc(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)ccc21 726152728 QXGVCRLOWOELBH-UHFFFAOYSA-N 486.959 0.774 50 20 JCGD COc1cc(NC(C)=O)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1OC 728313537 IUHHUBUBIKHQEA-IBGZPJMESA-N 473.438 0.806 50 20 JCGD CS(=O)(=O)Nc1cc(F)ccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728329912 XUMWRLZRWUSZIU-INIZCTEOSA-N 467.431 0.341 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 729275261 MXJNOQQGQCPILP-LLVKDONJSA-N 458.493 0.325 50 20 JCGD O=C(NC[C@@H]1CN2CCC[C@@H]2CO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 729620438 YKKZMRVSKAYPQY-IAGOWNOFSA-N 451.549 0.278 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1 749161210 JWFMMUKUAKKHSR-ZDUSSCGKSA-N 485.613 0.964 50 20 JCGD CC(=O)N1C[C@@H](C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)Oc2ccccc21 751393819 VHLGAJWLPBGFOW-HNNXBMFYSA-N 452.876 0.563 50 20 JCGD C[C@@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)C1 807136233 YBWPDPINHICJJW-IAGOWNOFSA-N 469.550 0.139 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)c1 825802098 XNZPRCMRABHZTQ-HNNXBMFYSA-N 465.532 0.960 50 20 JCGD CC(=NNC(=O)[C@H](C)CN1CCOCC1)c1ccc(S(=O)(=O)NCCCN(C)C)cc1 917544179 YPWVYGZPUAYGSZ-QGZVFWFLSA-N 453.609 0.725 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cccc(C(=O)N(C)C)c2)cc1 917721099 PRWSTVURNRQMPO-UHFFFAOYSA-N 468.557 0.327 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CCn1cc(C)cn1)N(S(C)(=O)=O)CC2 918319252 MPDUFTAAWMPSIZ-KRWDZBQOSA-N 479.559 0.695 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1)N[C@H]1CCS(=O)(=O)C1 919886344 RHDPHHOAOUUKRC-JSGCOSHPSA-N 462.450 0.571 50 20 JCGD COc1ccc2c(CC(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c[nH]c2c1 1779029767 YOTSPGMGYBUISF-RUZDIDTESA-N 492.536 0.861 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(Cl)nc3n[nH]cc13)CCO2 1779030700 UYHIWKGLKHKNAR-OAQYLSRUSA-N 484.904 0.367 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1O 1779032440 JZQFRQGYNWCBGC-JOCHJYFZSA-N 455.471 0.157 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc(Cl)n1)C2 1779372706 YOJYGWAWGRJSIJ-IIBYNOLFSA-N 473.921 0.570 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779375657 QXWINHNZKRPOMC-NFHUAXAMSA-N 469.546 0.579 50 20 JCGD Cc1cnoc1C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779935837 AIRSMSCZZCNCBL-HSZRJFAPSA-N 470.530 0.773 50 20 JCGD CCOc1ccccc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1780546352 ZVROAUBGUMYDGY-QHCPKHFHSA-N 453.499 0.841 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2 1783601981 ICHZHRXLJQLGHS-PJFSTRORSA-N 465.906 0.807 50 20 JCGD O=C(c1ncn2nc(N3CCOCC3)ccc12)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783945921 TUYDRDISPCWXJC-HXUWFJFHSA-N 483.356 0.813 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)C1 1784093889 ITWWSROZSMWKFD-WOYTXXSLSA-N 471.982 0.823 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C(=O)C1 1785669896 QZPBUCAAIAEECL-OXJNMPFZSA-N 476.933 0.430 50 20 JCGD COc1cc(OC)c(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1F 1786768958 WCHNMGBEDJSKBH-ZQIUZPCESA-N 498.527 0.948 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4sccn4c3)[C@H]2C1 1787274142 MWBCLLQCZZJIKN-KKXDTOCCSA-N 468.539 0.906 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1787395331 GMSIIEKTEDLLPB-PEDHHIEDSA-N 482.347 0.542 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)nc(O)c3)C[C@@H]21 1787508967 OHTJITJRNKBHNL-YKNBRYRPSA-N 468.514 0.823 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cc([N+](=O)[O-])cc2c1OCC2 1789218718 ONDMCTKRCCNFAA-STECZYCISA-N 453.879 0.723 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(O)[nH]3)C[C@@H]21 1789221821 IJUTVKDYIICDNF-QITLCBANSA-N 473.442 0.856 50 20 JCGD CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C[C@@H]21 1789864534 VUQOHBJWXDZYMF-QMHWVQJVSA-N 474.986 0.752 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1 1790315857 QOTQPTRJTVRBIP-CUWPLCDZSA-N 483.573 0.542 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1[C@H](C)OCCN1C(=O)OC(C)(C)C 1793487697 DDIPEUYYYIJZJS-PVWHLQNVSA-N 489.997 0.854 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793603393 LPHPVBJOUUSIOI-ACDBMABISA-N 472.590 0.886 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc3ccccc13)C2)c1cccc(B(O)O)c1 1795739264 XXXHCTWEYQTULC-MFKICJERSA-N 461.283 0.137 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(=O)nc2sccn12 1796191858 HLODSRUJSYYIAU-MUJYYYPQSA-N 452.301 0.001 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/C(=O)c1cccs1)C2 1797750576 JHKPKZYOHGIAJX-SPFNZZPCSA-N 469.523 0.389 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)nc1)NC(=O)NCc1ccccc1 1798641221 YSQDKAKWMMWOCP-HATOLVCRSA-N 482.541 0.337 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccc(O)cc1 1799298947 CJRBKDUXYPRDPJ-NTNQKNOYSA-N 453.499 0.398 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3cccnn13)C2 1800642056 UCLMRXQRARMHTO-IPJQOSJUSA-N 464.320 0.466 50 20 JCGD COc1nccnc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804970986 KEJHQKAMTBRIAK-XLIONFOSSA-N 461.287 0.193 50 20 JCGD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cnn1C 1805925286 CBCBSVQXXIRIQF-JXFKEZNVSA-N 462.514 0.755 50 20 JCGD Nc1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1 1807275524 PTXSPOLMQYLCRW-YJBOKZPZSA-N 451.317 0.434 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807363160 NWOJCPMZBOWNJU-YLJYHZDGSA-N 463.303 0.137 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370907 NBAZZMLQEHBZFH-HTAPYJJXSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374570 LIKIYZVPTGERMR-WQZLPFSVSA-N 457.299 0.584 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1 1808414363 IBAHBTRGHZTCSU-JBKKHTOXSA-N 465.514 0.500 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1 1808668274 NWURTGXZOWAMFP-QXSJWSMHSA-N 459.316 0.929 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)CC2)C1 1809974037 NSPOAADCRLWDFQ-QHCPKHFHSA-N 474.370 0.977 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1 1809974890 GJNRFKMDILQHTB-UHFFFAOYSA-N 485.371 0.324 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1 1810293530 FSYYKKBURZDEOQ-DYESRHJHSA-N 483.598 0.449 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1 1813072799 GQJBLTDLKAJTNF-HTAPYJJXSA-N 464.530 0.817 50 20 JCGD Nc1c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)sc2nccnc12 1815253151 UQMWDRONKCSIIC-GFCCVEGCSA-N 494.367 0.949 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1 1815347805 QDESHUKVJZFFGF-SFHVURJKSA-N 492.366 0.787 50 20 JCGD CC(=O)O[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(C)C 1815356780 QZRMKEAATSTABM-YJBOKZPZSA-N 459.333 0.636 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3cncnc3)sc2C1 1815534908 RJYBCCGDKALUNK-CYBMUJFWSA-N 466.527 0.790 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)CS(=O)(=O)N3CCCC3)sc2C1 1817277173 ZWWYNPXYLZIIGW-VXGBXAGGSA-N 464.997 0.735 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCCS1(=O)=O)CC2 1817282877 NIUZGBBONJSXCD-QGEKPWAMSA-N 492.583 0.766 50 20 JCGD C[C@@](O)(C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)C(F)(F)F 1827049964 ARMNWJICGSFLTM-FXAWDEMLSA-N 456.270 0.913 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)N1C[C@H]2C[C@@H]2C1 1827052403 YAEZMOSPHDAZAJ-TUUKDFBESA-N 453.392 0.940 50 20 JCGD COCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828549035 UKDKQSGLDGYQME-UTKZUKDTSA-N 453.923 0.685 50 20 JCGD O=C(O)C#CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551537 QOJVRXWKVWRMGL-VGSWGCGISA-N 477.901 0.126 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923388 HZECCWBAYKGOAG-HXUWFJFHSA-N 458.563 0.787 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924281 OILMIMZWXOWPLS-UZLBHIALSA-N 468.562 0.846 50 20 JCGD O=C(Cn1cncn1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829010391 RRYSSDRATGFCRV-XMSQKQJNSA-N 490.948 0.330 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc3cccnn3n2)CC1 1829565577 LINYLANXZDQRNV-JOCHJYFZSA-N 461.331 0.956 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)N1CCN(C)CC1 1830237852 IKSIKUDLJPVZDZ-XXBNENTESA-N 470.423 0.236 50 20 JCGD O=C(c1cc(Cl)c2nncn2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830730559 BFRXGYFDKTZRQW-KSSFIOAISA-N 458.302 0.052 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1831329310 LLXUIVDJTZHASP-XYPHTWIQSA-N 474.407 0.007 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832723885 HQHFVDYBVJBFNH-QRWLVFNGSA-N 483.363 0.299 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)n1 1832768916 FIONLFNZBLVRMY-IFXJQAMLSA-N 456.337 0.873 50 20 JCGD CN1CCC(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)CC1 1833105583 JXHXTTHHSRCAFD-UHFFFAOYSA-N 450.628 0.273 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CN3CCN(C)CC3)CC2)CC1 1833263106 KMTHUJQIMROMHS-KRWDZBQOSA-N 472.472 0.836 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1 1833448315 BREHLKICOBBYBC-LSDHHAIUSA-N 495.484 0.917 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1834674650 PLOWEODHQVSWDD-KXBFYZLASA-N 450.411 0.387 50 20 JCGD O=C(CNc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834680690 KXDDPVGKKQZTCQ-UHFFFAOYSA-N 482.365 0.803 50 20 JCGD O=C(c1nc[nH]n1)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1836354151 ZHHZVGZYNWZVQK-UZLBHIALSA-N 478.347 0.881 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837220029 YYQIAJJOLSVPGZ-GOSISDBHSA-N 468.363 0.511 50 20 JCGD Cc1cccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837455951 GWBUFPUQESYQFO-QQHIZMLBSA-N 480.525 0.172 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1837496969 SHACSHFITYLBLW-OXQOHEQNSA-N 462.927 0.203 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837635922 LFTLXBIRNNWWPC-WMWRJIBUSA-N 479.606 0.760 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(C)ccn1C)CCO2 1838820847 XNFVNBXHTBDSPD-VAHWYXDJSA-N 470.530 0.538 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)ccc1O 1838974947 VNEDBAHTZZFYGC-RGXRWQALSA-N 499.524 0.605 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](NC(C)=O)c1ccc(F)cc1)CCO2 1839038562 OUCBUELOCGDNJW-CNNODRBYSA-N 485.940 0.713 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COCCOCCOCCOC)C2)C1 1839149105 TWJQVMSKLJSCID-WIYYLYMNSA-N 480.986 0.156 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1839154912 BRBYNHKLLMFITC-HZPDHXFCSA-N 452.364 0.590 50 20 JCGD Cn1ncnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802177 NPTJAJUIAFIWLO-UWJYYQICSA-N 492.374 0.891 50 20 JCGD C=CCC(F)(F)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839887757 PBYRLOCLJKWKFF-PXMCARDJSA-N 467.473 0.788 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@H]1C[C@@H]3CC[C@H]1C3)CCO2 1839916683 RMSCRCCODWMRAH-ISJRUSPKSA-N 450.580 0.642 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)C1 1840032618 DSOJHXXHMCNARS-TYILLQQXSA-N 494.383 0.112 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(F)CN(C(=O)OC(C)(C)C)C3)C2)C1 1840156707 STANUVSUAIZPRF-YWZLYKJASA-N 493.960 0.656 50 20 JCGD Cc1noc(C)c1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840182489 JUOAFYGABPGRKI-QFIPXVFZSA-N 465.551 0.053 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1F 1840182561 GDWLTFVBQODINS-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3OCCc4ccccc43)C2)C1 1840182956 XLOQJGXPQRCJIK-PXDATVDWSA-N 488.585 0.520 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)c(N(C)C)c(F)c3)C2)C1 1840185066 HDJCTQCPAZZHNP-QHCPKHFHSA-N 497.543 0.474 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN1C(=O)CSC1=S)CCO2 1840896617 IVRKJAXWXKTSPM-GOSISDBHSA-N 475.665 0.155 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CC1 1843012944 USOXNUNHISPILL-UHFFFAOYSA-N 471.363 0.831 50 20 JCGD Cn1ncc(I)c1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1843602830 YUEYBFFWUYXRRI-SNVBAGLBSA-N 452.680 0.441 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(N3CCOCC3)cn1)C2 1844263792 WEJFUCSYDIZSFR-UHFFFAOYSA-N 465.514 0.048 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2=C3c4ccccc4C(=O)N3CC2)C1 1844651298 ZRCLWSBKVVXARY-UHFFFAOYSA-N 451.527 0.834 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2)C(C)C 1845248099 WYNXFZOQYGIOQZ-JYJNAYRXSA-N 472.970 0.161 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(CC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)=NO2)C1 1847562346 BZYHBGPFOACNER-VCAMNPENSA-N 470.954 0.944 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccccc1S(=O)(=O)N(C)C 10259264 QZJGMMZKESAKJY-UHFFFAOYSA-N 482.588 0.683 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)c1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1 15884752 NCMOFEZTAXEOEF-UHFFFAOYSA-N 479.511 0.565 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)c3ccccc3O)CC2)cc1 17576535 DEFHTNJKFMRETK-UHFFFAOYSA-N 474.539 0.775 50 20 JCGD C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C1 725871163 GVTOEFNLVNAUOS-OAHLLOKOSA-N 477.543 0.961 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccn(C)n2)c1 727349994 ODXNZWALTKMFPM-UHFFFAOYSA-N 465.513 0.853 50 20 JCGD COc1ccc(C(=O)NNc2nc(-c3cccnc3)no2)cc1S(=O)(=O)N1CCOCC1 728075416 ARRVWJFQSPBIEZ-UHFFFAOYSA-N 460.472 0.918 50 20 JCGD CN(C)N(C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1)[C@@H]1CCS(=O)(=O)C1 728176307 SGYILEYIVILGHB-CQSZACIVSA-N 465.981 0.467 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 728455560 KTXGASJUSIUNPK-UHFFFAOYSA-N 460.512 0.484 50 20 JCGD Cc1c(NC(=O)CSCC(=O)NNC(=O)N2CCOCC2)c(=O)n(-c2ccccc2)n1C 745992656 GZHUERFDCVOYGM-UHFFFAOYSA-N 462.532 0.229 50 20 JCGD O=C(COC(=O)CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1 834572351 UZKVXVQFVLDIAH-QXFGJRORSA-N 489.506 0.497 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)cc1C 914457569 BZXTZJDYIINLNB-UHFFFAOYSA-N 460.512 0.264 50 20 JCGD O=C(COC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1)NNC(=O)[C@H]1COc2ccccc2O1 914821026 XIOUASABCAEJAD-KZULUSFZSA-N 475.404 0.848 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCn1ccnc1)N(S(C)(=O)=O)CC2 915905469 QYGBFUUEPUPSHJ-MRXNPFEDSA-N 480.547 0.180 50 20 JCGD Cn1c(=O)c2ccc(C(=O)NNC(=O)c3ccc(F)cc3Br)nc2n(C)c1=O 918341518 MZNBVZXRBZMFOM-UHFFFAOYSA-N 450.224 0.609 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCCCC2)c1)N[C@H]1CCS(=O)(=O)C1 919884957 JCOJWDOGFYLFDV-HNNXBMFYSA-N 458.562 0.382 50 20 JCGD COc1ccc(CNC(C)=O)cc1S(=O)(=O)NNC(=O)c1csc(N2CCOCC2)n1 1317953072 MMWYUVRALZIFNE-UHFFFAOYSA-N 469.545 0.248 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1778314407 UVBVTSZWCKSLCQ-XMMPIXPASA-N 487.362 0.067 50 20 JCGD COc1ccc(COCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779034126 NHJROMFOPJIKRX-XMMPIXPASA-N 483.525 0.354 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2cnccc2[nH]1 1779126903 YJSURUDOVWGURQ-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C3=C4c5ccccc5C(=O)N4CC3)C2)C1 1780008200 IYHXNPDVZKTPIY-RUZDIDTESA-N 481.553 0.460 50 20 JCGD O=C(c1nc2c(=O)[nH]c3ccccc3n2n1)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781329982 PEADDRQYDWQLIB-BFUOFWGJSA-N 493.293 0.705 50 20 JCGD N#Cc1ccc(F)c(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1781963752 MNRHJLYFUZFWKG-QFIPXVFZSA-N 452.446 0.453 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1782921730 JRLDVNADPROIRK-BXKMTCNYSA-N 454.307 0.828 50 20 JCGD Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc(C)c1O 1784994925 SMEJJSUVCQTYSQ-HSZRJFAPSA-N 453.499 0.765 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccnc3)[C@H]2C1 1785172895 YLIPIISOBQHTAH-TUUVXOQKSA-N 453.337 0.575 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1786802542 RHXOHHGERBWPKW-UHFFFAOYSA-N 463.259 0.919 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4cccc(F)c4)CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980103 JPSRUZPLEVXPBU-HSQYWUDLSA-N 466.318 0.831 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCC4)C[C@@H]21)c1cccc(B(O)O)c1 1786983568 XUZTWQUQTRSDCB-YYWHXJBOSA-N 450.300 0.208 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3Cc4ccccc4CN3)[C@H]2C1 1787452257 KVZZGOSYIJKTCB-JXUDCGJUSA-N 492.580 0.815 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc4ccccc34)[C@H]2C1 1787886035 PMJDDMLXBAVDQB-QSFXBCCZSA-N 454.531 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CN(C(=O)OC(C)(C)C)C3)[C@H]2C1 1788117932 FMFWJVGUVKDUPS-SZMVWBNQSA-N 481.594 0.206 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCc3ccncc3)C[C@@H]21 1788611486 FAXRHVAUHHTBEV-YYWHXJBOSA-N 466.542 0.696 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(C)c3Cl)[C@H]2C1 1789081732 SPFPPONOKCIAKO-LIKXFGNHSA-N 475.937 0.801 50 20 JCGD CCOC(=O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)ccn1 1789339466 KUSRNCFNRZPTTO-LNLFQRSKSA-N 475.546 0.225 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3nccn3)[C@H]2C1 1789967652 VQAYGQXRHSKTER-VGWMRTNUSA-N 470.958 0.390 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1790607179 VUVREIRUCSRSRA-ZJEDPXCGSA-N 477.518 0.662 50 20 JCGD COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1F 1792108407 RNXKVLZMVBXWOR-ZVZYQTTQSA-N 450.511 0.801 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1793067806 IOZDQGCCWSDGCS-SRYPRDQNSA-N 487.601 0.548 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795112840 QSTOMQKMAMTMEJ-HLPPOEQASA-N 477.400 0.603 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c(F)c(OC)c1F 1795739933 SKFDRTLJIMKWFA-VTEUUUEMSA-N 490.268 0.179 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1OC(F)F)C2)c1cccc(B(O)O)c1 1795740615 DLQMWAZRNVRWDP-CCWDJLKJSA-N 460.242 0.485 50 20 JCGD COc1nccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1F 1796440461 MWHVNBHYBZHHDH-GHJDPZQESA-N 472.477 0.567 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)nc1 1796442096 QOMOADRKMJUNHK-DHMDNZFNSA-N 454.487 0.427 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2cc(F)ccc2[nH]1 1797341316 TUZONIXRLVUEGV-VPTLXERWSA-N 451.263 0.504 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(C(F)(F)F)c1)C2 1797749757 OIYDYYASIBUOEP-FVCICTRLSA-N 478.431 0.616 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)C(F)(F)F)C2)NC(=O)NCc1ccccc1 1799869472 QGDVENRZQOJXCC-BJWYYQGGSA-N 498.506 0.649 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CC(=O)NC1=O)C2 1800332173 DGOGORUWZQCYBB-SDGGPSBXSA-N 473.436 0.013 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccn(C)c2=O)[C@@H]1c1cccnc1 1803834491 CXFQPCQDJKBDKD-UWJYYQICSA-N 454.531 0.473 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnc(N(C)C)o2)[C@@H]1c1cccnc1 1805344834 BXVGZFZTJZLUFA-JXFKEZNVSA-N 457.535 0.828 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1807027509 YHPAJJIAANSKCH-CRAIPNDOSA-N 458.528 0.664 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1 1807363635 MZPSJYPJIQBMMK-UWJYYQICSA-N 465.344 0.484 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C(=O)NCC(C)C)[C@@H]1c1cccnc1 1808441719 JKEBWRJYJMLZAL-KDNBOHCBSA-N 481.557 0.994 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1 1810134398 PCZUNQMYEFLBFK-HJZDHAKKSA-N 456.547 0.295 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCNC3=O)[C@@H]1c1cccnc1 1813071443 SDCZZJAZRAPIEG-HTAPYJJXSA-N 496.572 0.104 50 20 JCGD NC[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccccc1 1815160522 YAZUMEVMBDQUIB-ROUUACIJSA-N 464.356 0.791 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1 1817475004 JMDBSWDOGRDULB-IBGZPJMESA-N 461.287 0.808 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3ncnn3c2)[nH]n1)c1cccc(B(O)O)c1 1817476041 BJMUUTDJFKDQLD-GOSISDBHSA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nncn3c1)CC2 1819796765 FBVARBYHUPAWPU-LBPRGKRZSA-N 477.510 0.724 50 20 JCGD CC[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1 1822092324 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CN1Cc2ccccc2C[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830725579 KCSXTGUWIOIOKN-KNKQGSTJSA-N 451.951 0.099 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)s1 1830733402 LFXXSLXJFJBKFZ-AUUYWEPGSA-N 460.936 0.133 50 20 JCGD CC[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)N(CC)CC 1831668356 RVLJVBYVIHPUSE-KERCYCQASA-N 490.605 0.697 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)[C@@H]1SC(=N)NC1=O 1831870737 DEXIDIJTHHUVQS-QOKNQOGYSA-N 480.635 0.782 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2 1832219801 QAXZTYNFWHSXKF-REWPJTCUSA-N 456.279 0.147 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc[nH]n3)C2)C1 1832551340 KEQMFQOPMCUXAG-HRAATJIYSA-N 485.969 0.541 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cnc(Cl)nc1 1833014078 KIKDYPYJLJGBDH-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1833573396 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NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1 1837026401 VYZNFZAERJNTJO-XMMPIXPASA-N 491.508 0.012 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cn3ccsc3n1)CCO2 1837048450 QGCZHRIXEIUMCS-IBUSPFOHSA-N 499.553 0.600 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(Cl)n3)C2)C1 1837456928 PXXFIWOSBLGRNW-JOCHJYFZSA-N 488.932 0.046 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(F)(F)F)nn3C)CCO2)C1 1838080986 XDRUWMKRPIRUAF-SJCJKPOMSA-N 468.860 0.763 50 20 JCGD Cc1nccn1CC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838394706 PGXHMZAHSGJGPM-UHFFFAOYSA-N 469.546 0.502 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(OC)c1 1838879605 WNXIZBGDLMCWCI-HSZRJFAPSA-N 478.546 0.147 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccc(F)cc1 1839037252 DQBZUYHJWYVVKE-LVCYWYKZSA-N 471.913 0.059 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1 1839199856 XBROGSNPYATYMZ-UWVAXJGDSA-N 470.339 0.848 50 20 JCGD O=C(NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)c1ccccc1 1839203267 GXRZLUAYOVCUPV-FXAWDEMLSA-N 486.338 0.953 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(O)cc3Cl)CCO2)C1 1840110293 DTQGXJCBIPFJMM-KURNWNDPSA-N 494.976 0.888 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1 1840155481 DCVMYTSFYWAUML-XLIONFOSSA-N 460.955 0.630 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(F)c3F)C2)C1 1840186991 HMISXTMNUVZHCQ-OAQYLSRUSA-N 472.464 0.547 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cnc2c1 1840188696 XJTONQLQVJPNJH-HXUWFJFHSA-N 469.325 0.877 50 20 JCGD CSc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1840302757 JHIXNVHWJSIFGB-XMMPIXPASA-N 484.383 0.401 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)CCO2 1840945691 BAFPZNHHMJXNOE-FOIQADDNSA-N 493.960 0.656 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846190934 LGJOSLXMJIYKOO-MYYSRTQBSA-N 484.557 0.902 50 20 JCGD Cn1c(CC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)nc2ccccc21 9753195 ZFOQOTROGUODNO-UHFFFAOYSA-N 486.554 0.667 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc2ccccc2n1 725870103 ZXLRUXIPQQTPSR-IBGZPJMESA-N 490.563 0.778 50 20 JCGD COc1cc(NC(C)=O)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1OC 728313540 IUHHUBUBIKHQEA-LJQANCHMSA-N 473.438 0.806 50 20 JCGD O=C(COC(=O)CSCc1cc(=O)n2ccsc2n1)NNC(=O)[C@@H]1COc2ccccc2O1 728318484 JQPUOKXVCRSKKT-HNNXBMFYSA-N 490.519 0.520 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 728379189 IJUXHMQLFWLOHQ-FUHWJXTLSA-N 499.636 0.822 50 20 JCGD Cc1cc(C)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)c1NS(C)(=O)=O 728854200 OZFCYTUMXBEKLE-UHFFFAOYSA-N 496.615 0.999 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c2ccccc2c1=O 730516370 GSMIFTXJUBICBB-INIZCTEOSA-N 463.450 0.519 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)[C@@H]2c3ccccc3C(=O)N2C2CC2)c1 744322466 YLTJRLZAZPILIN-IBGZPJMESA-N 470.507 0.327 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2S(=O)(=O)c2cccs2)c1 749160636 MMHSABRAEIURCD-HNNXBMFYSA-N 486.597 0.613 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)c1ccc2c(c1)OCO2 749837403 DMPWETKCWXCXBV-UHFFFAOYSA-N 462.303 0.979 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2)CC1 751211565 SSSJAWVKUSDOOH-UHFFFAOYSA-N 450.542 0.726 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2cc(C)ccc2C)cc1OC 768339492 YXGXHJPXRXBCKW-UHFFFAOYSA-N 451.501 0.825 50 20 JCGD CC(C)(C)c1noc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 915128565 GOGAMPXVZZXGBQ-UHFFFAOYSA-N 465.532 0.782 50 20 JCGD O=C(O)CNC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Br)s2)cc1 916105664 HAJMXQCPMGNBPW-UHFFFAOYSA-N 462.303 0.948 50 20 JCGD Cc1cc(C)c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(O)n1 916216242 APDVLNAISRUOHC-UHFFFAOYSA-N 463.516 0.569 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)COc2ccc(C#N)cc2)CC1 918138355 OZTXXRAXRXZSHV-UHFFFAOYSA-N 460.491 0.347 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)NCC1CC1 920859659 YQOIJRXXFIEYKF-ONOODXEBSA-N 458.562 0.120 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnccn1)C2 1778091858 VCENXDGQTSMRJM-VJDWAPLVSA-N 467.530 0.667 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CCCCn3cccc3)CCO2)C1 1779032300 MVDGRTHFSJPYTH-QHCPKHFHSA-N 454.531 0.801 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)CNC3=O)C2 1779372704 YIGQITPEXFBCIU-CJFMBICVSA-N 492.536 0.370 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4snnc4c3)C2)C1 1780069870 DNOADIKVPGOIKE-HLQTZPMBSA-N 482.526 0.664 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nc1 1780962512 JJJKSMINOUNNJV-DEOSSOPVSA-N 467.331 0.371 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCO1)CCO2)NC(=O)NCc1ccccc1 1780968930 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c4c(nn3C)CCC4)C[C@@H]21 1787507555 CRQMMUQHDPBEJT-MDUUWBQSSA-N 481.557 0.636 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788542869 VDPKVJOYZZMQKO-QQOZLPODSA-N 451.332 0.460 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-n4ccnc4)ccn3)C[C@@H]21 1788609983 JHULCNNEKZRPLR-ZRCAFCQKSA-N 490.524 0.173 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccn3C)C[C@@H]21)NC(=O)NCc1ccccc1 1789724665 JNTURZYWRUZECI-UFYCRDLUSA-N 483.573 0.360 50 20 JCGD Cc1cc(C)n2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)c2n1 1790530628 SCSHCNGEIWFXBC-NYVOZVTQSA-N 476.342 0.538 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791294012 YDBHXDGYOZGCQC-WFDGFOOXSA-N 475.546 0.109 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(Cl)c1 1793864868 WQAGGHWMHUVWDC-FAQVEIGNSA-N 472.734 0.474 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1CS(C)(=O)=O 1794405038 PKVLFIYQXHAWEZ-CCWDJLKJSA-N 469.636 0.681 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccs3)on1)C2)c1ccc(B(O)O)cc1 1795734318 MDRFILYXRHEVGE-YVWYUNDQSA-N 467.312 0.600 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)ccc1Br)C2)c1cccc(B(O)O)c1 1795737713 LPPIAHSZWQUMEH-HBCWATKFSA-N 491.122 0.785 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1795895416 SOUQVCSWLRUDLA-PFFSRIRZSA-N 490.395 0.731 50 20 JCGD CSc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797751670 NIISFJAKFRRSHF-FVCICTRLSA-N 456.528 0.319 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(-c2ccccc2)no1 1798137096 GDIOOHRIYVNVTJ-OPMZPASUSA-N 461.283 0.538 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1799370528 VFFRLKXJBOOXKF-PFFSRIRZSA-N 472.970 0.329 50 20 JCGD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c(O)c1OC 1800572011 YQNHXJCXTSNWMN-BTTYYORXSA-N 469.498 0.974 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C2 1800983120 PIQRSGXTMSBZIJ-YIDVYQOGSA-N 477.986 0.494 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCNC(=O)OC(C)(C)C)C2 1801014375 NTENGGLEWHVKQV-CWPLJXCYSA-N 469.583 0.254 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc3c(=O)[nH]c4ccccc4n3n2)[C@@H]1c1cccnc1)[C@@H](O)CCl 1803142729 HHHUZKYCOUVQHL-JCGIZDLHSA-N 495.927 0.885 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cnnn2C)[C@H]1c1cccnc1 1804747774 QXUZTIUERHJHSY-RUVVGEKZSA-N 463.502 0.664 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CSC(=N)N)[C@@H]1c1cccnc1 1807002435 SEXGGLRNHJGWFR-AXFCDHHRSA-N 470.559 0.848 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1808291318 HCGMWNMJURWIOT-AEVLCDIHSA-N 456.330 0.922 50 20 JCGD Cc1ccn(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810294495 LNBQAUYUEBTODU-DYESRHJHSA-N 462.514 0.605 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCOC2)[C@H]1c1cccnc1 1810308102 JBIUHQHFJZPLBX-QKLQHJQFSA-N 452.515 0.826 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCNC3=O)[C@H]1c1cccnc1 1813029755 WOJWJHSFHJKDKN-MPGHIAIKSA-N 460.922 0.595 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)N2CCCC2)[nH]n1)c1cccc(B(O)O)c1 1817474110 MIUUXBMCWOJODP-IBGZPJMESA-N 467.335 0.798 50 20 JCGD COCCOCCOCCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817479473 NJGGYIKMEYCFMB-HXUWFJFHSA-N 488.350 0.465 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1 1823008079 QMDBCFHJSYETQU-PNLAZUSQSA-N 453.290 0.810 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3CC(c4ccccc4)=NN3)sc2C1)c1cccc(B(O)O)c1 1824435252 ZFKHQPWUYKFSGQ-PXNSSMCTSA-N 489.366 0.815 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3cccnc13)CC2 1826086458 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CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3nc(O)n4c3CCCC4)CC2)CC1 1835853428 MTCZYLHMOCNPFS-UHFFFAOYSA-N 489.621 0.483 50 20 JCGD O=C(c1cc(F)c(F)c(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835941794 PUQRNEDRIUIFTM-QFIPXVFZSA-N 494.687 0.682 50 20 JCGD CC(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)on1 1836179795 DJHFTAHNUMHKSD-UHFFFAOYSA-N 468.363 0.977 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459527 HULUZIUKGNQJOX-NSYGIPOTSA-N 499.543 0.773 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838076545 LULBAIRENCODFL-MLGOLLRUSA-N 454.833 0.109 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ncccc1F)CCO2 1838247669 MXHGKVPDAHBNCD-WGLQLPMYSA-N 472.477 0.425 50 20 JCGD N#Cc1c[nH]c(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1838394533 GWILWHALTZBZCA-UHFFFAOYSA-N 465.514 0.811 50 20 JCGD C#CC(=O)N1CCC(OC2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1838615823 DAWNMPSKUWHAOC-UHFFFAOYSA-N 455.559 0.964 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)nn1 1838830056 GITCKSAJYNSQBE-GOSISDBHSA-N 457.325 0.730 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2 1838864184 QMVRVKVVPQPEEW-NRFANRHFSA-N 454.474 0.408 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccno3)C2)C1)NC(=O)NCc1ccccc1 1839054307 SNGVWIQLGOVCDC-QHCPKHFHSA-N 486.529 0.091 50 20 JCGD O=C(c1cnc(Cl)nc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839197090 IQRROFWWOMCUSJ-ABAIWWIYSA-N 451.680 0.891 50 20 JCGD O=C(c1[nH]nc2ccncc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199707 SJNOEVSOJBYWKM-PBHICJAKSA-N 456.272 0.718 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CS(=O)(=O)CC)C2)C1 1839962390 CSAKNDZFGCJYEL-CJNGLKHVSA-N 455.371 0.051 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCOCCOCCOC)CCO2)C1 1840077784 LLRJQEWYMPSGEV-PXNSSMCTSA-N 450.960 0.530 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1840154012 HZXVAZNSXNMQGX-XMSQKQJNSA-N 484.933 0.160 50 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JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)COc1cccc([N+](=O)[O-])c1 914711106 PEOQCFYELVJEPV-UHFFFAOYSA-N 492.510 0.775 50 20 JCGD C[C@H](NC(=O)C1CCCC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916096283 BFNXAOHQLMNUSB-AWEZNQCLSA-N 452.533 0.163 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=S)NCCN(C)C)N(S(C)(=O)=O)CC2 916125397 MLIRRHDXRXKMMR-OAHLLOKOSA-N 473.621 0.010 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)C(C)(C)C#N)c(=O)n2Cc1ccccc1 918017417 UPPSJHJJHQTUFU-UHFFFAOYSA-N 465.514 0.761 50 20 JCGD O=C(NNC(=O)c1n[nH]c(O)n1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 918289844 KMKRXYAARPPVLR-UHFFFAOYSA-N 485.526 0.092 50 20 JCGD CCOc1ccc(Br)cc1S(=O)(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919960909 LALZOXWCKKETKR-SNVBAGLBSA-N 456.340 0.527 50 20 JCGD Cn1c(CC(=O)NNC(=O)CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)nc2ccccc21 920340118 JQIROSZNOZICHZ-UHFFFAOYSA-N 460.472 0.540 50 20 JCGD Cc1nc(C)c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)o1 1779372428 IISOOFDBJXAOIJ-VGOFRKELSA-N 456.503 0.731 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)C2)C1 1781116009 YQNVZUMTDTYMFZ-JXSLOMFPSA-N 475.970 0.298 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1snnc1C1CC1)C2 1782212060 QVRBXTBARBRFTI-QVKFZJNVSA-N 464.592 0.916 50 20 JCGD O=C1C[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](Br)Cc4ccccc4)CCO3)C2)CN1 1783168226 PTHOQILKHPUNKO-FIKGOQFSSA-N 464.360 0.959 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1784414747 YATWSKSOKUYXGM-ZHRRBRCNSA-N 455.345 0.386 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCNC4=O)[C@H]2C1 1786258201 GTARTQHZDIDZLA-QCQGSNGOSA-N 468.352 0.251 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)no1 1786406572 YKFFUVRZRMFKSX-YDHLFZDLSA-N 457.325 0.478 50 20 JCGD COC(=O)CSCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787506574 IKKQGZZBVSIKKR-GLYSVQQSSA-N 479.559 0.006 50 20 JCGD O=C(/C=C/C(=O)c1cccs1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1787512398 IRPVIKMLMFEAPS-TXFPBYCFSA-N 468.340 0.460 50 20 JCGD CCc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611752 YVAPEFDBWMYXRO-DCPHZVHLSA-N 452.515 0.550 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc4cnccc34)[C@H]2C1 1789171362 SEEWFDFVQCJVGB-WVFSVQOHSA-N 475.509 0.535 50 20 JCGD Cc1nc[nH]c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726607 DDVXDYKICJEUFD-UFYCRDLUSA-N 483.573 0.658 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cnc2ccc(F)cn12 1790471320 GXTZDISRVCRWCE-QSFXBCCZSA-N 466.278 0.060 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]31)C2 1790686414 SBLFEQOYNYFSHK-YDRHNJASSA-N 482.965 0.202 50 20 JCGD CCOC(=O)N(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)Cc1ccco1 1791499599 URUPMNODBNFBNO-DKIMLUQUSA-N 471.938 0.818 50 20 JCGD C[C@H]1[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CCN1C(=O)OC(C)(C)C 1792983559 OSVKKXYROBGGLO-WBAHDQRJSA-N 459.971 0.821 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796367290 DZTVYWSXXHTBNE-STGWMILLSA-N 479.933 0.957 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc3cc(C)nn3c1C)C2 1796441964 KKFYEMVOYVLLBF-GSBKIRKESA-N 493.528 0.078 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748573 JRTSCGRFOCVYRN-AFIMGQEJSA-N 490.561 0.049 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1798207375 DTDPIMOGQIFGED-IVWMJMPLSA-N 488.932 0.649 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cc(C)cn1)C2 1798522369 RJSUDIFWBDGWNV-VPTLXERWSA-N 471.470 0.928 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2snnc2c1 1799194997 BPTSLOFLYYGUSU-CLLJXQQHSA-N 452.500 0.650 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2nccc12 1799973628 HPOQUHATOHNJJU-IHBLFXCCSA-N 463.498 0.672 50 20 JCGD Nc1n[nH]c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Br)Cc2ccccc2)n1 1800434852 FWCHHIAKNXMGOV-RCJHGTSTSA-N 491.390 0.915 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(-n2cncn2)c1 1800725794 QJXUSMRLXCLOPI-VBUUOAMHSA-N 460.498 0.831 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3sccc3c1=O)C2 1800974594 YHFURFLNJBBUIK-HRJSJKBJSA-N 453.948 0.906 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)CN)[C@@H]1c1cccnc1 1804239820 RRCCYDCKQCSCBY-LUKYLMHMSA-N 468.986 0.506 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1805307404 FYUCWPQTRMOMSC-UZLBHIALSA-N 457.535 0.516 50 20 JCGD Cc1nn2cc(CC(=O)N3CCCC4(CCN(C(=O)c5ccc(B(O)O)cc5)CC4)C3)nc2s1 1806448171 AUXJFVLSOYKZFU-UHFFFAOYSA-N 481.387 0.867 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807363154 NWOJCPMZBOWNJU-XLIONFOSSA-N 463.303 0.137 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807951292 YQHYSRJXPLIWOU-ZWNOBZJWSA-N 451.274 0.331 50 20 JCGD O=C1Cc2cc(C(=O)NC[C@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)ccc2N1 1809683016 BGCNFKGMKIYUGO-NTKDMRAZSA-N 484.321 0.889 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)[C@H]1c1cccnc1 1813338074 ONLIXDDRAGFWEH-IJXRJRJASA-N 476.965 0.812 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)Cc1ccccc1)CC2)c1ccc(B(O)O)cc1 1815348571 PSCFKSAEXZEQIG-MJGOQNOKSA-N 465.340 0.652 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819400210 DVUQVBKRMKISLH-DOTOQJQBSA-N 456.507 0.629 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)[nH]n1 1819403962 POSJMUSHOUTXJS-CVEARBPZSA-N 475.531 0.291 50 20 JCGD Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1821311380 LFTWRALXNTUOMY-LLVKDONJSA-N 467.511 0.380 50 20 JCGD Cc1nnc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)o1 1828926135 AEKKFZZMKAOMRY-GOSISDBHSA-N 455.519 0.853 50 20 JCGD NC(=O)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1 1829476745 VVALIDQFUZPXHS-UZLBHIALSA-N 469.901 0.641 50 20 JCGD Cc1cccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1832239252 NRLHDUPNAPMHFC-RUZDIDTESA-N 466.343 0.378 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cc3noc(C)n3)CC2)CC1 1833809677 MHGMHZZWNNVSTR-JFLMPSFJSA-N 484.561 0.626 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3)CC2)CC1 1834134334 RSWNPZFYGLNGTB-UHFFFAOYSA-N 451.531 0.579 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1834554035 ZZXTXANGNACEKO-JOCHJYFZSA-N 473.722 0.107 50 20 JCGD COCc1c[nH]c(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835738214 ZWKWZVUKRKYQPS-UHFFFAOYSA-N 483.573 0.659 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(F)n3)CC2)CC1 1835905198 VIXUXEAFTVAEKX-UHFFFAOYSA-N 469.521 0.718 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccccc4)on3)C2)C1 1835926193 IAXCGDBVHUXPKT-VWLOTQADSA-N 491.309 0.405 50 20 JCGD O=C(CCc1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933920 IUKJIBSIMNDSSR-XMMPIXPASA-N 470.306 0.208 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836681140 SVHOEPQBVRWSNP-IAGOWNOFSA-N 477.986 0.470 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC=CO1)CCO2 1837410747 QHJCYIPTKBLIPN-OOMZYFKXSA-N 459.503 0.270 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1837715669 CVTBOXVIMOESFS-HSZRJFAPSA-N 476.650 0.691 50 20 JCGD CC[S@@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921243 PGYGLOKKMRGBRC-JGCGQSQUSA-N 464.393 0.137 50 20 JCGD CSc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838285928 HDKQMSGTIWXEKP-QFIPXVFZSA-N 486.554 0.186 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1839146214 WQRFPODDWXAYMR-VLIAUNLRSA-N 453.927 0.104 50 20 JCGD C[C@H](NC=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1839166160 HKAVQEJMSOMSEI-CDXJDZJCSA-N 482.375 0.584 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2 1839961549 AXBPJGBDRVGVAD-VKRNSVOSSA-N 458.353 0.475 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1840032575 CMNFWSOURFUETI-RBZFPXEDSA-N 481.347 0.909 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840033077 SGRSHKBINJNOOS-KSSFIOAISA-N 459.341 0.383 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)OCCO4)C2)C1 1840152723 RBLZRPHPLGEYLI-IIBYNOLFSA-N 454.907 0.782 50 20 JCGD Cc1ccccc1OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184291 YPXHAMSTWCUHHV-HSZRJFAPSA-N 462.547 0.203 50 20 JCGD CCc1ncsc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185627 QWKZBFDFPWRGMF-FQEVSTJZSA-N 453.565 0.149 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1 1841028851 GZHLNFVBCHOVEL-QEEYODRMSA-N 459.971 0.798 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)/C=C\C(=O)NC2CC2)C1)NC(=O)NCc1ccccc1 1844177934 DNYRBBKTJGXVMI-KHPPLWFESA-N 468.558 0.371 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)C2 1846383926 JEJJCQFJMUWBNW-LJQANCHMSA-N 455.559 0.612 50 20 JCGD O=C(CCn1cnc2ccccc2c1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 12606327 FMKRYCZEJPNEIP-UHFFFAOYSA-N 485.522 0.269 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)c1 16594075 XINOAGBTOUELTJ-UHFFFAOYSA-N 458.496 0.661 50 20 JCGD CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)c2ccccc2c1=O 60266160 FCFIMYDYIMVFHO-UHFFFAOYSA-N 470.511 0.791 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1O 107684647 RJBPTPNCRFHDMK-UHFFFAOYSA-N 456.502 0.404 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CNC(=O)c1cccs1 725740132 BHQQQSXTEUCPGI-CQSZACIVSA-N 470.598 0.726 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CNC(=O)c1ccco1 725740785 YMNUEWFSGNTFAS-AWEZNQCLSA-N 484.918 0.044 50 20 JCGD CN1CCN([C@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)c2cccs2)CC1 726087246 VABLPYLDMPDAJP-CQSZACIVSA-N 450.590 0.859 50 20 JCGD Cc1nc([N+](=O)[O-])cn1CCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 728215575 GVTNGRHFNDKIKH-UHFFFAOYSA-N 451.509 0.569 50 20 JCGD Cc1ccccc1[C@@H](CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)NC(N)=O 728323638 OZOKERSOKGBGJY-QAPCUYQASA-N 456.455 0.625 50 20 JCGD O=C(COC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)NNC(=O)[C@H]1COc2ccccc2O1 728341601 XAIHMQGODDPGRU-CZUORRHYSA-N 495.535 0.432 50 20 JCGD CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1 728381979 SKCZDJCXHXESGC-JTQLQIEISA-N 496.405 0.722 50 20 JCGD CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)N3CCOCC3)c2)CC1 745992255 XRUZMLJQHOPQQN-UHFFFAOYSA-N 459.956 0.353 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)CCOc2ccccc2)c1 747180556 DWHOQQOASDGWCS-UHFFFAOYSA-N 450.517 0.495 50 20 JCGD O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2nc(O)[nH]c2c1)C(=O)N1CCCC1 748246521 BTVRBXXHDYXXDL-UHFFFAOYSA-N 472.483 0.453 50 20 JCGD Cc1cc(C(=O)NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)c(C)n1-c1ccccc1 749353897 RHKLFMIAHWYWIC-UHFFFAOYSA-N 462.576 0.615 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(F)c2)CC1 751207203 SGUVMAJSDCIGCX-UHFFFAOYSA-N 470.454 0.536 50 20 JCGD COC(=O)c1sccc1S(=O)(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 798148970 AYENNTOYYVBXKB-UHFFFAOYSA-N 453.907 0.459 50 20 JCGD O=C(Cc1ccc(-n2cccn2)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915635356 JWPMLMFATOJFRA-UHFFFAOYSA-N 469.523 0.897 50 20 JCGD O=C(O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 918062540 YDAVQPSTJMXISI-UHFFFAOYSA-N 487.487 0.168 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)Sc2nnnn2C2CC2)c1 918398802 GGCZMKDLNQIPRU-LBPRGKRZSA-N 467.577 0.980 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1ccc2c(c1)OCO2 918552490 VLYDQCHEFCDMQM-UHFFFAOYSA-N 475.523 0.759 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Cl)N[C@@H]1CCS(=O)(=O)C1 919883863 GEFMNSUPIIIERT-LLVKDONJSA-N 464.953 0.256 50 20 JCGD COC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 920308809 FAQKWFHTERTGSL-UHFFFAOYSA-N 459.477 0.486 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)[C@H]1COc2ccccc2O1 921175867 QBJPQSVFTPKJIL-GOSISDBHSA-N 475.479 0.272 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 921305049 BGDITPJWONOMFT-OAHLLOKOSA-N 484.575 0.701 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC[C@@H]1CCOC1)N(S(C)(=O)=O)CC2 1319045934 CIFKHJXXMSTWET-BBRMVZONSA-N 470.548 0.320 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1 1778022080 COMBPPPZKDDYKW-VYGYDYRJSA-N 451.923 0.920 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3nc(N)n[nH]3)C2)C1 1778847310 YDIKZBCHNBXBHS-RNODOKPDSA-N 485.973 0.282 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc4sccn4c3)CCO2)C1 1779029927 BOMUYIKFRGWZRF-NRFANRHFSA-N 454.512 0.757 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)n1ccnn1)CCO2 1780098274 HHGUEVHNXBZOPT-SPLOXXLWSA-N 472.458 0.816 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2)[C@@H](F)Br 1780773713 RXFNYOXCPIFDAI-SUYBPPKGSA-N 493.355 0.656 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780775016 UEVKXGPJMWFNBH-OUFKLWKOSA-N 486.342 0.799 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccncc1)CCO2)NC(=O)NCc1ccccc1 1780969816 KBLSCQLSHIUCTM-DEOSSOPVSA-N 466.542 0.871 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783881859 NNTYRMSEFUELKI-AVRDEDQJSA-N 481.981 0.416 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccccc3)CCO2)C1 1783933306 ULAATXVWAAYAFF-PVOYRIJTSA-N 471.558 0.062 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(CCN3CCCC3)nc1)CCO2 1783934147 ADCSWASZGVQJPE-RUZDIDTESA-N 486.617 0.536 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCN(C(=O)OC(C)(C)C)CC1)CCO2 1783939554 IIRHQVXKMDRFIR-XMMPIXPASA-N 495.621 0.836 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)n3cnnn3)C2)C1 1784599689 WRQKUCSIXYCRRS-RNODOKPDSA-N 473.446 0.211 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1 1785714110 NCDBRYCAUQYLAQ-QFIPXVFZSA-N 488.545 0.186 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(F)cc3F)C[C@@H]21)c1ccc(B(O)O)cc1 1786980233 YARBVOMWJXPXML-OWNFZTQPSA-N 470.281 0.951 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C[C@@H]21 1791251736 SXEZGCDGOBXDFN-SIRPWMCASA-N 477.002 0.462 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C[C@@H]21 1791288015 OAZGBYGGLLPYLT-FJIDUMEYSA-N 481.594 0.349 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(-c4ccccc4)n3)C[C@@H]21 1791291506 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CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1[C@H]3CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C3)C2 1801421421 NUSDHJCGZNGSJS-RSPOEFSDSA-N 494.357 0.254 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361193 FHIVOUKRGNRRPH-GDBMZVCRSA-N 453.201 0.981 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365846 ZGOGNVNYRKZZHE-UGKGYDQZSA-N 477.330 0.238 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)ccn1 1808920058 XILHCUPIONJNQH-OFNKIYASSA-N 487.325 0.748 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809978658 IRLRFSYNHJQNHQ-KRWDZBQOSA-N 451.336 0.502 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1 1810295701 VRMZQQGDPBLYEV-UWJYYQICSA-N 460.498 0.432 50 20 JCGD Cc1nc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)no1 1810296012 ZGNOTQFLSRSJRG-YWZLYKJASA-N 464.486 0.334 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)n[nH]2)[C@H]1c1cccnc1 1810301986 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O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1)c1ccc(B(O)O)cc1 1817472319 FSNMJEOOJRNJEB-IBGZPJMESA-N 473.302 0.681 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)[nH]n1 1818112999 ZBHTZCGEZZEVIG-JKWRJKHLSA-N 486.533 0.186 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CSc2nc[nH]n2)[nH]n1 1819404510 OJEAYCBWOVQBJJ-CQSZACIVSA-N 470.519 0.625 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1825128160 CRBYNRAUUQLBKN-GOSISDBHSA-N 463.539 0.784 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(CCO)CCO)sc2C1 1825318684 AQFWGZVVFDVVAX-VXGBXAGGSA-N 463.398 0.373 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@@H]1NC(=O)NC1=O)CC2 1825441385 UOVLLXKOLSXVPQ-WEDXCCLWSA-N 458.338 0.827 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1827692738 YRCBYDUSEBKADB-YWZLYKJASA-N 458.563 0.785 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COCCO)CCN2C(=O)OCc2ccccc2)C1 1829231148 ATFLFSNYRNLUAK-CVDCTZTESA-N 497.976 0.701 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1831644075 NMTYAEUGICOYTO-XLIONFOSSA-N 473.979 0.963 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cccn3)C2)C1 1832549243 IVSRYTKHDPNGBH-KKSFZXQISA-N 485.969 0.472 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833313836 VEFHWVNIKJALSY-UZLBHIALSA-N 464.994 0.976 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)cn1 1833430055 OWKYUMFBHKZBDT-AUUYWEPGSA-N 471.352 0.976 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1[nH]ccc1C)CCO2 1833543794 YMOFEACVJHUQNZ-LWROZRRASA-N 456.503 0.527 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CS(C)(=O)=O)CC2)CC1 1834569201 SVWIAPADRBHITJ-ZDUSSCGKSA-N 452.415 0.634 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@H](O)c1ccccc1 1834583531 YLPCPBFOCUSTRX-HSZRJFAPSA-N 465.359 0.285 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C#CC3(O)CCCCC3)CC2)CC1)c1ccc(B(O)O)cc1 1834798560 LBYPZJZTGPZURE-UHFFFAOYSA-N 481.402 0.250 50 20 JCGD O=C(Cc1noc2ccccc12)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834815224 XWXJDDLLMFVXSK-UHFFFAOYSA-N 490.369 0.936 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc2cccnc2[nH]1 1835581082 WRMPOFXHVISKAG-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CC(C)[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835926140 HMXDVRXMSPURHC-BVAGGSTKSA-N 480.370 0.876 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835926544 RAOQVZXESYTDIY-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931795 CVEUBRADHCBQPX-VWLOTQADSA-N 482.342 0.376 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1cccs1 1835939869 LNCFBLQNUCASRU-KSFYIVLOSA-N 458.345 0.302 50 20 JCGD O=C(CN1C(=O)CNC1=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1837046349 CDOIZKOJCGGJIR-HNNXBMFYSA-N 463.304 0.227 50 20 JCGD COc1ncccc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837453951 VKCOZXHETDZMTE-UHFFFAOYSA-N 467.331 0.696 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3c(F)cccc3F)C2)C1 1837460106 VEPSIVBMVQOVOZ-QHCPKHFHSA-N 489.479 0.276 50 20 JCGD COC(=O)C12CC(C(=O)N3CCC(OC4CCN(C(=O)c5cnccc5C(=O)NN)CC4)CC3)(C1)C2 1838395530 ZEFBDRCMXWSZRE-UHFFFAOYSA-N 499.568 0.641 50 20 JCGD C[C@H](NC=O)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1839802375 UZPQWCVSZMZRFD-DJPFJPOOSA-N 482.375 0.584 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1840033589 KHEWEAVIYAVCLK-SCLBCKFNSA-N 457.325 0.519 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCn3c(=O)oc4ccccc43)C2)C1 1840150353 JMUDUJLFTLMBAL-OPAMFIHVSA-N 481.933 0.695 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(N4CCOCC4)c3)C2)C1 1840154827 HKSZOJYXGASJQP-NFBKMPQASA-N 481.977 0.847 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185885 VBXUZIGSBFEHMO-NRFANRHFSA-N 483.953 0.187 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CC3(CCC3)C1)CCO2 1840603976 XRAJSAGUTRGMGO-QHCPKHFHSA-N 457.531 0.335 50 20 JCGD COCCOCCOCCOCC(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1 1845220023 WADQBYJZBRCXDN-HNNXBMFYSA-N 455.321 0.577 50 20 JCGD O=C(COC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)NNC(=O)c1cccs1 10149539 GADLKVDGULWZGV-UHFFFAOYSA-N 471.488 0.526 50 20 JCGD CC(C)(C)C(=O)NCCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 28028449 XDDULRIHHYMTHO-UHFFFAOYSA-N 454.549 0.411 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CNC(=O)Nc1ccccc1 28663242 FPNAECNVLLNIAF-UHFFFAOYSA-N 489.554 0.609 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c(C(=O)OC)s1 726520002 SKYJMFYNYALVNJ-UHFFFAOYSA-N 456.454 0.716 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@@H]1CCCOC1)N(S(C)(=O)=O)CC2 727849319 XLJYKHJDNHEDKR-ZBFHGGJFSA-N 455.533 0.527 50 20 JCGD C[C@@H]1Oc2ccccc2N(CC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1=O 728213376 ASLIYMSJZGBTFA-INIZCTEOSA-N 473.555 0.880 50 20 JCGD O=C(COC(=O)CCn1cc(Br)cn1)NNC(=O)[C@H]1COc2ccccc2O1 728332867 TUDKXMIRJGLMGF-CQSZACIVSA-N 453.249 0.566 50 20 JCGD NS(=O)(=O)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 746347554 XWBZVYOSXUPJNA-UHFFFAOYSA-N 466.541 0.334 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1S(=O)(=O)N1CCCCCC1 748246005 CJSDBFOFDGXPEJ-UHFFFAOYSA-N 452.533 0.643 50 20 JCGD Cc1sc2ncn(CC(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c(=O)c2c1C 761461594 BMSSHMYGRCVHMV-UHFFFAOYSA-N 469.932 0.837 50 20 JCGD COc1cccc(/C=C(/C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n2nnnc2C)c1 817819867 PHDYPKKLJXFBBZ-OWMRDYPQSA-N 494.464 0.519 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H]1CC1(Cl)Cl 863950130 WOJGTXHPIODYPE-AWEZNQCLSA-N 450.344 0.981 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1ccccn1)c(=O)n2Cc1ccccc1 916333205 FUXJNPCNDWLQCE-UHFFFAOYSA-N 475.509 0.990 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 919684193 JYJOVWNXENYJBA-KRWDZBQOSA-N 474.605 0.357 50 20 JCGD C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1)c1ccccc1 919885406 OYSXEYOJAHRSIM-RHSMWYFYSA-N 480.568 0.857 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1c[nH]c(C(=O)N2CCCC2)c1 1317809454 LYLUQVKUZDEDQS-UHFFFAOYSA-N 468.561 0.476 50 20 JCGD COCc1oncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1778345125 WYYVGJAIWZIRQY-DYESRHJHSA-N 451.524 0.322 50 20 JCGD CO[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1779031244 OYRFAXCCOKEZOG-CVDCTZTESA-N 453.499 0.516 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCCO3)C1 1779033963 KKCPTNBTGVJRLB-CAAOGRNVSA-N 497.556 0.927 50 20 JCGD COC(=O)CCCCCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034652 RKJPQLHYPMXNTJ-QFIPXVFZSA-N 461.519 0.252 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2 1779374527 NGGGJYHWFLDWSE-SRIQFFGBSA-N 498.584 0.214 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779375016 KIHXZIFDDZQLQG-XKDCRVNJSA-N 469.546 0.345 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2)N1CSCSC1 1779452329 ORKAJTCDYJPRLH-CBGDNZLLSA-N 487.692 0.916 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)N(C)C(C)=O)CCO2 1780097780 JWSPATFSYQEOHE-FPTDNZKUSA-N 476.486 0.830 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCS(=O)(=O)CC1)C2 1780700062 LELWWPMQULSTMG-FRQCXROJSA-N 450.001 0.248 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCOCCOCCOCCOC)C2)C1 1781384073 YKJSAEXOPQFYEL-GHTZIAJQSA-N 464.987 0.920 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCNC(=O)c1ccc[nH]1)C2 1782170885 DTYSGRNANHHOOB-LUQKVYGDSA-N 454.955 0.902 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782569899 ODLLUEFKMZBFJQ-NYQDVAGCSA-N 467.331 0.356 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN3CCCCC3=O)C2)C1 1783756365 QQSSPIBDYLCPPV-HSZRJFAPSA-N 488.497 0.976 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783946709 GAPVXZXUZQGNHO-SGTLLEGYSA-N 454.351 0.896 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784096540 ZZUUQOJRKZHLFZ-RBZJEDDUSA-N 473.954 0.492 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1785272453 MPKAJLZZYSYGRO-HSZRJFAPSA-N 485.733 0.736 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Cl)cc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979474 MVZUZEZARROWQS-YYWHXJBOSA-N 456.735 0.856 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C[C@@H]21)c1cccc(B(O)O)c1 1786982724 GCVIHCHCMJQVSK-NYVOZVTQSA-N 481.314 0.501 50 20 JCGD O=C1CSc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)ccc2N1 1787387378 WFAQECLVJJOSGT-SDADXPQNSA-N 453.948 0.924 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4ccnc4c3)[C@H]2C1 1788359378 KAWHJWBRNQLBLQ-SNRMKQJTSA-N 463.498 0.240 50 20 JCGD O=C(CS[C@H]1CCCCO1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1788646718 NUAXZOXWBXOTAI-WBKMXMRLSA-N 462.377 0.220 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1789544886 CVLCDDRDYFIUFO-OAQYLSRUSA-N 482.298 0.609 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4c(c3)NC(=O)CS4)[C@H]2C1 1790454726 INSWXAJDKXMFPA-PCBIJLKTSA-N 468.963 0.973 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(C)c1 1792095904 SAQHTJFHCBLRCV-NYVOZVTQSA-N 480.326 0.369 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CO)NC(=O)OC(C)(C)C 1796300127 JQFRNGRIVQKQDE-PEBLQZBPSA-N 464.357 0.245 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)C2 1796439551 KICCPXLMRRHZLF-GMHREAEJSA-N 498.584 0.501 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796445755 IVLNKPVGFMKCRZ-WRANAMQPSA-N 485.541 0.465 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2sc(C)cn2c1=O 1797065442 XCJJYUHHJFATTK-AYRXBEOTSA-N 454.936 0.521 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)C1 1798443670 UNQYDVIIPIMIIS-NNXHMXCWSA-N 457.531 0.916 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)N1C(=O)OC(C)(C)C 1801008793 BGVNCHZJZDROJE-CURYNPBISA-N 495.621 0.737 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1cccn1C 1801442809 CNGVGBWOMUFRPP-YVWYUNDQSA-N 484.465 0.945 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803147039 SIFMNBOBBSBLAN-WSTZPKSXSA-N 457.955 0.757 50 20 JCGD C=CCO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803566968 PTXIBDGIYKXTLB-SYNHAJSKSA-N 452.515 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cc2ncccn2)[C@H]1c1cccnc1 1804692661 ODJDPUAJYLSTSF-IIBYNOLFSA-N 460.498 0.432 50 20 JCGD O=C(CNCP(=O)(O)O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1807021071 FYXOSYCZTFJYCT-CZUORRHYSA-N 463.269 0.597 50 20 JCGD CC(=O)c1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n[nH]1 1807360783 CYYZMAJDBJVVSR-UWJYYQICSA-N 461.287 0.321 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccnc(Cl)n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361852 UIQZAUFMOBILHJ-LPHOPBHVSA-N 465.706 0.838 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807363819 QJYJACRALFQDLE-XXBNENTESA-N 487.325 0.748 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1807369485 LONSXWIGHNEOBG-XMSQKQJNSA-N 475.314 0.584 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375970 RCSQWFNUCIZJPS-NBCNXNJRSA-N 474.330 0.372 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)Cn2nccn2)[C@@H]1c1cccnc1 1808416070 DFBSRINBOHQXHZ-PFWGCWTJSA-N 463.502 0.513 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 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C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1ccnc1 1819792742 ADGAFUOMPNVPRU-NEPJUHHUSA-N 454.516 0.825 50 20 JCGD Cc1nn(C)cc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793084 KCAJKWIAZKKTDJ-NSHDSACASA-N 454.516 0.723 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(N)s1)CC2 1819794818 FJACPKYZDVAFDA-MRVPVSSYSA-N 458.529 0.720 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3nc4ccc(F)cn4n3)sc2C1 1824395789 JLEPNUDDPLFWJI-GFCCVEGCSA-N 474.522 0.924 50 20 JCGD O=C(c1cnc2ncccn12)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052150 QFILQMGWZZFWGF-HXUWFJFHSA-N 461.331 0.956 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2nccnc2C(N)=O)CC1 1829511097 IOKQTFNIUFOJJY-MRXNPFEDSA-N 459.551 0.182 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1831446173 CCPGGEJEXGCRAY-UKRRQHHQSA-N 457.318 0.040 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CC1 1831874705 USEGQXXMALLHAY-PXNSSMCTSA-N 483.610 0.822 50 20 JCGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)c(=O)[nH]c1C 1833386316 VQSZBIWUVRUNTQ-BLVKFPJESA-N 471.352 0.488 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnnc3)CCO2)C1 1834025226 XCINBEOCUYBIGE-HRAATJIYSA-N 483.953 0.679 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)c3ccccc3)CC2)CC1 1834584394 FLGWVPABCOLFLN-JOCHJYFZSA-N 480.569 0.604 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801474 NMUSTJWDOMRBBS-SFHVURJKSA-N 480.374 0.414 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)o1 1835733500 CUENJGSYHJHRJS-UHFFFAOYSA-N 482.346 0.417 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1835933736 BPRIRSZNOKJFIY-CJAUYULYSA-N 482.342 0.249 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)s1 1835935231 JRQPFCAXXKTYDD-HSZRJFAPSA-N 472.372 0.439 50 20 JCGD Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1C 1836770833 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CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccccc3=O)C2)C1 1839964490 SRYPBLYZXGOXDP-DNVCBOLYSA-N 456.337 0.478 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1 1840184266 GBEKJTJFGOZJDI-DEOSSOPVSA-N 469.542 0.678 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1 1840184697 BJARDEBGIKPBQL-IFMALSPDSA-N 482.965 0.203 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1 1840511925 RNVFJYWJSQNJKL-DEOSSOPVSA-N 482.541 0.173 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1840520606 PDHDCVDCONOJQK-KOXUSJRISA-N 465.576 0.294 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1 1840905527 GHWQETQCPZXJHB-FXAWDEMLSA-N 486.338 0.872 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C[C@H]2C[C@H]21 1847079217 SHJHGOBIKOTPLI-QRQLOZEOSA-N 469.347 0.581 50 20 JCGD COc1cc2ncn(CCCC(=O)NNC(=O)c3n[nH]c(=O)c4ccccc34)c(=O)c2cc1OC 10708486 QBUBZSMKKCCUGN-UHFFFAOYSA-N 478.465 0.892 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)n(C)c1 16231270 LOOJAZRPKBWMHM-UHFFFAOYSA-N 460.516 0.377 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)Cc3ccc(Cl)cc3)cnc21 727098078 HBQZQAHTXZPIPP-UHFFFAOYSA-N 453.684 0.936 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C 728381927 QWWVDZJQAIBDIX-FVQBIDKESA-N 487.600 0.748 50 20 JCGD COc1cccc(NC(=O)COc2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)c1 729275133 LRXYQXXJPDEZKI-ZDUSSCGKSA-N 464.500 0.411 50 20 JCGD Cc1nc2c(c(O)nn2C)c(C)c1CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 729511457 HLXFOETXAZWUBD-UHFFFAOYSA-N 466.907 0.595 50 20 JCGD CO[C@H](C)CC(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 749567040 FEFQXMDSPILIBZ-MRXNPFEDSA-N 470.530 0.636 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(C(=O)N2CCCC2)C1)c1cccc(S(=O)(=O)N2CCOCC2)c1 915802889 WIYMPSGZEGYVEV-GOSISDBHSA-N 493.586 0.396 50 20 JCGD C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1nnc2ccccn12 916222007 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Cc1nc[nH]c1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967938 DXUYLPCHUFKSSL-HSZRJFAPSA-N 469.546 0.508 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)C=CC1=O)C2 1781904724 AQFYDQPRSNSVBZ-IQUTYRLHSA-N 456.337 0.599 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2ncc[nH]2)C1 1782407695 PPHOOBNIPNRDEO-VGOFRKELSA-N 455.519 0.169 50 20 JCGD O=Cc1ccccc1-c1cncc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1782766057 PNCGDJPQBIDHCV-HHHXNRCGSA-N 499.332 0.998 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1782866029 IFJZOFWVNDDEAJ-RTBCXJIMSA-N 478.452 0.766 50 20 JCGD NC(=O)NCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783021146 ATHXYMXGUMQTHS-BEFAXECRSA-N 453.337 0.491 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#CC3CC3)[C@H]2C1)NC(=O)NCc1ccccc1 1784385280 KHSWSLSFYYCVOS-FKBYEOEOSA-N 467.570 0.726 50 20 JCGD COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1786527042 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474.754 0.488 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)N1C[C@H]2C[C@H]2C1 1797629803 IUNGWSIGVVBBDD-GHMQIUJFSA-N 456.547 0.050 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1CCCCN1Cc1ccccc1 1799038167 STUMMYBJOROCRR-VRUIKYSZSA-N 491.397 0.624 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2sccn12 1799094131 FYAJXBVWPMJJFW-CLLJXQQHSA-N 467.511 0.320 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2 1800643574 XRAPMPDDINPEKW-WPLOAARJSA-N 464.357 0.593 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC 1800911106 CLBSHNFHWQOETF-JRBZFYFNSA-N 491.969 0.286 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C1(O)CCC1 1802465463 JPJLVQFYAXETGB-SYNHAJSKSA-N 466.542 0.951 50 20 JCGD COc1cnc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1 1806051958 VWONMZQNXOHEIZ-IERDGZPVSA-N 455.519 0.573 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807359624 BMRKCJZLAFBRJQ-PERKRYKHSA-N 466.347 0.386 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807360638 TYZWBZNPDASCIC-CRAIPNDOSA-N 466.332 0.288 50 20 JCGD CN1CCC(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1807362124 ZOVRHLRTSSYEFF-UNMCSNQZSA-N 450.348 0.423 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368247 RBZAXXXMINAQRR-JPYJTQIMSA-N 460.299 0.424 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc1 1807369585 PEAIZBGLCZJPDX-XXBNENTESA-N 473.342 0.856 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C=CCN2)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807454687 WITNETYWIOOSDM-WPFOTENUSA-N 491.596 0.962 50 20 JCGD O=C(C/N=C/c1ccco1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810389662 DOLJAMYPPSBUNC-ODMMXCMLSA-N 460.299 0.793 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1 1812142791 YSNFSTCWZAYULB-IIBYNOLFSA-N 474.525 0.856 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1 1812864203 NWPYGKRZWUIRHA-GHJWDPDVSA-N 474.319 0.916 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813071581 UVOWTFBSXYTLNV-UZLBHIALSA-N 457.535 0.516 50 20 JCGD Cc1noc(N)c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1814906535 SOBKQGIHCHQSBB-SECBINFHSA-N 456.488 0.560 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1 1815775296 YARQVCLBWMDGFI-JBBSTVMTSA-N 455.504 0.481 50 20 JCGD Cc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)c(=O)[nH]c1C 1816115681 RPPPAVPRQIYVBM-HNNXBMFYSA-N 458.523 0.789 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)c4cnccc4C(=O)NN)n[nH]3)CC2)CC1 1819404079 XBNYTWXSFVSTEU-LJQANCHMSA-N 495.588 0.494 50 20 JCGD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)n1ccccc1=O 1819570562 KTSFKAVDRPZIAW-KXBFYZLASA-N 463.303 0.818 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1820108503 YPENNAOQKBVCPC-WFASDCNBSA-N 458.349 0.354 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1821735592 GCSHTERLAWBXAG-KRWDZBQOSA-N 494.273 0.166 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[nH]n1 1822414513 VQAFVTUAMFWHMJ-OAHLLOKOSA-N 492.562 0.240 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])CC2 1826088063 QPSSKYSPLXUMPE-SECBINFHSA-N 450.481 0.373 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cnccn2)CC1 1828923285 BNNAFDWZFOSRDD-FQEVSTJZSA-N 451.531 0.951 50 20 JCGD O=C1C[C@H](C(=O)N2CCN(C(=O)OCc3ccccc3)[C@]3(CCN(C(=O)[C@@H](O)CCl)C3)C2)CN1 1829305872 IZDFBPDGKQNQMK-BSRJHKFKSA-N 492.960 0.174 50 20 JCGD C[C@@H](O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1829329773 UOKWNJIAXHOMKS-HOYKHHGWSA-N 489.573 0.192 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1829762981 WLCBRLNUKRDUSU-WIXIHDJSSA-N 458.353 0.332 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1830538294 AZBYXSGFBFFDJX-ZBEGNZNMSA-N 460.285 0.419 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)N1CSCSC1 1830730464 ANMZHDBQSSAHQN-JKIFEVAISA-N 454.014 0.086 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2 1831262675 HJYFSZOBCKDYBJ-LQBOVUBWSA-N 465.934 0.890 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551305 IEXMRWCKKTWIOZ-PNLZDCPESA-N 491.029 0.915 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833024523 QNBGSILBJUOBGQ-KHJUTWJGSA-N 482.965 0.857 50 20 JCGD Cc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1833361411 BCGQOAVSDAJPBH-UHFFFAOYSA-N 458.607 0.877 50 20 JCGD O=C(CCN1C(=O)C=CC1=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1833614289 JQTGFKOTGXSLRD-GOSISDBHSA-N 473.343 0.564 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1 1833895859 KDZDGSDKLCSLHA-SCLBCKFNSA-N 459.341 0.842 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1ccnc1 1834798153 XHCRLVITSWVFGK-KRWDZBQOSA-N 453.352 0.009 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1n[nH]c2c1CCCC2 1835002056 HBKJDHLORBWKFM-UHFFFAOYSA-N 479.390 0.467 50 20 JCGD Cc1cncc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835737205 WFKRJLFVMKOAGB-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930467 JAFKODGAJLMESR-SANMLTNESA-N 494.353 0.004 50 20 JCGD Cc1ccccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932150 QKKFBCXPUYXFPX-RUZDIDTESA-N 466.343 0.378 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933929 HAGOBIIBABGBRT-QHCPKHFHSA-N 492.259 0.096 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC[C@H](C(F)(F)F)CC3)C2)C1 1835941482 LOEJMPDRELRSMJ-RADWXHQJSA-N 498.307 0.805 50 20 JCGD C[C@@H](Sc1cccs1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837230712 BBFWIGCAFJNQNH-OPAMFIHVSA-N 490.412 0.679 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncccc4c3)C2)C1 1837459189 LVKLZPCUBQWBLR-RUZDIDTESA-N 490.520 0.617 50 20 JCGD Cc1noc(N)c1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837857797 RRWKLPQKPGVFIH-UHFFFAOYSA-N 456.308 0.171 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H]3Cc4ccccc4O3)CC2)CC1 1837919108 FIXRPWVMMQIHSO-XMMPIXPASA-N 478.354 0.982 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ncccc3F)CC2)CC1 1837921145 FTQYFWJHWUNADD-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc4nncn4c3)CC2)CC1 1838332140 LBKOOSBPDKVNBK-UHFFFAOYSA-N 471.562 0.715 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)nn1 1838832041 CVSNVVPNIDGANJ-UGSOOPFHSA-N 457.325 0.729 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)cc1)CCO2 1838977155 RHFDFDPLXFZPKR-JOCHJYFZSA-N 492.259 0.769 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839150405 LPLGTPVGTGZFHK-KBRIMQKVSA-N 474.407 0.007 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202732 NZZJXBDMVKGKPS-YGTYGHESSA-N 477.327 0.889 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCC(=O)N3)C2)C1 1839743354 KTXRDJUDVVFIFB-WCPBPTQFSA-N 474.464 0.607 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCSC(=N)N)C2)C1 1839963347 IICQPEWBXAEAJN-MLGOLLRUSA-N 451.387 0.633 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840030735 VFOKAQBKTFOQST-MLGOLLRUSA-N 453.355 0.132 50 20 JCGD CCOc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)nn1 1840034713 UYTOOQMHHHLGAN-SCLBCKFNSA-N 457.325 0.729 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4cc(C)ccn4c3=O)C2)C1 1840152932 YWZOSOZGSORSCX-VGSWGCGISA-N 478.933 0.327 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)OC(=O)NC(C)C)C2)C1 1840154318 SHSRGITYZFMNTC-MGPUTAFESA-N 463.959 0.610 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(NC(C)=O)cc3)C2)C1 1840156814 UZYDFVDUKVBPFO-GHTZIAJQSA-N 453.923 0.969 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)nc4n[nH]cc34)C2)C1 1840183897 HEBMDNDFTNLXBC-OAQYLSRUSA-N 493.952 0.054 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C#N)ccc3F)C2)C1 1840184787 BQCXFMJJTONADK-QFIPXVFZSA-N 461.494 0.140 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3Cl)C2)C1 1840185859 ZFVBSEDGDACEIC-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840239895 RPSWSLIJQODXSO-DEOSSOPVSA-N 470.306 0.127 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)C(C)(C)C#N)C1 1841137214 NYHHYCSKCBGTAR-IBGZPJMESA-N 498.389 0.555 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)Cc2ccn(C)n2)C1)NC(=O)NCc1ccccc1 1843056538 GLKLANINVFQQAP-UHFFFAOYSA-N 453.547 0.512 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2nc3ccc(C(F)(F)F)cn3n2)C1 1843156044 VCYTXHDCFCWNJZ-UHFFFAOYSA-N 467.452 0.938 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(-n3c(O)nnc3O)cc2)C1 1844739352 VRFAJHJTTQEVNE-AFUMVMLFSA-N 492.496 0.630 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)n(C)c1=O 9444171 XZNXZWFYLKBPLA-UHFFFAOYSA-N 473.449 0.703 50 20 JCGD O=C(CSc1nnc(N2CCOCC2)n1C[C@H]1CCCO1)NNC(=O)c1ccc(F)cc1 11373954 DNJMCOQRCSVVBA-MRXNPFEDSA-N 464.523 0.986 50 20 JCGD COc1cc(C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)NC3CC3)c2)cc(OC)c1OC 26219576 BSTTYBVNCLGPLG-UHFFFAOYSA-N 485.540 0.776 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C1=CC=CN2CCS(=O)(=O)N=C12 761414850 JNRLKKKIHZHVCW-LLVKDONJSA-N 469.317 0.861 50 20 JCGD CCc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(OC)c(OC)c1 768522641 VMBWDXNRAGOEKF-UHFFFAOYSA-N 451.501 0.771 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)cc1OC 787407262 XGGWVUWWQORDLC-XMMPIXPASA-N 496.476 0.402 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(S(N)(=O)=O)c1 916197073 MUSSUTCPQMTLTD-LBPRGKRZSA-N 469.545 0.290 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NN=C1C(=O)N(C)c3ccccc31)c(=O)n2Cc1ccccc1 916332504 YQHSTPLHSWGKLI-UHFFFAOYSA-N 485.504 0.925 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccnc(N3CCN(C)CC3)c2)cc1 916390447 QRWCVTIHOXHDAO-UHFFFAOYSA-N 489.602 0.293 50 20 JCGD CN1CCN(c2cc(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)ccn2)CC1 916390734 WRHBDZANIJATRC-UHFFFAOYSA-N 460.564 0.271 50 20 JCGD COc1cccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1OC 918218543 WIQAAFRHEHIRNI-UHFFFAOYSA-N 492.554 0.911 50 20 JCGD COc1cc(C(=O)NNC(=O)c2nc3ncc(Br)cn3n2)cc(OC)c1OC 919805984 HCUUTCRBNXAOKT-UHFFFAOYSA-N 451.237 0.987 50 20 JCGD NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)Cc2c[nH]c3ccccc23)c1 920277359 TXYKOVRLQHFTIF-UHFFFAOYSA-N 457.512 0.656 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CS(=O)(=O)C3)C1 1777715690 UEHKEBDJWSZMKA-UCMVZMLTSA-N 489.392 0.749 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1[nH]nc2ccncc12 1777906883 LFDLKEQBOLBCFJ-AUSIDOKSSA-N 463.303 0.079 50 20 JCGD COC(=O)CSCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091443 FHNXSRRSSYJIGI-JBQOLUAXSA-N 493.586 0.541 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1779279899 FDELKEDFFHBWTK-RCDICMHDSA-N 474.470 0.654 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCS1(=O)=O)CCO2 1780098702 QRUICOSBBVYCNL-GHTZIAJQSA-N 495.510 0.541 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nc(CO)[nH]c3c1)C2 1782212140 XJNCVWKAKLODMD-NTKDMRAZSA-N 486.573 0.556 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1 1782671274 YKAFOOGNHAGMHT-LIRRHRJNSA-N 453.337 0.815 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1 1783601979 ICHZHRXLJQLGHS-CFZJUORYSA-N 465.906 0.807 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)CN3CCCCC3=O)C2)C1 1783751942 SCEIFDZLHNZJIB-AOMKIAJQSA-N 486.997 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C(=O)c1ccc(Cl)cc1)CCO2 1783932747 CWSWSWALUUQBLN-NRFANRHFSA-N 450.923 0.726 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C3=CCN(C(=O)OC(C)(C)C)CC3)C2)C1 1785318263 KZUHHBPNJLQWSE-XMMPIXPASA-N 493.605 0.757 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)n1 1785536887 GBQCGLVTGLRZCG-BQFCYCMXSA-N 460.535 0.006 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1scnc1C1CC1 1785788306 GCNBKRSOWDPWBH-SZMVWBNQSA-N 455.345 0.607 50 20 JCGD CC(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)no1 1786225464 RIJIEMAABKLJMM-AXHNFQJDSA-N 456.503 0.704 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCNC4=O)[C@H]2C1 1786258200 GTARTQHZDIDZLA-DVZHBHJUSA-N 468.352 0.251 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786986584 MWMZYPJCRNSAFP-AAEGSUEWSA-N 461.327 0.901 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(F)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786986667 XFBFGTXTGDOWFC-NYVOZVTQSA-N 454.307 0.732 50 20 JCGD CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)CC1 1787508241 RZTFOQXJVUKKGE-HDHADGOUSA-N 472.590 0.832 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)CCN4C)[C@H]2C1 1787998999 SUTLZAUGUMMULK-ZJOUEHCJSA-N 457.575 0.645 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C[C@@H]21 1791293699 BBBMOAAUPLXLBZ-BJLQDIEVSA-N 471.558 0.538 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc(OC)c1C 1792045272 OJLXUGQPIQMJLY-NYDSKATKSA-N 482.342 0.599 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@@H]1c1ccc(F)cc1 1792807446 OVXYQLCOGFZZQM-MGKRVJGCSA-N 467.501 0.831 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1nc(-c3ccc(F)cc3)no1)C2)[C@@H](O)CCl 1792975673 UOUJETCMSCOKHO-MVWRLGRASA-N 466.897 0.998 50 20 JCGD CC(C)(C)OC(=O)NCc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c1 1792976457 UUKSWVVZUOAETG-CYGHRXIMSA-N 482.965 0.909 50 20 JCGD CC(C)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)N1Cc2ccccc2C1=O 1793322629 NRCDXPSWEIOMQU-PLWWPAAYSA-N 499.612 0.630 50 20 JCGD CCC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1793445471 JLIGTAHUSGYCBV-SCYMPEOESA-N 452.939 0.990 50 20 JCGD Cc1noc(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1794693797 MFBIDHTZKAOOSG-HATOLVCRSA-N 484.557 0.841 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ccc1F)C2)c1cccc(B(O)O)c1 1795737782 SQIKSAQVDHTZSK-HBCWATKFSA-N 491.122 0.785 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)C1CCN(c2ccccn2)CC1 1796188584 XLHREHCIUCYYCM-KOUNCHBCSA-N 462.359 0.930 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798522946 HEZPMWDALSXSRF-OGTATFDYSA-N 474.470 0.763 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)c1ccccc1)C2)NC(=O)NCc1ccccc1 1799094764 JMVCYCJLPWGRAC-CBJLPSGESA-N 495.580 0.656 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(F)F)cc1 1799588178 MIPVMNCPWLXQJI-ZSBFGKGUSA-N 475.452 0.804 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)C1 1801052202 OEOLWVKVUYPTNA-IDLUEMFASA-N 490.395 0.733 50 20 JCGD CS(=O)(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1801532686 RFFSMIGTZAHPSP-AOWDBCOTSA-N 467.494 0.896 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@@](C)(O)CN1C(=O)OC(C)(C)C)C2 1802339764 LIMXMCKTPXLSCY-JCHKBEJOSA-N 495.621 0.758 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCc2cnc[nH]2)[C@@H]1c1cccnc1 1804427614 QISGQRWPPMXZAJ-KKSFZXQISA-N 462.514 0.756 50 20 JCGD CCN1CCC(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1807363820 FSBJDPBZVJAFTF-GGAORHGYSA-N 464.375 0.813 50 20 JCGD CCc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n(C)n1 1807376454 VOUPBNYDFGZYGJ-AVRDEDQJSA-N 461.331 0.691 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1nc2ccccn2n1 1807934544 MNSBZZTTZVUAAE-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1 1809763974 FIZGRMHNFCLEFG-HRAATJIYSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCc2ncc[nH]2)[C@H]1c1cccnc1 1813273657 JWWXTTUCZPWGDV-HRAATJIYSA-N 462.514 0.756 50 20 JCGD Cc1cnn([C@H](C)C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1 1813379995 PNLRUYKVBGUAIE-AGHHOFFYSA-N 461.331 0.847 50 20 JCGD CNc1nsnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474969 IVYWFWZAVSOMRP-AWEZNQCLSA-N 455.309 0.602 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOC2=O)[nH]n1 1818110405 FKHWRTFYCFGOBC-ANDSAHIGSA-N 470.490 0.988 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1827680923 YMDRFXJHSCPZHN-LWKXQZBCSA-N 493.373 0.734 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCCO3)CC1 1828610987 CLTCHSWYSOHPFH-NRFANRHFSA-N 466.347 0.893 50 20 JCGD O=C(/C=C\C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)NC1CC1 1828789624 CARUEYKGTQJMNH-VFCOFNOGSA-N 453.348 0.435 50 20 JCGD CNC(=S)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1828928216 AOVUOJKISOQRJG-LJQANCHMSA-N 460.409 0.084 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1828957427 NTJIFCPYTJYTEA-VQTJNVASSA-N 482.578 0.474 50 20 JCGD COc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)nn1 1829524534 SQHBOHMPLGCNRI-HXUWFJFHSA-N 452.320 0.712 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830737439 HMWIQSYTESBQMH-XXBNENTESA-N 498.960 0.723 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830738711 SGAIDXNGUAOGQI-ACTFIFLWSA-N 489.997 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1 1831282938 HXAHJMCPNXRZDP-OALUTQOASA-N 477.587 0.496 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1831301312 PLVAXOUFNKFJLN-FXSPECFOSA-N 494.353 0.249 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)COc2cccnn2)CC1 1832191370 AGSMPKFGZNCCPS-HXUWFJFHSA-N 452.320 0.469 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2 1832219789 QAXZTYNFWHSXKF-NFBKMPQASA-N 456.279 0.147 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1 1833305980 HYCSRBJOOQXZGJ-IBGZPJMESA-N 472.007 0.875 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(NC(C)=O)n3)CCO2)C1 1833339743 RHMRLUREULKGBN-MGPUTAFESA-N 454.911 0.364 50 20 JCGD Cc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1833360097 OXAQBSSIIYYTMM-UHFFFAOYSA-N 464.375 0.498 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)COc3cccnc3)CC2)CC1 1833760077 CZQYEDUBVPUTLX-UHFFFAOYSA-N 460.579 0.405 50 20 JCGD Cc1ncoc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834259536 NPXDGTIKFIOWOW-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCSC(=N)N)CCO2)C1 1835656265 HSNRBLBJDKQNSY-MLGOLLRUSA-N 451.387 0.633 50 20 JCGD Cc1ccn(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835737223 XWBAWASRGRHWGL-UHFFFAOYSA-N 468.562 0.075 50 20 JCGD Cc1cc(Cl)ccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934356 XJTKXKFBENBFKJ-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD O=C(c1ccc(-c2ncc[nH]2)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934491 VTFUSMRKOCHZPB-VWLOTQADSA-N 490.325 0.140 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c[nH]1 1835935620 VXYWIWIXZNYNOG-XMMPIXPASA-N 469.347 0.376 50 20 JCGD COc1cc(Cl)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835942134 XKZPFQSPMIFFBN-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3nn[nH]c3C(F)(F)F)CC2)CC1 1836177086 QSFQUYQXKOHTEM-UHFFFAOYSA-N 488.515 0.382 50 20 JCGD CCc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)n[nH]1 1836279308 MMQGYKNYIOTZPR-NMWDDECMSA-N 471.518 0.176 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)nn1-c1ccccc1F 1836343580 SNXFWKGMJMVGTQ-XMSQKQJNSA-N 496.923 0.690 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOC3=O)CC2)CC1 1836786240 DWHLUJLVHDRLAN-PCLIKHOPSA-N 488.545 0.571 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)CCO2 1837474395 GGUNMOQFXGSIQI-VCHRRKICSA-N 488.610 0.704 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(C(F)(F)F)n1)CCO2 1837929702 MIIOXKSJKVRYMH-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccn4c(O)nnc34)CC2)CC1 1838060780 GKXNZSFPWLQEQM-UHFFFAOYSA-N 487.561 0.420 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)c(F)c1)CCO2 1839011120 LQQGPNJBQPEVMQ-OAQYLSRUSA-N 454.474 0.408 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839150236 GHTJCOPZVJQPMZ-MOPGFXCFSA-N 452.379 0.841 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1 1839261333 VWLDCNIBVIEKET-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)c2n1 1839625614 CFOMPNLBCUZZPJ-LAUBAEHRSA-N 450.923 0.621 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)n3)C2)C1 1839964420 RASSXOARRDDSGL-PIGZYNQJSA-N 459.297 0.131 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cccnn3)C2)C1 1839967563 QJBPUSOMNJBFAL-KBXCAEBGSA-N 457.325 0.485 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840035073 FPOJKULVFUVGQY-YVCVADBVSA-N 484.347 0.996 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1cccs1 1840375801 IFNOSFYUANHBKN-IVZQSRNASA-N 473.555 0.620 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2 1840542425 WJYXOQSHQATJMC-FXLJNVFASA-N 456.348 0.407 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)O2)C1 1841348986 YDLFHHGFTYTVSR-CABCVRRESA-N 457.955 0.958 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)C1 1843009061 BFBZJQLAUUGGLS-UHFFFAOYSA-N 481.425 0.382 50 20 JCGD COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1NC(C)=O 1844746076 FYASTXWKFTWUBJ-UHFFFAOYSA-N 466.498 0.783 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1845948042 FICAXJFLMCPTHY-UHFFFAOYSA-N 477.326 0.452 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1846202948 OJLVIFURSFFUTO-GVRJEKJASA-N 457.955 0.548 50 20 JCGD COC(=O)N(CC(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2)Cc1ccccc1 1846260590 KMQGJPNMAXRYJF-UHFFFAOYSA-N 459.547 0.831 50 20 JCGD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1847544284 TZZNCPWBCXICHY-ROUUACIJSA-N 457.679 0.986 50 20 JCGD Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)CC2)c1C 15639544 OXNUGJKXMBKKQI-GOSISDBHSA-N 485.628 0.903 50 20 JCGD C[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 28028046 JAOCIJAIMVAMRM-INIZCTEOSA-N 490.538 0.783 50 20 JCGD COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1S(=O)(=O)NCc1ccccn1 725902057 GJXMPHZCSFWRNT-UHFFFAOYSA-N 487.494 0.353 50 20 JCGD O=C(COC(=O)[C@H]1C[C@H](O)CN1C(=O)c1ccc2c(c1)CCC2)NNC(=O)c1cccs1 725996015 ANUIVVQOCDDFKH-DLBZAZTESA-N 457.508 0.817 50 20 JCGD Cc1ccc(C)c(OCC(=O)NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)c1 727099395 UTAUCQKJKXFLOK-UHFFFAOYSA-N 463.292 0.736 50 20 JCGD CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1 727603746 CTXLHCPCOPIHSE-UHFFFAOYSA-N 451.491 0.098 50 20 JCGD C[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccc2c(c1)CC(=O)N2C 728402084 XXRNKJPNFYVJTH-OAHLLOKOSA-N 487.586 0.924 50 20 JCGD Cc1nc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cs1 728574543 DBVCGIYEXSHMKV-UHFFFAOYSA-N 468.517 0.127 50 20 JCGD CN(C)S(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 728704752 KSZZAGZLQONLGN-UHFFFAOYSA-N 463.428 0.214 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)n1 728722211 NDMICNFBZDUYIJ-UHFFFAOYSA-N 482.540 0.019 50 20 JCGD C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)C2=O 728845656 OBGXFVQKLQRFGN-IQMFZBJNSA-N 471.562 0.977 50 20 JCGD COCCCNC(=O)[C@@H](C)N1CCN(C(=O)NNC(=O)c2cccc(OC(F)F)c2)CC1 728954248 VYTBPTWJAIRCGZ-CQSZACIVSA-N 457.478 0.801 50 20 JCGD Cc1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 729275154 MGKXLEZMNHKBFK-GFCCVEGCSA-N 472.520 0.634 50 20 JCGD COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 749562445 XTNDSQBKENPLTE-UHFFFAOYSA-N 454.530 0.475 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H]1C[C@H]3CC[C@H]1C3)c(=O)n2Cc1ccccc1 789857491 VEZBWIKKAZHNRF-FHWLQOOXSA-N 494.552 0.638 50 20 JCGD CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1=O 912642878 DHYJMSQDJUOOCZ-UHFFFAOYSA-N 465.532 0.343 50 20 JCGD NC(=O)[C@H]1CC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)=NN1c1ccccc1 913081160 CMBHIMRMDSJPAM-LJQANCHMSA-N 484.538 0.352 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)c1 915895141 VBESTMGAUHOEJX-LJQANCHMSA-N 475.571 0.782 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@@H]1CCN2CCC[C@H]2C1 916572540 AVJXUCJNYXXVQH-SJORKVTESA-N 451.549 0.278 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCNc3ncccc3C#N)nc2)CC1 916641169 BYZXPQFQBQMHIA-UHFFFAOYSA-N 459.536 0.023 50 20 JCGD O=C(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NC1CCCCC1 918125666 MGRRPLSKFKVSSL-UHFFFAOYSA-N 481.575 0.491 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(c2cccc(Br)c2)C1)N[C@H]1CCS(=O)(=O)C1 919884851 HONGDXOOILWGQT-JQWIXIFHSA-N 459.322 0.320 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccc(O)cc1 1779036556 AROFENQJFVQMIS-NPMXOYFQSA-N 453.499 0.638 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1O 1779037149 PUXKVHQNNOYRKO-QHCPKHFHSA-N 469.498 0.547 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1779688716 TYMITFTZNIGOKZ-NRFANRHFSA-N 467.954 0.950 50 20 JCGD CC(C)n1nccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779748153 ABIPIZOLWVXULG-NFBKMPQASA-N 454.336 0.585 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnnc1O)CCO2 1780097855 OZEIATQQKXZEKU-OAQYLSRUSA-N 471.426 0.773 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1F 1780112239 IQSWMOIMSRZKJE-HSZRJFAPSA-N 478.521 0.819 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCN1C)CCO2)NC(=O)NCc1ccccc1 1780968973 LPKCZLDBSQXLIC-RDPSFJRHSA-N 472.590 0.257 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1783450478 OKEDCIQWYVPCMT-DFBJGRDBSA-N 499.373 0.067 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1c(Cl)ccc3c1OCO3)CCO2 1783934515 GMNPJEOQZUSNIN-NRFANRHFSA-N 466.922 0.885 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)C1 1784016213 ZVASLYNNGLTPDZ-WOJBJXKFSA-N 490.395 0.973 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784100185 AOVOGFHIPLNCJY-LQJIQPLVSA-N 489.378 0.121 50 20 JCGD Cc1nn[nH]c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785076530 PXTSFFSXEUHIAH-AJNGGQMLSA-N 470.958 0.839 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(O)c4ccn(C)c34)[C@H]2C1 1789151556 FUKPXWHIVQDBGL-WBAXXEDZSA-N 472.546 0.245 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3CCN(C)CC3)[C@H]2C1 1789801834 YUNCUFVIEBWLGF-ATIWLJMLSA-N 459.429 0.776 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)[C@H]2C1 1789810478 WUFUVRGRZCIPPQ-FRMKIJSPSA-N 489.997 0.448 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21)[C@H](F)Br 1789923481 PJHDQRJHAMJKHQ-NHULGOKLSA-N 489.367 0.562 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(-n4cncn4)c3)[C@H]2C1 1790248155 QDPGPWYCBSVESB-NDXORKPFSA-N 490.524 0.173 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790575390 ACTDXUXYSQQBHH-GWKIZSTFSA-N 466.542 0.552 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS(=O)(=O)N1CCCC1)C2 1792867842 IYSUEGYNXNWEPW-AYDFFVQHSA-N 466.398 0.033 50 20 JCGD O=C(CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)Nc1ccccc1 1792936439 VIRDTEYSBZJSCP-NHKMSHSESA-N 479.342 0.379 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796190310 MXNBVZYUJQUXPF-FCHSSTLOSA-N 483.374 0.731 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c(C)noc1C)C2 1796439449 FIJYGHLIDCKMLE-QCIWSRGXSA-N 470.530 0.948 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc(CO)[nH]c3c1)C2 1796441940 IWTZJZAYIZZUNV-LNPMFIPTSA-N 493.524 0.392 50 20 JCGD COc1c(Cl)cccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801808839 ODHGLMVOXPHOHK-IVWMJMPLSA-N 473.917 0.864 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362045 YWQNMPKXEYBUKM-OXQOHEQNSA-N 464.243 0.896 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1 1807362165 ZTUUMUMLCWJLBG-ZTCOLXNVSA-N 489.337 0.823 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363849 RATMXWOKWTZTKW-GDBMZVCRSA-N 497.210 0.436 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807366284 YEJCHOHLUFVVKP-FPOVZHCZSA-N 463.347 0.363 50 20 JCGD COc1nccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1807711081 IGVLJEZBZNSAJF-UTKZUKDTSA-N 478.289 0.938 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)c2nc[nH]n2)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807868702 BCSPHCNYDOGIAY-CTNGQTDRSA-N 491.556 0.866 50 20 JCGD Cc1noc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810303008 OFZDCXOPJSYKOR-QRWLVFNGSA-N 464.486 0.334 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)c3)C2)CC1 1810546334 CHUISIZALPPSOQ-UHFFFAOYSA-N 454.487 0.650 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813074731 WLXOHBUIVPFMRI-AQOAWAETSA-N 496.572 0.069 50 20 JCGD CC(=O)N[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(C)(C)C 1815057171 HSXPKLIJEVLDOE-ICSRJNTNSA-N 469.351 0.946 50 20 JCGD COc1nccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1F 1815340031 BXKWYLQEACOYAK-CYBMUJFWSA-N 470.291 0.905 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(CO)c(F)c1)CC2)c1cccc(B(O)O)c1 1815361730 PTDDEZCTTHHGJR-MRXNPFEDSA-N 469.303 0.994 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1 1815361764 QYVUXNIUYAHUNO-XJKSGUPXSA-N 453.333 0.815 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N[C@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)n(C)c1=O 1817118145 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YZDULOLBXIFLEI-HNAYVOBHSA-N 457.314 0.886 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830738737 SYCMYISCBXKQJF-BXTJHSDWSA-N 463.959 0.203 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)CCO2 1832051853 XQIVRWGFKZKYNT-QYWGDWMGSA-N 475.970 0.706 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1 1832135514 QXFXLUWAMRXXPE-QRVBRYPASA-N 453.971 0.676 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3C[C@@H]3F)C2)C1 1832551100 AWEYYUPOWVLQFZ-VPCSNGCSSA-N 463.934 0.933 50 20 JCGD CC(C)c1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)no1 1832792279 XRCJDEOWOLXZLJ-UGSOOPFHSA-N 459.341 0.975 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](Br)Cc3ccccc3)CC2)CC1)C(O)O 1833223367 QMSXIFCHMJHGIN-GOSISDBHSA-N 468.392 0.875 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)COCc1ccccc1)CCO2 1835370110 HASFBZQEBIVKRM-QHCPKHFHSA-N 462.547 0.033 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2 1835642056 HGABCWWBDOOULJ-GCKMJXCFSA-N 477.002 0.702 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CNc3ccccc31)CCO2 1835714967 HTAIZCKMRVKUFU-DWFICWTASA-N 494.552 0.786 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc4occc4c3O)C2)C1 1835932172 RLWIXGAOQDCCSG-DEOSSOPVSA-N 480.282 0.202 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(C(F)(F)F)cn3)CCO2)C1 1836377736 LBOCHSLXHSGGKI-SJKOYZFVSA-N 466.844 0.819 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1 1836850619 VHDMYRONJRDIRS-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD Cn1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)cc2ccccc21 1837459129 JAJHJJIUVCXWFH-RUZDIDTESA-N 492.536 0.561 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1 1837460356 CNJLDTBEKTUNDV-WZOHSFFVSA-N 479.537 0.559 50 20 JCGD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837797334 GRAURAZHBQBEPA-SMDDNHRTSA-N 450.221 0.078 50 20 JCGD CN(C)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1837921315 YQJLIWTTYKQUHA-UHFFFAOYSA-N 480.374 0.753 50 20 JCGD CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)C[C@H]1CO2 1839086109 WERZGNSDOACZGW-YJPXFSGGSA-N 491.944 0.756 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839109011 WNNUMUKCLXJRQY-APWZRJJASA-N 473.412 0.006 50 20 JCGD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200543 JWDXHWCDLGCNAT-PXNSSMCTSA-N 497.321 0.926 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839767664 UVHJNTDPGCFNQU-HOYKHHGWSA-N 478.565 0.834 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1840148804 VKGOXKLMWBSPDM-AUSIDOKSSA-N 498.960 0.723 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)C1CC1 1843013761 JUCLHPFMXHAOKS-SFHVURJKSA-N 457.336 0.487 50 20 JCGD COc1ccc(COCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1 1844265178 BXBKVVUUGRMALK-UHFFFAOYSA-N 453.499 0.728 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1844692717 CATVQPLINMGGBX-LJQANCHMSA-N 491.453 0.832 50 20 JCGD C=CCOC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847563961 OKNHADBRIVQKIQ-YHUYYLMFSA-N 488.969 0.593 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccc3c(c2)COC3)cc1OC 726671959 YFRLQMRCTYBSBH-UHFFFAOYSA-N 493.494 0.017 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCCN(S(C)(=O)=O)CC1 728943598 RDFMILCOMXXXOE-LBPRGKRZSA-N 463.354 0.925 50 20 JCGD O=C(NCCS(=O)(=O)N1CCSCC1)NNc1ccc(S(=O)(=O)C(F)(F)F)cc1 730672759 KZKKGIFORKIPDN-UHFFFAOYSA-N 476.524 0.985 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)NNC(=O)COc1ccccc1O 730893153 BWYDZKCZCKAZDJ-UHFFFAOYSA-N 480.499 0.653 50 20 JCGD O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 742457535 HMYSOACXYYOTMC-CYBMUJFWSA-N 475.449 0.701 50 20 JCGD C[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 748125865 OICJAJBOVYMQRA-YVEFUNNKSA-N 461.858 0.989 50 20 JCGD CN(CC(=O)NNC(=O)CNC(=O)c1cccs1)S(=O)(=O)c1ccc(Br)cc1 751206240 IGBMXOSEYQSBTA-UHFFFAOYSA-N 489.373 0.709 50 20 JCGD CCc1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1S(=O)(=O)N1CCOCC1 751209123 LSLQSHCZQOBRNV-UHFFFAOYSA-N 480.568 0.522 50 20 JCGD CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)s1 761462691 JEYWYIZUWULODK-UHFFFAOYSA-N 480.977 0.215 50 20 JCGD Cn1nc(SCC(=O)NN=C2CCN(Cc3ccc(Cl)cc3)CC2)c(=O)n(C)c1=O 915957686 QXBFXAGNGRRLGW-UHFFFAOYSA-N 450.952 0.993 50 20 JCGD O=C(NCCN1CCN(c2ccccc2)CC1)NNC(=O)c1csc(N2CCOCC2)n1 916514880 ROLUIVZJPHPHBB-UHFFFAOYSA-N 459.576 0.746 50 20 JCGD Cn1c(=NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)sc2ccccc21 916516720 PTMGFFAIRHIZES-UHFFFAOYSA-N 475.600 0.902 50 20 JCGD Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 917278311 MWLPDWCTOZTVHS-QFBILLFUSA-N 484.444 0.435 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C[C@@H]1CCCO1)c(=O)n2Cc1ccccc1 918016088 CZZFTKIEFLOZBJ-INIZCTEOSA-N 454.487 0.144 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(C)n(C)n1)C2 1778091515 SXGGHSKFLLTKLA-LVGVVDSRSA-N 469.546 0.990 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1778256597 NRWOEVFYRIYXSI-DEOSSOPVSA-N 480.525 0.330 50 20 JCGD CCSc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029623 VYNUVYHYGFGFMO-JOCHJYFZSA-N 470.555 0.949 50 20 JCGD O=C1COc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)cc2N1 1779049321 NPTUWQYDLZAAIR-PXDATVDWSA-N 493.325 0.139 50 20 JCGD Cc1nc2sccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779155479 ZHSNANPIHFSMIY-WZONZLPQSA-N 482.371 0.825 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCOC1)C2)NC(=O)NCc1ccccc1 1780559607 WAEHYKVGMVHODM-BPYKYCOYSA-N 487.601 0.883 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc(Br)cc3O)C2)C1 1781524927 SUMPGUDKLUGALS-NRFANRHFSA-N 489.131 0.592 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1782171198 SNLBUYALDYQSNE-ZXHYMLNSSA-N 482.965 0.760 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1 1782264405 MSGDDEUTCUJLGA-XZZBMYDMSA-N 491.508 0.913 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1782868008 XFMUFTZKZSMLLJ-XNTKEIKESA-N 476.480 0.853 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@@]3(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)C2)CC1 1783209586 IITOKCZMKPKKPY-VBKZILBWSA-N 473.954 0.902 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)[C@@H]2C1 1783465540 ILHNQSGHWLLTFM-VPEYGQHGSA-N 457.955 0.529 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c([N+](=O)[O-])cc1O 1783934559 CYXPRYOCZPVVSG-OAQYLSRUSA-N 479.490 0.126 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784094781 RMORPLJPIUFDAR-ZWBPQZFFSA-N 471.982 0.965 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)CCc3cnccn3)C2)C1)NC(=O)NCc1ccccc1 1784559835 BTVBNYROIJDQIZ-RUZDIDTESA-N 495.584 0.585 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3cccnc3)[C@H]2C1 1785378111 LLFMYPBMPKQYGL-NBFPQWMBSA-N 450.499 0.387 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cc(C)cnc34)C[C@@H]21 1787508512 KXVNMLPJEQLHIG-WRSVAZJTSA-N 492.540 0.765 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cc(O)ccc4n3)[C@H]2C1 1787868327 CFJVRFUZTAPLPH-MDKPJZGXSA-N 469.542 0.907 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(-c4ccccc4)n3)C[C@@H]21 1788610088 CMTKPRJYNSTRBQ-YSSFQJQWSA-N 490.524 0.173 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cc(O)ccc4n3)C[C@@H]21 1788610420 QUKMPNVIKGYAQG-OHEPNIRZSA-N 490.520 0.846 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Oc3cccnc3)[C@H]2C1 1791651232 HGURXYWAKHTYSJ-VIGRZUFSSA-N 482.541 0.963 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncc(Cl)cc1Cl 1792412706 CRKHZRZIEAAPCS-CULMDFNYSA-N 479.324 0.904 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)C2 1794142444 AMCQQDZXBVXYGN-XFMPKHEZSA-N 493.952 0.802 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(S(C)(=O)=O)c1 1794626269 JUDODABUPFYBJM-MUJYYYPQSA-N 451.549 0.110 50 20 JCGD CCc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1Br 1795962231 WKERBSPYHBYIBO-IVWMJMPLSA-N 499.410 0.321 50 20 JCGD Cn1c(=O)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)nc2ccccc21 1796188941 CVPPUICEJRWBNI-BCDXTJNWSA-N 460.299 0.179 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796189723 RQMCJGNPHKBHII-YRPNKDGESA-N 469.347 0.535 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)C1CCN(c2ccccn2)CC1 1796191656 LJSVZECXRUWJLJ-KOUNCHBCSA-N 462.359 0.930 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2c(O)nnc12 1796288936 GSUXKASDJSAZPB-XCCSTKFXSA-N 452.309 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)ccc1F)C2 1797748336 RCTXESOTNMMUDA-KSPBDQMDSA-N 461.881 0.995 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)c2c1 1797748461 DSQIXSKBVWAQAW-GPVSGQMNSA-N 476.537 0.921 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)cc12 1797751539 FFWIRDFCGUXCFP-USGNIVHTSA-N 462.510 0.992 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnc(-c2ccccc2)o1 1797821597 IJPBWFWTQCFVCZ-HGKCTWBKSA-N 456.503 0.313 50 20 JCGD C#CCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097503 NHWGGUVEUJANNV-JHDGKUDLSA-N 455.559 0.726 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2)[C@H](F)Br 1799346603 DLHKSSZYEWTIQS-QSMSVPEVSA-N 484.366 0.902 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CNC(=O)C1)C2)NC(=O)NCc1ccccc1 1799869487 QPNZGCJEOUYMBO-OKYOBFRVSA-N 456.547 0.107 50 20 JCGD CN(C)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Cl)cc1 1800305861 ZQQJXXIDQHZDMU-GMQQQROESA-N 485.777 0.526 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCNC3=O)C2 1800641203 RAUBFSOKUSMJKA-ZWUHOBOKSA-N 468.352 0.393 50 20 JCGD COc1ccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)n[nH]2)cc1 1801011112 CGKVKVLIXWWBPA-GPVSGQMNSA-N 484.557 0.662 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1802085267 NXARRNDCVFUXIK-ITGHMWBKSA-N 465.906 0.567 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n(C)n1 1804928662 LBLAAOGEZKDEIM-IIBYNOLFSA-N 457.535 0.516 50 20 JCGD Cn1c(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cccc1=O 1805309044 QRIGJEQHVZRXSE-GCJKJVERSA-N 460.299 0.094 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1806340243 AQBDSXXIBNTHOJ-BLLLJJGKSA-N 475.307 0.312 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807361820 JLJNESZYTGPQDH-ICSRJNTNSA-N 462.319 0.567 50 20 JCGD Cc1nnc(CCC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1 1807362858 MKFWSDNGZTZUSX-AVRDEDQJSA-N 479.371 0.874 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371323 SMJYUIPFKDMMQF-QFBILLFUSA-N 460.137 0.866 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377271 ZUUKAMSWXIHWJG-REWPJTCUSA-N 496.336 0.976 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1 1807937864 UANDTZVHMMRIPD-UTKZUKDTSA-N 464.530 0.817 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1808317844 LWSGFEVAKQJPLV-POAQFYNOSA-N 461.390 0.610 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1 1810303497 TZFBIWAOYGQXAB-OXQOHEQNSA-N 485.508 0.756 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356980 XPLPYOKNYTVSRK-IUODEOHRSA-N 466.332 0.339 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2 1819837572 XYNTVHDBMUVJAC-CHWSQXEVSA-N 460.564 0.719 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1CC[C@@H]2CCC(=O)N2C1 1820758630 KJNPMFGLXOJKHB-POAQFYNOSA-N 479.346 0.796 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1822703354 ZMXJABFJZKDSHF-MSOLQXFVSA-N 487.565 0.245 50 20 JCGD O=C(COc1cccnn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822752750 OIRQDGUDAQQJTI-KRWDZBQOSA-N 450.264 0.264 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1F 1830149339 LUSXKMCASZMWHN-HSZRJFAPSA-N 487.488 0.217 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)CCO2 1830429273 UAXVQLMLWNRRCE-REHUZNOOSA-N 476.549 0.759 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccccc3=O)C2)C1 1830538961 WRGIKHMTSHGRQG-HNAYVOBHSA-N 456.337 0.336 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCC4)C2)C1 1830539078 AIVVRCLGWKTITE-LIRRHRJNSA-N 455.353 0.930 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1830539117 BJRIMKBCDKBBPP-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1830540254 PGYBVVSELVYUNY-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726173 OPBGMPXISCDPHU-WIYYLYMNSA-N 480.905 0.606 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(O)c1OC 1830733053 CXOUPYHHHMWMEH-XOBRGWDASA-N 458.895 0.079 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)n(C)n3)CCO2)C1 1830955315 KPIHHMQDXSUZJQ-LPHOPBHVSA-N 457.369 0.901 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccn(C)c3=O)CCO2)C1 1831892936 FRDRKRWGQGLCEM-HNAYVOBHSA-N 456.337 0.629 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cn1nnc3ccccc31)CCO2 1832208421 ORIJNUIYAVLGRE-NRFANRHFSA-N 461.595 0.739 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832250950 BYKFHANHXWSOCI-HZMBPMFUSA-N 464.796 0.052 50 20 JCGD CC[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)N(CC)CC 1833539082 YWMBOGNXIMPVEK-QHCPKHFHSA-N 472.439 0.672 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCc3ccccn3)CC2)CC1)c1cccc(B(O)O)c1 1834799881 KRAYPBDVKXDXKN-UHFFFAOYSA-N 464.375 0.579 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834821281 FAUFBQKXVLGJCV-LIRRHRJNSA-N 494.383 0.113 50 20 JCGD CC[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)N(CC)CC 1835737218 XFLUCKAHFHYKRR-QFIPXVFZSA-N 487.649 0.991 50 20 JCGD O=C(NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccco1 1836128308 JAHCXXCHFMYCHK-YOEHRIQHSA-N 462.272 0.156 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1836255412 AXASAZCSLAUYEQ-KUHUBIRLSA-N 474.967 0.316 50 20 JCGD CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCN(C(C)=O)CC3)CC2)CC1 1836397411 ZWJQTIZXCXRVID-FQEVSTJZSA-N 456.031 0.740 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1 1836414705 ZBAKSRMVBBPNFF-FUHWJXTLSA-N 466.348 0.864 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnsn3)CC2)CC1 1837298026 TYXOVAZGJRUNPB-UHFFFAOYSA-N 459.532 0.463 50 20 JCGD Cc1cc(/C=C/C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)no1 1837919298 WSCRUGUWDHEFCV-VOTSOKGWSA-N 467.331 0.988 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3n[nH]c4c3CCCC4)CC2)CC1 1837920115 BTHGAASGWLODCT-UHFFFAOYSA-N 480.374 0.894 50 20 JCGD O=C(c1cn2ncccc2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201445 XVOPNTNGPTUWLD-YOEHRIQHSA-N 456.272 0.490 50 20 JCGD Cc1cccc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839367996 AFSHQDDPBSCIES-XMMPIXPASA-N 452.316 0.367 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839519131 WOLREBIIHRGUGQ-KXBFYZLASA-N 471.352 0.909 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1 1839989206 UNZFMQNPERZHTH-UGSOOPFHSA-N 464.357 0.751 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840106524 PGIWLUKZZHUNOA-DNVCBOLYSA-N 460.369 0.629 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2 1840137626 LUCRDTPCBFOQNF-PXDATVDWSA-N 495.536 0.149 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1840151374 ZXOGYYOZGSQLOE-YGRLFVJLSA-N 464.796 0.052 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1840153060 BMNFOXFIPZYOKB-ZHRRBRCNSA-N 480.949 0.050 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1 1840185996 YBVOLTSEYNAQKW-FQEVSTJZSA-N 453.927 0.178 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3OC(F)F)C2)C1 1840186576 AYMAZAWENPCELB-QFIPXVFZSA-N 484.500 0.731 50 20 JCGD COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1F 1840793556 DNPGPUFXVJMHIK-HSZRJFAPSA-N 487.488 0.217 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841354099 IMZVRXJEOJWRPM-LSDHHAIUSA-N 455.943 0.649 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1841777710 YTAZTOKQEKWJJC-LJQANCHMSA-N 471.363 0.973 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C[C@@H](F)C1 1843014072 TZZWUXRQLJWSHV-PKOBYXMFSA-N 489.353 0.779 50 20 JCGD Cc1c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)ccc2c1OCCO2 1844264127 HUUDWJIRLIGCQC-UHFFFAOYSA-N 451.483 0.896 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1844693159 DBMZPSMCMGNJHR-LJQANCHMSA-N 498.496 0.808 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)NC(=O)c2ccccn2)C1 1845769671 KNLWGAQUSDMZLT-SCQWWOTGSA-N 465.514 0.537 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1845938817 NTLSONWQEBUETK-UHFFFAOYSA-N 470.356 0.220 50 20 JCGD Cn1c(=O)c2c(ncn2CCC(=O)NNC(=O)CSc2ccc(Cl)cc2)n(C)c1=O 16228321 BPPPGJOERNLVPV-UHFFFAOYSA-N 450.908 0.417 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N(C)Cc1ccccc1 728372477 RKTBNTVTLHIVJK-KRWDZBQOSA-N 495.579 0.712 50 20 JCGD COc1cc(C(=O)NNC(=O)Cc2c(C)nc(-c3ncccn3)nc2O)cc(OC)c1OC 729258230 JLZLNGZYSQRFNG-UHFFFAOYSA-N 454.443 0.977 50 20 JCGD CNS(=O)(=O)c1cccc(NC(=O)CNC(=O)NNC(=O)Cn2ccc3ccccc32)c1 729506657 HRJPDCVJSOFRLY-UHFFFAOYSA-N 458.500 0.519 50 20 JCGD CN(C)c1ccc(NC(=S)NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)cc1 729689098 PCPHCZQNNUBRFA-UHFFFAOYSA-N 464.529 0.326 50 20 JCGD C=CCNC(=S)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C/c1ccccc1 825123402 QQYSIAZCEVBGOQ-BMQCOBNYSA-N 460.603 0.061 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)n1 904222357 IMIALGALIOHBQC-LLVKDONJSA-N 479.446 0.785 50 20 JCGD CC(C)CCOc1ccc(C(=O)NNC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 914881972 YSUMAPSWLPMFQW-SJORKVTESA-N 451.545 0.908 50 20 JCGD COc1ccc([C@H](CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)N2CCOCC2)cc1OC 915894525 CFBVZDZBXJKQFG-OXJNMPFZSA-N 456.565 0.458 50 20 JCGD Cc1ccc([C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)N2CCOCC2)o1 916229227 NAYNASBCRMBJIU-GOSISDBHSA-N 479.559 0.856 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(Cc3ccccn3)CC2)c1 916382598 QPCZQQNZDNVMFW-UHFFFAOYSA-N 460.560 0.941 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)[C@H]2c3ccccc3C(=O)N2C2CC2)c1 920276356 WFICMUAXOTVESU-HXUWFJFHSA-N 499.549 0.174 50 20 JCGD O=C(NNC(=O)c1cccc(NC(=O)c2ccc3nc[nH]c3c2)c1)N[C@@H]1CCS(=O)(=O)C1 920292334 FLDAFQNKQVYZMM-OAHLLOKOSA-N 456.484 0.946 50 20 JCGD CCn1c(CCC(=O)N2CC[C@H](B(O)O)C2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 1261844396 MSEIBINRQCZFQO-HNNXBMFYSA-N 464.353 0.085 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCC=CO3)C2)C1)NC(=O)NCc1ccccc1 1778992347 RNYQDAVMUQSKIZ-GBXCKJPGSA-N 471.558 0.855 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3cccnn3)C2)C1)NC(=O)NCc1ccccc1 1779463065 XWAIWALNFFCWLY-HSZRJFAPSA-N 467.530 0.266 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc(Cl)n1 1779791926 MCSWBCJZBZJCQN-NRFANRHFSA-N 459.695 0.181 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C1=COCCC1)CCO2)NC(=O)NCc1ccccc1 1780967877 AJKQUJQVYLIPPU-XMMPIXPASA-N 471.558 0.857 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781326451 XSDAXPGIEPVAEG-XWCIJXRUSA-N 468.320 0.392 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1782170358 JNNNPTSMZGZPLH-ZBQZNYHESA-N 474.967 0.219 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1 1783749495 XYUODJWOUOVABS-QHCPKHFHSA-N 463.498 0.179 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCN1C(=O)OC(C)(C)C)CCO2 1783936925 LRCFOBPVCJFQIZ-HXOBKFHXSA-N 481.594 0.589 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(C)noc3C)[C@H]2C1 1785084401 PRNRKTHFGHASMZ-MSEPQIRJSA-N 470.530 0.948 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1 1785228918 JEOSSOKMSNETEY-OAQYLSRUSA-N 484.550 0.046 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccc4c(c3)OCO4)[C@H]2C1 1786606104 BFEKCNZTUGHTAN-BPXKWBHBSA-N 495.536 0.640 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)cc(F)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979729 BUAPAODLSVIPIE-NDXORKPFSA-N 458.270 0.481 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCCC3(F)F)C[C@@H]21)c1ccc(B(O)O)cc1 1786980178 SAQULKKBODBTEE-WNHJNPCNSA-N 450.291 0.785 50 20 JCGD Cc1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786982967 DKHSPNHOFMCHGG-PMVMPFDFSA-N 450.344 0.901 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)C1 1787450186 WRBVJSKGICZZKF-AUQLDDPISA-N 463.934 0.872 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cn2ccc(Cl)cc2n1 1788080184 QWQBUALWQKECQY-QSFXBCCZSA-N 482.733 0.575 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cc(F)ccc4n3)[C@H]2C1 1788345921 VYBDGEDENMUQFY-ZVZYQTTQSA-N 460.510 0.440 50 20 JCGD NC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)c1ccccc1 1788610526 DFOUJCZRKGSKSV-GIUOSPMZSA-N 466.542 0.021 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)cn1 1789923068 RPYNQEPYHMRWRS-QCEMKRCNSA-N 492.367 0.910 50 20 JCGD CN1CCN(C2(C(=O)Nc3ccc(C4(NC(=O)c5ccc(B(O)O)cc5)CCC4)cc3)CC2)CC1 1790446726 TUVRCSCMZPEUFJ-UHFFFAOYSA-N 476.386 0.894 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ncccn4n3)C[C@@H]21 1790961456 JZMXABCJQDYIRN-XUXIUFHCSA-N 451.325 0.891 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C[C@@H]21 1791253930 MDWRNKNSYYWJMU-KSWRQPAISA-N 477.986 0.496 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791292157 BELCQYYDJYNYQN-GTAWCEEGSA-N 473.574 0.158 50 20 JCGD CC#C[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(O)cc1 1791335986 GSNZOEYGUKQRFP-QKYMMTCKSA-N 490.365 0.863 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Cn3ccnc3)[C@H]2C1 1791626037 SPOCZPJOEXFZCA-VDTQALLHSA-N 469.546 0.633 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)n(-c2cccc(=O)n2C)n1 1795933474 PCISTINUGTWWMV-FAQVEIGNSA-N 487.633 0.934 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796192044 DRFLQMKLZCYLGO-FCHSSTLOSA-N 483.374 0.731 50 20 JCGD COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cn1 1796439574 MLJDIHNBEXAQPS-ZMQIZJGTSA-N 482.541 0.746 50 20 JCGD Cc1cc2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)[nH]c2cc1C 1797671561 WIEHACQWWMFECG-UPHUGPLXSA-N 462.315 0.377 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(F)(F)F)C2 1797749738 MDNHHTNWVONSGW-DPIQGUFMSA-N 478.431 0.616 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1798521694 UYYQWUIQOVYWBP-RBNVPPIJSA-N 455.851 0.323 50 20 JCGD CN[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1)C(=O)O 1800436558 YCLGVCANINLFAJ-OREBXVKISA-N 482.375 0.645 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800436592 YYAKGOJEWDMZEK-OREBXVKISA-N 481.391 0.175 50 20 JCGD CNC(=O)CC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1803476820 QHIJSZRHHPFYPF-CUVSIRLISA-N 453.503 0.358 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(=O)OC(C)(C)C 1806722482 VTQFAYXVLZBJPD-SIKLNZKXSA-N 496.373 0.948 50 20 JCGD O=C1CN(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)C(=O)N1 1808651549 OIDADFSFXUUGEU-KCPJHIHWSA-N 456.272 0.330 50 20 JCGD O=C(COC(=O)C(F)(F)F)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809970876 CRPMBOKXAOGPJY-UHFFFAOYSA-N 456.226 0.317 50 20 JCGD COCCOCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810298225 GXFLGVZKEGGHJL-UZLBHIALSA-N 456.503 0.063 50 20 JCGD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)N1C[C@H]2C[C@H]2C1 1815344334 UIOVURXGHIKCMB-UTXMOHQDSA-N 454.361 0.389 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3nonc3c1)CC2)c1cccc(B(O)O)c1 1815356714 MZUKQWSQRRODAV-CQSZACIVSA-N 463.284 0.899 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2[nH]nc3ncccc23)[nH]n1)c1cccc(B(O)O)c1 1817475069 KICDXCOPZSCNAW-KRWDZBQOSA-N 459.275 0.981 50 20 JCGD C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNCP(=O)(O)O)CC2 1820163067 YAUXHTHOULFSJG-JTQLQIEISA-N 450.530 0.631 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1 1822415756 HNVYECHXZQYJDB-GFCCVEGCSA-N 462.429 0.880 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059909 YILKRPSTMPEWFR-SFTDATJTSA-N 470.404 0.626 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1827679142 NVJUMUHUQBKLNB-BASWRVNGSA-N 488.589 0.891 50 20 JCGD COC(=O)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828834609 KZXRQMHTLCMZPV-FDDCHVKYSA-N 495.960 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)Cc2cscn2)CC1 1828927053 YOCMJYMINDZTSO-PMACEKPBSA-N 485.614 0.945 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1c(Cl)cncc1Cl)CCO2 1829599158 OJQXRFKKHLURGN-OAQYLSRUSA-N 494.140 0.452 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)NCc1ccccc1 1830674930 FUATUUMXYSIMIQ-WBWXQYNJSA-N 453.898 0.850 50 20 JCGD O=C([C@@H]1CCCN1C(=O)c1ccc(F)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830720422 ZLOALQUGHGCHBG-YDHSSHFGSA-N 497.951 0.486 50 20 JCGD O=C1CSc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2N1 1830728617 WHTBMGCOFHAOME-YWZLYKJASA-N 469.947 0.401 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1831651472 PMJFPZWFSGAIMC-CKJXQJPGSA-N 467.954 0.459 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1 1832149123 LOFBMSXLKQORFT-QGZVFWFLSA-N 472.575 0.829 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1832443274 SPTQPHXXWYZCLT-DEOSSOPVSA-N 476.574 0.512 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccoc3)CCO2)C1 1832647513 OCKWMFZNCBDRGB-QCXQHHQDSA-N 469.498 0.883 50 20 JCGD N#Cc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1833106748 SZHWQCHJIRMSAH-UHFFFAOYSA-N 474.370 0.666 50 20 JCGD CC(C)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1833214207 MQIWCEXBUNLBTN-UHFFFAOYSA-N 464.958 0.263 50 20 JCGD CC(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)on1 1834798319 HBAXWZNWUWPPGZ-UHFFFAOYSA-N 468.363 0.977 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)CC1)c1cccc(B(O)O)c1 1834799783 AWQLODJMAPQXQD-XMMPIXPASA-N 493.369 0.392 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834824781 MJHUHKMRZKYPJI-SFHVURJKSA-N 464.357 0.753 50 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BFZNJCHRDLVGRO-QAPORCKPSA-N 453.399 0.633 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1 1837457438 BJYBHBNONCFIOI-IBGZPJMESA-N 485.463 0.488 50 20 JCGD O=C(c1ccc(Br)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837826033 AVCNTABLWXSULX-PBHICJAKSA-N 462.728 0.514 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ncccc1C(F)(F)F)CCO2 1838144554 HVTXXODHNNSXKP-FQEVSTJZSA-N 487.479 0.543 50 20 JCGD COc1nc(C)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1838174577 LYXVTLRAYDBBAB-FXZATJRASA-N 498.540 0.603 50 20 JCGD COC(OC)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838527325 OCDKYLCKWFVNAY-NRFANRHFSA-N 481.458 0.209 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccncn3)C2)C1 1838528338 ROIBNWKKTFQSMK-JOCHJYFZSA-N 485.453 0.694 50 20 JCGD COc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1OC 1838841029 FQRRXLJNGWAGGC-MAUKXSAKSA-N 476.299 0.859 50 20 JCGD CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1838990570 IJMVVKVNEUORKT-DEOSSOPVSA-N 467.526 0.631 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1 1839965493 ZSWBLWDKYGTGCC-GLJUWKHASA-N 463.373 0.324 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@H]43)C2)C1 1840184848 BMTQWRILZNTZMH-GRSYGWAWSA-N 488.610 0.704 50 20 JCGD C/C(=C\c1cccnc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185222 MNGDCAOPMCPVOP-PZSRYKBRSA-N 459.547 0.314 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1 1840187389 WZJHSUPKHSYBKP-DEOSSOPVSA-N 458.559 0.231 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187402 YEVRLTGEXZWFPE-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)n1 1840188380 GNEQOGUVDYCHHK-LJQANCHMSA-N 461.346 0.547 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H](C[C@@H]2CCOC2)NC(=O)OC(C)(C)C)C1 1843422970 CGYLJUAZMDYYAY-ROUUACIJSA-N 495.621 0.883 50 20 JCGD CC(C)N(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1)C(=O)OC(C)(C)C 1847328220 LKPUDWVAVVWZRE-OALUTQOASA-N 459.352 0.827 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2c(C)nc3ccccn23)c1 15668045 UUQZIYHKWLASTO-UHFFFAOYSA-N 460.516 0.296 50 20 JCGD O=C(CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)Cn1cnnn1 726070227 DYAYARVJTJBKET-UHFFFAOYSA-N 463.907 0.365 50 20 JCGD O=C(NCc1nccn1C(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 726710195 UTMGJQLHCUETSO-UHFFFAOYSA-N 458.447 0.443 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCN3C(=O)[C@@H]4CCCC[C@H]4C3=O)cc2)CC1 728214105 XZIMQAOMCACBTO-RTBURBONSA-N 477.587 0.631 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1 728306637 JEXYJZOLHARLET-UHFFFAOYSA-N 471.586 0.723 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1 728342498 GUTJVRZKFIQQPL-UWVAXJGDSA-N 499.476 0.289 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 729275290 MZOYRDHQRYOYMZ-JTQLQIEISA-N 481.453 0.915 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccc(C#N)cn1)N(S(C)(=O)=O)CC2 730830172 MZRJXMJJNXEARD-KRWDZBQOSA-N 473.511 0.681 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1 748214628 UQSHCPMMXJJQMB-UHFFFAOYSA-N 483.529 0.754 50 20 JCGD CC(C)[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)C(=O)N1CCCC1 748245964 AOZHHJIKQVSSEE-AWEZNQCLSA-N 475.365 0.522 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1)C(=O)N1CCCC1 748246662 FRPMCHSUIFFLKV-LLVKDONJSA-N 493.405 0.681 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2F)CC1 751206722 MCKWYJHJSMSDNT-UHFFFAOYSA-N 452.464 0.397 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NCCC#N)cc2)n1 762023123 JZYYKSGJPDVIFA-UHFFFAOYSA-N 465.513 0.190 50 20 JCGD O=C(CSc1nnc(N2CCOCC2)n1C[C@H]1CCCO1)NNC(=O)c1cccs1 827873120 OLWODXDUWCEAMU-CYBMUJFWSA-N 452.562 0.909 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 871018536 AQRJPAZNIZREOI-LBPRGKRZSA-N 487.332 0.141 50 20 JCGD O=C(NNC(=O)c1ccccc1-n1cnnn1)c1cccc(S(=O)(=O)N2CCCCC2)c1 912643195 HQHHFTYGVWOJST-UHFFFAOYSA-N 455.500 0.912 50 20 JCGD O=C(CN1CCN(CC(=O)N2CCc3ccccc32)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 917125587 MGQRGAIUXWKZQG-UHFFFAOYSA-N 466.498 0.563 50 20 JCGD CSCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])o1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 919809981 PGTVTBWEXLUQJN-LLVKDONJSA-N 498.543 0.794 50 20 JCGD C[C@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1)c1ccccc1 919885409 OYSXEYOJAHRSIM-YOEHRIQHSA-N 480.568 0.857 50 20 JCGD COc1cccc(NC(=O)COc2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)c1 919885550 LOPWOFQECLTSTC-INIZCTEOSA-N 476.511 0.844 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1)N[C@H]1CCS(=O)(=O)C1 919889892 WFLGNNOKYSVTRX-NSHDSACASA-N 450.564 0.054 50 20 JCGD CC(C)CN1C(=O)/C(=C/NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C(=O)NC1=S 920976552 XLONAXTVXUPSCY-LFIBNONCSA-N 479.584 0.489 50 20 JCGD O=C(NNC(=O)[C@@H](Cc1ccccc1)NC(=O)c1cccnc1)c1ccc(-n2cnnn2)cc1 921303334 ZJEGVBGLIHTVTK-HXUWFJFHSA-N 456.466 0.860 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)NCC1CC1 1317993922 HHTBGHMSZSAMSY-AWEZNQCLSA-N 475.365 0.723 50 20 JCGD CC(=O)O[C@H](C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1)C(C)C 1778797576 USGUTUBOJVQTMA-KNUAZTGGSA-N 461.519 0.538 50 20 JCGD Cc1cc2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)[nH]c2cc1C 1778925161 SWYCMOIJSATVQH-DEOSSOPVSA-N 477.525 0.936 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032633 PLZXXPOODACRIS-QFIPXVFZSA-N 476.534 0.042 50 20 JCGD Cc1nc[nH]c1CSCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032809 ZRWUANQNIFWNEH-OAQYLSRUSA-N 473.559 0.094 50 20 JCGD Cc1nc2sccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779155268 YCHANQWJSASVQT-WZONZLPQSA-N 482.371 0.825 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1780292998 SURFNRXNXQSTLN-DEOSSOPVSA-N 475.509 0.833 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)CCO2)NC(=O)NCc1ccccc1 1780969038 SYNRSBMQFLEJGM-HSZRJFAPSA-N 499.528 0.713 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2)C1 1781355422 NCCTZBDFGXOWOT-IQUTYRLHSA-N 478.384 0.875 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](CC3CC3)NC(=O)OC(C)(C)C)C2)C1 1783773397 DTVWMJMUGIWHDX-HOYKHHGWSA-N 495.621 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1CCN(Cc3ccccn3)CC1)CCO2 1783935677 BSAMTZXEVGBYIT-VWLOTQADSA-N 486.617 0.497 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccnc3C(N)=O)C[C@@H]21 1783969528 HJNVFFDKRIULGQ-VOAKCMCISA-N 454.325 0.200 50 20 JCGD O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21 1786406087 HTBYVFFGGBQSEC-YDHLFZDLSA-N 464.320 0.468 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(Cl)cccn34)C[C@@H]21)c1ccc(B(O)O)cc1 1786979750 DQSNEJRHBAHPFF-KNBMTAEXSA-N 482.733 0.575 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1 1787446106 WPMJCCAZYMGAGK-QNILMXGZSA-N 463.934 0.871 50 20 JCGD COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)n1 1787507089 WXJSUZUDEVQJCP-ZCQORZAUSA-N 482.541 0.746 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c4ncccc34)[C@H]2C1 1787877465 LZIRFSZWQQSCDA-AGRHKRQWSA-N 463.498 0.469 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607842 OCZPOIZUVYMGLV-NDXORKPFSA-N 468.558 0.856 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)NC=O)C[C@@H]21 1789221950 UIZORJODBVIQFX-DTPILHQWSA-N 462.459 0.248 50 20 JCGD Cc1c(Br)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)nn1C 1789361783 QAZLGGSDSYSSRJ-CYDGBPFRSA-N 463.760 0.684 50 20 JCGD COC(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)s1 1789690244 INWRVGMTMTURGW-XIRDDKMYSA-N 480.587 0.430 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc(C)c1C(=O)O 1790318764 CBDMJTSSROYOAV-WDSOQIARSA-N 474.558 0.968 50 20 JCGD CN(C)[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(Cl)cc1 1790674016 VMEGMRWWNLJIJJ-FDTGPBLFSA-N 499.804 0.916 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)CC1 1791292234 JQYNVBQBYVVWLC-FHWLQOOXSA-N 481.594 0.208 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1S 1792501032 XKDPZSCPLTWMEZ-LVTGYEAHSA-N 456.528 0.708 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1ccnn1)C2 1793882300 FZUMGOBICAZWJQ-IVSAIRAKSA-N 470.958 0.390 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(Cl)n1)C2 1797749790 SZDXMKBNENANSD-DBWKPXFBSA-N 458.906 0.179 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1799275443 XYABZHFCVUJKPQ-ZYYNGRNUSA-N 465.359 0.278 50 20 JCGD O=C1CCc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)nc2N1 1799346247 MDSZNEJDUIFRCL-JLUCKKNBSA-N 455.284 0.860 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799871528 MBOBVDQHIHGZOC-RSPOEFSDSA-N 487.605 0.678 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2 1800756359 BMLQAOLOPYAZEA-NQUGEPOWSA-N 469.336 0.366 50 20 JCGD CC(=O)NCC(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803718769 QXSLZLCPAUODJJ-XLIONFOSSA-N 481.557 0.562 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1 1804044093 VVNDRHZBEIVUBD-HOCLYGCPSA-N 497.210 0.436 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)n1cccc1C=O 1807366524 ZPOBEUDEVWOMEX-LLBVYWAGSA-N 474.326 0.956 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnnc(Cl)c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369380 IFJDRGCASQTUPC-OXQOHEQNSA-N 465.706 0.838 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373769 GASPULVUKSYBAE-IHPCNDPISA-N 457.361 0.195 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)no1 1808388795 NUBPBVMNXPPZGY-FDDCHVKYSA-N 491.313 0.406 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810294071 HYIFYGWPPDXFJH-PGRDOPGGSA-N 476.541 0.913 50 20 JCGD C#CCO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810295671 VCDZCNUYKMRASA-SYNHAJSKSA-N 450.499 0.438 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CNC(=O)c2cccs2)[C@H]1c1cccnc1 1813071925 ZOMYXPJIWYWFLK-JTSKRJEESA-N 486.598 0.952 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1COc3ccccc3O1)CC2)c1ccc(B(O)O)cc1 1815336700 AGOHTGKUGRLWRK-BEFAXECRSA-N 479.323 0.889 50 20 JCGD COc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c(F)c1 1815337480 SRCSDKGDNPHRHY-CYBMUJFWSA-N 470.291 0.905 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337993 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COCCn1nccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059286 KKBJKGZPTVGHFW-NRFANRHFSA-N 468.363 0.756 50 20 JCGD CN(C)C(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828550828 CWGANJSWQPRNRJ-HTAPYJJXSA-N 480.949 0.126 50 20 JCGD O=C1CCCc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc21 1830728020 NDRBOABOVLJOKW-SIKLNZKXSA-N 450.919 0.875 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830737348 DMODHSBUHVDZRA-XLIONFOSSA-N 474.341 0.968 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(C)n3)CCO2)C1 1830917343 MXFJEOHVMGXTLC-JZZXMACJSA-N 482.541 0.523 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1832545263 NJIASJYPTOLVQA-VGOFRKELSA-N 487.981 0.610 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833313835 VEFHWVNIKJALSY-OXQOHEQNSA-N 464.994 0.976 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cccn(C(F)F)c3=O)CC2)CC1 1835858903 SMLJKSSCICBXFF-UHFFFAOYSA-N 496.559 0.802 50 20 JCGD CC(C)c1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835932078 MSYPNVPHWUZDPP-SANMLTNESA-N 480.370 0.803 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1 1835936790 DMGZLWSSTDXJRQ-RUZDIDTESA-N 475.310 0.298 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835940160 XDRJJDBAXZUAFS-CJAUYULYSA-N 484.333 0.454 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2 1836716090 MGLDUBCSMJVLME-FOGHPNEFSA-N 485.463 0.919 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3c3ccc(F)cc3)C2)C1 1837456722 PYVNXKLQAQLPLL-RNHFSVANSA-N 497.527 0.698 50 20 JCGD Cc1ccccc1OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457446 CBHQVTKDYLDMFU-DEOSSOPVSA-N 483.525 0.143 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1 1837460352 CNJLDTBEKTUNDV-DFIYOIEZSA-N 479.537 0.559 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)nc1)CCO2 1837843673 SWLHJQVTJUVVDB-QVGKIPNLSA-N 472.477 0.425 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4snnc4c3)CCO2)C1 1838513496 VKOLPLGDKVWTRJ-APPDUMDISA-N 470.349 0.940 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1C 1838988809 PQTVXSGGVBBWMN-HSZRJFAPSA-N 462.547 0.447 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)C1 1839144829 LMMUTVJKZYMSIQ-AVYPCKFXSA-N 463.959 0.346 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199433 WKCJODSFYXKJKS-DOTOQJQBSA-N 452.321 0.440 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCOCCOCCOC)C2)C1 1839966517 HYDVGQVHRZIECN-FXAWDEMLSA-N 495.411 0.686 50 20 JCGD COC(=O)C12CC(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)(C1)C2 1840006113 OOHCSZWDRJCDPB-IMBJVDQRSA-N 463.300 0.477 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(F)cc3)CCO2)C1 1840054377 UTZGECSBWZEFOC-XMMPIXPASA-N 485.516 0.527 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccccc1)CCO2 1840121243 LPEQWUNSSGPWHJ-REHUZNOOSA-N 458.559 0.620 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(Cl)ccc3F)C2)C1 1840183507 IHWAILMTALHZSV-HXUWFJFHSA-N 471.917 0.317 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CN2CCS(=O)(=O)CC2)C1 1841894945 UQFGVUKCGPSBIC-LICLKQGHSA-N 478.521 0.806 50 20 JCGD Cc1ccn(CC(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)n1 1845038492 IWDXHWLTBJCQII-UHFFFAOYSA-N 453.547 0.741 50 20 JCGD O=C(C[C@H]1SC(N2CCCCC2)=NC1=O)Nc1cccc(C(=O)NNC(=O)c2cnn[nH]2)c1 729456916 OIVJJOIFADOUOO-OAHLLOKOSA-N 470.515 0.692 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1cccc2cccnc12 747429163 ZAGAMPCOXIIUKZ-GOSISDBHSA-N 490.563 0.778 50 20 JCGD CC(C)CC(=O)N1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1 749197364 GCPJXFROQWEAEJ-UHFFFAOYSA-N 453.565 0.918 50 20 JCGD NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 749405598 YHARTFXLYCDKPS-UHFFFAOYSA-N 466.541 0.334 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2cc(=O)n(CC(C)C)[nH]2)c1 750871927 IDLDNLDKJXPGPQ-UHFFFAOYSA-N 451.549 0.867 50 20 JCGD CN(C)C(=O)CN1C(=O)C(=NNC(=O)CNC(=O)c2ccco2)c2cc(Br)ccc21 750937573 VERCXMDXQMJOEH-UHFFFAOYSA-N 476.287 0.727 50 20 JCGD N#Cc1cccc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1 769743191 LYSNBVVECWLUGY-UHFFFAOYSA-N 450.860 0.494 50 20 JCGD CC(C)N(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 811848580 LHRRJEILDOTYAU-LJQANCHMSA-N 491.522 0.860 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 915880602 MWTJCKJYUQYKPN-AWEZNQCLSA-N 482.540 0.627 50 20 JCGD O=C(CNC(=O)c1ccc(Br)s1)NNC(=O)c1csc(N2CCOCC2)n1 916734364 CONNJPBWGIZFSV-UHFFFAOYSA-N 474.362 0.995 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC(=O)N(C)Cc3ccccc3)nc2)CC1 918089869 HUYMKBJJUWNXDF-UHFFFAOYSA-N 475.575 0.302 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc(Cl)cc3O)cc2)CCN1 918359202 PPIUUKBZMCTYCR-UHFFFAOYSA-N 452.876 0.241 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cc(OC)c1OC 919822363 PBFKOISLMHGKEY-UHFFFAOYSA-N 493.538 0.737 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCCCC2)cc1)N[C@H]1CCS(=O)(=O)C1 919883258 BOYBLVBHHSQBGC-HNNXBMFYSA-N 458.562 0.382 50 20 JCGD Cc1ccc(C)n1-c1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cnn1C 920410350 XUQANUYVVNVGAT-GOSISDBHSA-N 453.455 0.972 50 20 JCGD NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)NCCc2cccs2)c1 920861302 RFRRDYJBBDCMPF-UHFFFAOYSA-N 453.546 0.419 50 20 JCGD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1 921017605 OZZSMMUXBAMWBL-RUDMXATFSA-N 488.482 0.489 50 20 JCGD Cc1cc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccn1 1779028236 HUPMSRNWMHFIML-HSZRJFAPSA-N 452.515 0.465 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc[nH]c3nccc1-3)C2 1779373406 PBYUHCRGVMOPNC-NTKDMRAZSA-N 477.525 0.954 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccn1 1780323917 SVSHHSLIAYOUEM-JOCHJYFZSA-N 461.519 0.075 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(O)cc([N+](=O)[O-])c1 1781095781 JDLCOJPABGOFAT-NFBKMPQASA-N 483.286 0.422 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1)[C@H]1SC(=N)NC1=O 1781331752 VNCXBZZXHKCTRK-OFYUCFFLSA-N 451.318 0.309 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1 1782210485 WLZXJTLUZOQITI-WNOPAQSVSA-N 476.574 0.616 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1 1782268256 YDEIWDQXKMVBEA-JOCHJYFZSA-N 456.503 0.152 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1783321752 ASTGJPBGQFHJTP-QMHKHESXSA-N 453.499 0.596 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1c(Cl)cncc1Cl 1783423739 LQNCNVSHKZDOTQ-YEWWUXTCSA-N 478.141 0.975 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2)C1 1783534669 NDGHWLRADHGASX-FHSNZYRGSA-N 464.357 0.485 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)CCO2)C1 1783880438 INSJXNIYVAEWGF-AUSJPIAWSA-N 463.959 0.346 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1 1783882032 PISUNKUWABBOKY-BFUOFWGJSA-N 454.936 0.823 50 20 JCGD CCc1c(Br)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)nn1C 1783933924 NFHNQSVSNOYDQY-HXUWFJFHSA-N 499.410 0.562 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C[C@@H]21 1783965318 HWBQJZGEOIKTGT-QXKUPLGCSA-N 492.411 0.883 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@]3(O)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1784011182 ONIWDNPCWIACLS-ONGXBYRLSA-N 475.970 0.442 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(Cl)cncc3Cl)C[C@@H]21)c1cccc(B(O)O)c1 1786981879 DTIMNWYIEZABMO-YEWWUXTCSA-N 478.141 0.975 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc(OC)c1C 1792045807 IJNMNXQTPLHJLE-OHEPNIRZSA-N 497.552 0.918 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)[C@H](O)C1 1792453918 XPMDFIKUJWXTCT-ZQNQSHIBSA-N 480.389 0.998 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C1 1793112550 RFRMJEOBCDRCRM-IZKTWJBDSA-N 459.971 0.842 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1nc(-c2ccccc2)ns1 1795919405 BCVDNOMYJIAWFJ-IZZQQSIFSA-N 478.339 0.402 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C)NC(=O)NCc1ccccc1 1797956160 GAGRZCCSFNPEPR-HATOLVCRSA-N 491.665 0.774 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)C2 1799264860 ZIGPEHLOMFVHBE-QOIOWGMHSA-N 463.966 0.629 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)NC(=O)OC(C)(C)C 1799680127 KTKHTMYVGABDLM-VVSAWPALSA-N 464.357 0.450 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1NC(=O)C2 1800028551 VPQCVFBZZQOXJL-UIZNVDRRSA-N 478.509 0.518 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1 1801014127 HAQQWQIYTAOKBT-USGNIVHTSA-N 479.965 0.875 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@@H]1c1cccnc1 1803997371 DCIVCSZFEUOEKR-DKSSEZFCSA-N 459.469 0.774 50 20 JCGD O=C(CCC(=O)N1CCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804148690 AXXWKRJLXGNDHU-YKSBVNFPSA-N 478.358 0.484 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1804190409 GATMRVKXTDKLIY-GHJWDPDVSA-N 452.309 0.423 50 20 JCGD COc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1805599540 FIMGACCOYUVPML-RXVVDRJESA-N 460.299 0.798 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369790 VVWXKRNLZBSCNP-DYESRHJHSA-N 479.277 0.491 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2n[nH]c3c2CS(=O)(=O)C3)[C@H]1c1cccnc1 1807742547 KRGBQUMSNVLCOG-DHSIGJKJSA-N 481.962 0.807 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1[nH]nc2ncccc12 1808106961 MJCSNLYGCTYKJQ-DYESRHJHSA-N 470.298 0.666 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)nc(O)n2)[C@H]1c1cccnc1 1808416661 CMUAUWKNDVRORN-WTBDCCNDSA-N 492.496 0.736 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1 1814564456 MJOBMSUWOLXWPB-JUCPORTRSA-N 473.559 0.521 50 20 JCGD COc1nccnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817473122 GWLHPFLUIAHJDB-INIZCTEOSA-N 450.264 0.508 50 20 JCGD COC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cn1 1817536845 HDNOXAUVOWJJSF-OAHLLOKOSA-N 480.311 0.544 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819404760 XTLGZQKKZOUEMU-MRXNPFEDSA-N 471.522 0.087 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1821661540 OAQLNSPWWPEWIO-MAUKXSAKSA-N 484.561 0.988 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822780975 JECVKOSTJQWIPR-HNAYVOBHSA-N 450.308 0.928 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)N1CCOCC1)CC2)[C@H](F)Br 1823007253 LLBTTWHCUUGSPF-FDLBOYPASA-N 451.318 0.396 50 20 JCGD CCOC(=O)C(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1823483265 LBMKTLXPMNKGBA-QGZVFWFLSA-N 456.308 0.985 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1 1826873315 OXSPGGVVZKMERA-UQJRAWQTSA-N 469.531 0.871 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924278 OILMIMZWXOWPLS-OXJNMPFZSA-N 468.562 0.846 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828926515 MASBQCLPCLFNFY-MSOLQXFVSA-N 459.551 0.365 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)no1 1828988811 WFNFDVCMZYFPSI-IBGZPJMESA-N 476.578 0.706 50 20 JCGD CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737655 HTOGLRGGLMNXQX-DRSNIGMVSA-N 492.013 0.982 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)C(=O)c3ccccc3)CCO2)C1 1831151322 ZQWKZWKQWOKDOA-PGRDOPGGSA-N 467.950 0.469 50 20 JCGD O=C(NCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)c1cccs1 1833308285 PJZBQCZADQOXMC-MRXNPFEDSA-N 456.996 0.649 50 20 JCGD Cc1ncsc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834222959 HXQQIEUVEGXGLX-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1834556370 FZUXZMNJEVIESM-QFIPXVFZSA-N 488.932 0.426 50 20 JCGD CN(C)c1cncc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834797279 BPIJCGRBBBDWOX-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799094 NUVYDDRZQXTTGQ-GOSISDBHSA-N 467.379 0.084 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1834823376 QQQPRUJWAHDSNQ-CQSZACIVSA-N 461.231 0.333 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](C)Br)CC3)CC2)CC1 1835513369 YEHPUCMYSSPSRR-INIZCTEOSA-N 486.455 0.506 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)oc2ccccc12 1835930446 IQXXVZNYWZFHCA-RUZDIDTESA-N 478.310 0.805 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@]3(F)CCCCC3(F)F)C2)C1 1835937451 XNIPLXAIEGUFAZ-LEWJYISDSA-N 484.280 0.354 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)C2)C1 1835938566 YYVGLBUOLNYHKV-WTEVXDJOSA-N 494.378 0.324 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836718484 ZAIWMVHIZXAOHO-ZWKOTPCHSA-N 492.013 0.860 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3ccc(F)cc13)CCO2 1837042448 VLWVKZYWEVRIFN-QHCPKHFHSA-N 497.487 0.084 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4sccc4[nH]3)CCO2)C1 1837131545 NGFFOOZTBLUIBR-JOCHJYFZSA-N 484.538 0.612 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccoc4cn3)C2)C1 1837460238 XYDWTLTUFUMNAV-HSZRJFAPSA-N 480.481 0.210 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n1 1837659183 SWHQBECMZLUICX-QRWLVFNGSA-N 485.379 0.527 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1 1837920033 DUGGYMXFAUBCHR-PZJWPPBQSA-N 497.401 0.380 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCNC3=N)C2)C1 1839743265 HCNGCURJJWNRNT-VAPFXODJSA-N 488.495 0.168 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1839780112 ZIHXTVDWFDAGIT-CKEIUWERSA-N 467.382 0.051 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840142961 FIDIWVNZWPIJGJ-QCUYGVNKSA-N 477.327 0.889 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccccc3)C2)C1 1840156271 MEJIBILHHOCVRG-AVRDEDQJSA-N 467.950 0.517 50 20 JCGD COc1ccccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840182636 ORBAPLXFYRLGAT-XMMPIXPASA-N 476.574 0.457 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4c(F)cc(F)cc4[nH]3)C2)C1 1840184609 XEPMIOFGCYNHDJ-HSZRJFAPSA-N 493.511 0.889 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)s1 1840185114 LKQKOMGDPJXBCT-KOXUSJRISA-N 465.576 0.294 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CC#N)cc3)C2)C1 1840185149 KMHMKRRSAXPJJY-QHCPKHFHSA-N 457.531 0.196 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840277345 XAGLPMWHQPFUKU-HOIFWPIMSA-N 489.997 0.690 50 20 JCGD CCn1nnc2c1[C@H](C(=O)N1CCCC13CN(C(=O)[C@@H](O)CCl)C3)CN(C(=O)OC(C)(C)C)C2 1842055980 GSLGNQYMTGJFOM-ZBFHGGJFSA-N 496.996 0.935 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1 1844264908 XEKIVAQFAMOCJD-UHFFFAOYSA-N 452.471 0.994 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ncn(-c2cccc(F)c2)n1 1848311138 YJSASGYKASCEDQ-ROUUACIJSA-N 464.461 0.534 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(=O)N(C)CCc2ccccn2)c1 727608473 UBCJAWUGSQMFHD-UHFFFAOYSA-N 490.586 0.757 50 20 JCGD O=C(Cc1cccnc1)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1 728855017 CEMLPNOBRAKUNZ-UHFFFAOYSA-N 460.512 0.644 50 20 JCGD O=C(CNC(=O)c1ccc(Br)o1)NNC(=O)C1CCN(c2ncccn2)CC1 728980998 KOARVHPJULFVHN-UHFFFAOYSA-N 451.281 0.626 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](C)[C@@H](C)N2CCOCC2)c1 729623365 KMPIDQFSERPBNP-HZPDHXFCSA-N 455.581 0.770 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2(N3CCCC3)CCOCC2)cc1 729624474 WXASYCSRGRJQLS-UHFFFAOYSA-N 467.592 0.591 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCCc1nccs1)N(S(C)(=O)=O)CC2 747987973 ZSINVJOREURCGD-HNNXBMFYSA-N 497.599 0.982 50 20 JCGD CCc1ccc(C(=O)NNC(=O)[C@H](CCC(N)=O)NS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 769111023 YZHHRFQXZQILKA-KRWDZBQOSA-N 490.538 0.394 50 20 JCGD O=C(COC(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O)NNC(=O)[C@@H]1COc2ccccc2O1 784364335 DAOFFHYDGCNPGV-VBQJREDUSA-N 459.455 0.082 50 20 JCGD CCCc1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1 807135265 IXIHPWKEOVJOJV-UHFFFAOYSA-N 498.569 0.976 50 20 JCGD O=C(Cn1cncn1)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 849203002 DGKQJTXYZXBDNW-UHFFFAOYSA-N 483.554 0.246 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(S(=O)(=O)N(C)C)CC1 914531167 XECXFTNKCAPJNR-GFCCVEGCSA-N 478.369 0.381 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1 915596424 OBCNBFDGYKMXJV-UHFFFAOYSA-N 482.540 0.178 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)cc1 916253922 SRXKBQRKBNFVNW-UHFFFAOYSA-N 489.620 0.198 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)cc1 916258265 PYIRSRFQUWPOKC-IBGZPJMESA-N 468.624 0.218 50 20 JCGD CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 916486204 BZCKVWZQINVGPO-UHFFFAOYSA-N 497.599 0.768 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1nncn1C 916580675 PHLAAKJOTIACNS-CQSZACIVSA-N 457.516 0.999 50 20 JCGD COc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N1CCCCCC1 919886938 XWFLREMUUWEOFB-OAHLLOKOSA-N 488.588 0.391 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ccccn34)C2)C1 1777821030 DXXHTNFLTNSWLG-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD CC(=O)NCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778094136 BIRUGNJMTPWUNU-GULKHOJOSA-N 460.535 0.161 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)[C@H](Br)Cc3ccccc3)CCO2)C1 1778788686 JCZFFCAKAHUWPH-CBGDNZLLSA-N 498.374 0.887 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1 1779032022 KINSQSDBUGWVIA-NRFANRHFSA-N 484.904 0.139 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3O1)CCO2 1779032646 VWIAHYURZKQQSG-CVDCTZTESA-N 451.483 0.132 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1[N+](=O)[O-] 1779036003 SWYBINLAAAIWQI-JOCHJYFZSA-N 484.469 0.359 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1779382044 DFUXECXAOKBBDJ-HXPMCKFVSA-N 486.913 0.894 50 20 JCGD CC(C)(C)OC(=O)N1CCn2c(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cnc2C1 1779950232 ZCHWPDNWKQBBJX-AOMKIAJQSA-N 497.980 0.677 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn(C(C)(C)C)nn2)C1 1780194635 AANTWHSRQBTPJN-VGOFRKELSA-N 463.583 0.534 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1 1782218103 SUCJXWXBSLULMU-PMUMKWKESA-N 453.319 0.799 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)C1 1784080295 BZTYLBGDIPNHMK-VJFFJZKOSA-N 487.557 0.689 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1 1784547709 SPMKCFAFUSOJGG-DANYPQMUSA-N 468.514 0.813 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccnc2ncccc12 1790401729 JHJHDAKKFXIOAY-NDXORKPFSA-N 460.299 0.217 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1792322901 PVBOFCIUJQUTDK-AJNGGQMLSA-N 463.934 0.525 50 20 JCGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1cncn1 1793882273 CQOLUOFTMQOCQB-QMHWVQJVSA-N 470.958 0.561 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(F)CCCCC1(F)F)C2)c1cccc(B(O)O)c1 1795738977 KOKCWYKWBMTERR-MQJTVSLUSA-N 454.254 0.487 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)n(-c2cccc(=O)n2C)n1 1795934403 MPQFQOZVCPQGPV-BKEDOTJMSA-N 492.374 0.866 50 20 JCGD COC(=O)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1 1796190648 UPQHOGFAHXPQRY-WKCHPHFGSA-N 450.300 0.648 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1n[nH]c2c1CCc1ncccc1-2 1796191922 PWNQRYKGWOHLCH-BCDXTJNWSA-N 471.326 0.816 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1C(C)C)C2 1796445622 GHXWXDAKQFXFDQ-LVPMTATBSA-N 458.563 0.583 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(n1)NC(=O)CC3)C2 1798440226 HRSCWGTTZVQJHB-QDMKHBRRSA-N 463.498 0.530 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798521365 DQAWYMHUVYYFEG-BAAGSCJXSA-N 476.486 0.638 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccn(-c2ccccc2)n1 1798698877 NIJSAHZIKLFTQL-OPMZPASUSA-N 460.299 0.069 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncs1)C2)NC(=O)NCc1ccccc1 1799094742 ICZIGTJSWPJJSW-XEMDLRDOSA-N 472.571 0.693 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCN(C)C2 1800129488 DGZBAURLULCQLB-VWPFQQQWSA-N 454.369 0.705 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802344018 MWLORJVIQSEEOL-MHORFTMASA-N 463.579 0.914 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnnc(Cl)c1 1804720446 DBKJLJKEMPDQKZ-JXFKEZNVSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C/N=C/c2ccco2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361791 UEWPCKXGIFYIHR-ZWWUYNHISA-N 460.299 0.793 50 20 JCGD COCc1c[nH]c(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1 1807362345 VIIZGRCJYGUXTM-DENIHFKCSA-N 462.315 0.869 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1 1807362405 VNPMOOJHHGHCCQ-GCJKJVERSA-N 476.298 0.946 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])o2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807364011 GVZMPWNVNYWCHE-JXFKEZNVSA-N 464.243 0.896 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371336 SVMFUURJYVXBBZ-UTKZUKDTSA-N 467.722 0.631 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807997682 CVNIXVGUXVFQLW-VFNWGFHPSA-N 456.503 0.580 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cnn4c3OCCC4)CC2)C1 1809973395 JRALNBWPCDLUKU-UHFFFAOYSA-N 452.320 0.504 50 20 JCGD Cc1cnn(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1 1810303616 SYHMQWPVARZYAX-UWJYYQICSA-N 462.514 0.605 50 20 JCGD Cc1nc(N)sc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1815142168 YTQOMQNZRVDFJF-GFCCVEGCSA-N 457.346 0.710 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339559 HBIAAPXZLOPVJT-BBRMVZONSA-N 465.344 0.944 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nc3ncccc13)CC2)c1cccc(B(O)O)c1 1815355004 YUNLPAUPRABZOB-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)cn1 1816095082 YJVJFUOLDBPKDS-FZMZJTMJSA-N 472.976 0.908 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nc3ncccn3n2)n[nH]1 1818618748 QTPSVZWJHPFMLU-HNNXBMFYSA-N 475.473 0.466 50 20 JCGD Cc1nnc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)o1 1827117164 NZSMKKONNSHASO-GOSISDBHSA-N 455.519 0.853 50 20 JCGD CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1828825841 BNYOGXAVOWTAKU-RUZDIDTESA-N 479.342 0.842 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)C(F)(F)F)CC1 1828925889 SMVSYAWEOTUGJM-MRXNPFEDSA-N 484.479 0.597 50 20 JCGD CCOc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1 1830543664 XRCAJDSWHWUQTE-LIRRHRJNSA-N 471.352 0.976 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830732144 VLGCLQRBPUFJFR-CKJXQJPGSA-N 475.970 0.300 50 20 JCGD O=C(Nc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1)C1CC1 1830733280 HLKYPQBZEMXKTA-PGRDOPGGSA-N 465.934 0.705 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1833094896 IQKXMYSXYIBJKX-HXLYRSSUSA-N 487.605 0.607 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)s3)CCO2)C1 1834058437 SRQZPDQLEJGHHQ-HXUWFJFHSA-N 479.946 0.784 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CNCP(=O)(O)O)CC2)CC1 1834666512 NOROOBXPNIXJKF-UHFFFAOYSA-N 464.576 0.134 50 20 JCGD O=C(CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2)N1CCCC1 1834818771 DXUZOXVVSQODRA-IBGZPJMESA-N 460.369 0.630 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835116739 ZHANBTMNPAWMNR-TXMABLNQSA-N 487.605 0.607 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)n1ccnc1 1835734921 YCPXWRNZXHQMQF-INIZCTEOSA-N 468.562 0.328 50 20 JCGD C[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)Oc1ccccc1 1835931990 KGDVQWZZBOIZLI-CLOONOSVSA-N 482.342 0.294 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nc[nH]n1)CCO2 1836354010 UBSGOTMPTMGKDG-JMDQKNPTSA-N 458.425 0.760 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919148 JTGMGDYPGHLDEQ-UHFFFAOYSA-N 480.330 0.012 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cn2[nH]cnc(=O)c12 1838472478 MKBZJYDRZKDZOH-GOSISDBHSA-N 458.302 0.205 50 20 JCGD O=C(C1CCN(c2ccccn2)CC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839050670 JEIZDEKKVXQNNQ-PGRDOPGGSA-N 466.966 0.354 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)ccc1Cl)CCO2 1839326029 DWBLOAGJWMRIES-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839649613 ZIGMKUMGIPLYJC-IFXJQAMLSA-N 471.352 0.602 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(N)=O)C2)C1 1839744178 SRGXXZQRIOMQSL-KYIYGJGQSA-N 462.453 0.594 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839764890 NRTYGSCRALWIEC-BVZFJXPGSA-N 484.333 0.454 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)C2)C1 1840184850 BMTQWRILZNTZMH-JTOYRKQZSA-N 488.610 0.704 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ccoc4c3)C2)C1 1840185481 RORSDHXHMMLXCC-QHCPKHFHSA-N 458.515 0.876 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1 1840906174 XLGNDISVYGQMQI-FQEVSTJZSA-N 458.342 0.985 50 20 JCGD O=C(c1ccc(N2CCCOC2=O)cc1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014609 FQZSVPAYUJLULE-UHFFFAOYSA-N 463.299 0.844 50 20 JCGD O=C(C[C@H]1CCS(=O)(=O)C1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 10105267 XBLDGENNYYKPLK-MRXNPFEDSA-N 465.553 0.751 50 20 JCGD O=C(COC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NNC(=O)c1ccc(Cl)cc1 10733863 HCJQMDCJFOBLFS-UHFFFAOYSA-N 481.914 0.979 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2C)cc1 13028814 SUFLVXFCZZNVDZ-UHFFFAOYSA-N 455.514 0.632 50 20 JCGD CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)c1n[nH]c(=O)c3ccccc13)n2C 17195873 UDIYFHSIJYGBLF-UHFFFAOYSA-N 497.537 0.454 50 20 JCGD CCN(CC)C(=O)CSc1nnc(SCC(=O)NNC(=O)c2ccc(F)cc2)n1N 22533074 GSOJGEXQUAPEOK-UHFFFAOYSA-N 455.541 0.645 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc2c(c1)CCC2)NNC(=O)c1cccs1 725996018 ANUIVVQOCDDFKH-SJORKVTESA-N 457.508 0.817 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3nc(-c4ccncc4)no3)CC2)cc1 728071243 YLXFWCXLTQIDPK-UHFFFAOYSA-N 457.516 0.890 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)COc2ccccc2O)C1 730778724 UHKGYADBGRXDNP-AWEZNQCLSA-N 451.505 0.359 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)s2)ccc1Cl 749838603 RDQPERRCRRIKGT-UHFFFAOYSA-N 487.368 0.442 50 20 JCGD COc1cc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(F)c2)cc(OC)c1OC 751266832 LKWVYISIFUJKCC-UHFFFAOYSA-N 458.420 0.938 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)n1 760649103 QMGBVJDQYDSVGT-UHFFFAOYSA-N 479.540 0.204 50 20 JCGD COCCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 811835924 VGTZOQMVPXKDML-UHFFFAOYSA-N 469.903 0.883 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)cc1OC 859319980 DVBUJVKAMYSKHU-UHFFFAOYSA-N 479.511 0.808 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(=O)n(Cc3ccccc3)n2)c1 873767233 AQLXVKCFJNYCNO-UHFFFAOYSA-N 455.496 0.617 50 20 JCGD O=C(NNC(=O)C1CCN(C(=O)N2CCCC2)CC1)c1cccc(S(=O)(=O)N2CCOCC2)c1 915635324 IEPZDAPJRGRHDJ-UHFFFAOYSA-N 493.586 0.396 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cn[nH]c1)c(=O)n2Cc1ccccc1 916147901 MYVJFQOSEIWVMG-UHFFFAOYSA-N 464.486 0.248 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nccn3c2)C1 1778704037 COPSXVFKVRTKMS-WZONZLPQSA-N 456.547 0.835 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cccc1C=O 1779030759 HPLXPXBUJMAULD-QRQCRPRQSA-N 454.487 0.004 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccn2ccnc2c1 1779042653 RXDLWRGULCZKMC-HYBUGGRVSA-N 462.315 0.455 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CN3CCCC3=O)CCO2)C1 1780097337 XZOFVQHBRXIIHG-JOCHJYFZSA-N 474.470 0.586 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3nccn23)C1 1781316153 HAKVUEWNEJQUHJ-WZONZLPQSA-N 456.547 0.835 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1 1781769650 BXVHJIVKOWLLQV-OAQYLSRUSA-N 457.223 0.171 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c1NC(=O)C3)C2 1782213452 UAXAZEFHEWROJK-HOYKHHGWSA-N 471.558 0.682 50 20 JCGD CC(C)C(=O)Nc1nc(O)c2ncn(CC(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](F)Cl)CCO4)c2n1 1782885715 KLENDDRDQBDQRF-XOBRGWDASA-N 497.915 0.491 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)COc1cccc(Cl)c1)CCO2 1783933121 QXVHLAYXBYVMMZ-OAQYLSRUSA-N 452.939 0.922 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936154 DQQNOGTXTRMRPR-QVKFZJNVSA-N 455.556 0.103 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)ccc1C 1786981773 KSUSFYWKEFSLGZ-RRPUWOKSSA-N 479.342 0.540 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ncccc34)C[C@@H]21 1787508557 AIADHJHMACWKHW-KUCAILFGSA-N 478.513 0.685 50 20 JCGD CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)no1 1787508661 NELDBKGHYXJGAS-MZONFKNFSA-N 456.503 0.964 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)[C@H]2C1 1788179186 UNVSUEGCMBFUOF-XWSJACJDSA-N 495.621 0.596 50 20 JCGD COc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)c1OC 1789411712 RDVHXPUJPZRHOZ-BRZMCFHBSA-N 498.540 0.826 50 20 JCGD O=C(Cc1c[nH]c2ccccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789748084 SRSPVBUFKXLTNT-HYVJGQCMSA-N 461.327 0.684 50 20 JCGD COc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)ccc(F)c1F 1790171907 DTYFWRXSTJSXCZ-FNHZYXHNSA-N 474.269 0.560 50 20 JCGD Cc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)c1F 1794478832 VSZOJHYARRQKQH-XEMDLRDOSA-N 487.536 0.407 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCOCC1 1795440460 HJXKMETVZWJBLJ-VPTLXERWSA-N 476.486 0.056 50 20 JCGD Cc1ccc(SCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1 1795734085 AYZIRRLGCAZYGR-OPMZPASUSA-N 454.357 0.670 50 20 JCGD CCc1c(Br)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)nn1C 1795952812 PJZDNIPXJLDMHZ-IQOUGMIPSA-N 463.760 0.548 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C\C(=O)NC1CC1 1797614717 NEOKTLYLOJZBSK-ZVDPXCMSSA-N 486.481 0.558 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)C1 1797680549 HBZZRRLBWKLWCN-IZKTWJBDSA-N 459.971 0.842 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)ccc1F 1799526541 GAKWJPZPMXICDC-NXTZLTDHSA-N 457.462 0.869 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnc3ncccn23)[C@H]1c1cccnc1 1809329825 LUFYEKDQMIJSKT-OXJNMPFZSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN2CCCCC2)[C@@H]1c1cccnc1 1810297759 DHOBNAMRLXBGNV-XMSQKQJNSA-N 465.558 0.886 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1n[nH]cc1[N+](=O)[O-] 1810632902 LBDUJVLWTHZSSH-HNAYVOBHSA-N 464.247 0.026 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1)C(Cl)Cl 1813075713 IKHOMENYJUOFMU-RISCZKNCSA-N 450.286 0.936 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819789938 AOYDZVGZMVMINV-BXUZGUMPSA-N 459.532 0.282 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nccc3nc[nH]c13)CC2 1819797144 NIUQDIDPDQJTBI-SNVBAGLBSA-N 477.510 0.953 50 20 JCGD Cc1cn(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c(=O)nc1O 1822417994 UAZLIGOLGNSHGW-HNNXBMFYSA-N 474.522 0.046 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1826726449 MAEBYQHTISBUNT-OAQYLSRUSA-N 464.655 0.617 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)[C@H]1SC(=N)NC1=O 1827059338 NCTBNHBBBZHCAE-GDIGMMSISA-N 486.403 0.402 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1 1827601220 LWEMHDFOILFZCS-KRWDZBQOSA-N 469.502 0.433 50 20 JCGD CN[C@@H](CC(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1)C(=O)O 1827680924 LATQGNPMESKXQB-USFCLMKFSA-N 474.562 0.803 50 20 JCGD N#CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1828806482 UXVWREBEZPMEQT-VWLOTQADSA-N 490.325 0.346 50 20 JCGD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)n1cncn1 1828925341 ITOFQWVZOBUAAT-HNAYVOBHSA-N 454.535 0.771 50 20 JCGD CNC(=S)NCCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1828929650 VSSOUSGQQXSGLY-SFHVURJKSA-N 475.619 0.402 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnncc2C(=O)O)CC1 1829254509 DLGAUUPYTFEOMH-LJQANCHMSA-N 481.513 0.720 50 20 JCGD CC(=O)NCCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829308843 QSOLZZOGSGIZQH-CVDCTZTESA-N 494.976 0.564 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@]2(C1)CN(C(=O)C1CC1)CCN2C(=O)OCc1ccccc1 1829443146 BMUOEDQYHCMFRG-SANMLTNESA-N 491.353 0.842 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(S(C)(=O)=O)c3)CCO2)C1 1830182000 DFNHGAIISKTWAB-XLIONFOSSA-N 474.963 0.414 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1830539578 ILQPJGFZVNVOFI-VBKZILBWSA-N 498.378 0.118 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2 1832231459 GXMVPHVFYYMHER-RBBKRZOGSA-N 450.511 0.527 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3csc(C)n3)CCO2)C1 1832967006 GMPCESKWHRBIJB-IBUSPFOHSA-N 488.570 0.584 50 20 JCGD O=C(CCc1cc(F)ccn1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833795082 KBBKNJDFBOSKGT-UHFFFAOYSA-N 482.365 0.719 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCC4)CC2)CC1)c1ccc(B(O)O)cc1 1834798626 SDCNLJFFSZDZAQ-UHFFFAOYSA-N 479.390 0.398 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1 1835844298 QVZJMGOUXJKNEL-XLIONFOSSA-N 465.422 0.945 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2)C1 1836473306 ALDUBEYFJBZYIZ-QEEYODRMSA-N 463.959 0.346 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837457800 RTRZXLOTMUVXFV-DEOSSOPVSA-N 483.525 0.006 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C3CCCC3)C2)C1 1837459878 NWKXZZOBRMMYOF-AWUSRGSFSA-N 457.531 0.502 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)n1ccccc1=O 1837921142 FILAPRXKATZPFX-GOSISDBHSA-N 481.358 0.402 50 20 JCGD O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838480493 ASBLFBLJDSCELN-HTAPYJJXSA-N 475.933 0.240 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1 1839349121 FHXXKEDNYOTMSS-VBKZILBWSA-N 468.348 0.887 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)NC(=O)c3ccccn3)CCO2)C1 1839667775 IODPUMAKINTGSV-MRUHUIDDSA-N 497.390 0.830 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cn4nc(C)sc4n3)C2)C1 1840150734 PSQKRCGQHWYDNU-KXBFYZLASA-N 471.967 0.352 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(=O)OC)nc3)C2)C1 1840152216 BDGPTZJQJSNZOT-MGPUTAFESA-N 455.895 0.192 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2)C1 1840153920 FSIKZOQJPXXNOL-ZOCZFRKYSA-N 477.986 0.952 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(NC(C)=O)cc3)C2)C1 1840156815 UZYDFVDUKVBPFO-NQIIRXRSSA-N 453.923 0.969 50 20 JCGD CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843013927 FAQCRRCGSZDCNG-LJQANCHMSA-N 487.362 0.209 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CC(=O)N(Cc2cccs2)C1 1848145425 IMDFOWKQWFYQSB-JVPBZIDWSA-N 482.566 0.611 50 20 JCGD Cn1ncc2c(=O)n(CC(=O)NNC(=O)COc3ccc(-c4ccc(C#N)cc4)cc3)cnc21 14057056 JPZTUULWYLJABL-UHFFFAOYSA-N 457.450 0.895 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1c(C)nc2ccccn12 17582107 ZAFGFEDMDIDQBG-UHFFFAOYSA-N 473.511 0.747 50 20 JCGD COCCn1nc(C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)ccc1=O 24399797 ZRQHHSXDYGCQDF-UHFFFAOYSA-N 477.524 0.827 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cn1C 725877546 FCWYQFJGHJMZJX-UHFFFAOYSA-N 475.531 0.149 50 20 JCGD Cc1c(C(=O)NNC(=O)CNC(=O)c2ccco2)nnn1C1CCN(C(=O)OC(C)(C)C)CC1 726149713 HAKCQMCXIJEQQX-UHFFFAOYSA-N 475.506 0.943 50 20 JCGD COc1ccc(S(=O)(=O)N2CCC(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)CC2)cc1OC 728179233 IGXPXZGYOOCRTL-MRXNPFEDSA-N 489.616 0.597 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNC(=O)c3c[nH]c4ccccc4c3=O)cc2)CC1 728215412 ZQVVVIZWGUOPJF-UHFFFAOYSA-N 498.565 0.337 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)c1cccc(C#N)c1 728872344 MKKYTGCIADGSLS-KRWDZBQOSA-N 458.496 0.561 50 20 JCGD O=C(NC[C@H]1CN2CCC[C@H]2CO1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 729620560 YTYZGPCWEDBKMD-IRXDYDNUSA-N 451.549 0.278 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)CCc1ccco1 748266343 GACGHCGTGBVREV-MRXNPFEDSA-N 491.975 0.795 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1 789852823 UOEMZWHMIAHRLL-UHFFFAOYSA-N 487.494 0.494 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 789857576 YPABZEVOTSKRKQ-UHFFFAOYSA-N 462.440 0.746 50 20 JCGD Cc1cc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(C)n1Cc1ccc(S(N)(=O)=O)cc1 793121259 SBFLLLUFEVGRFI-UHFFFAOYSA-N 494.537 0.851 50 20 JCGD COC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1nn(CCC(C)C)c(=O)c2ccccc12 912521588 LNAQOHOEYAVWLV-UHFFFAOYSA-N 462.488 0.576 50 20 JCGD COCCS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1 915636798 WAPPWUXDQHQZJM-UHFFFAOYSA-N 485.540 0.318 50 20 JCGD CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 915789091 IFEYQNNHCTUVSG-UHFFFAOYSA-N 495.366 0.966 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)c3ccc(F)cc3Br)n(C)c2n(C)c1=O 919750135 RHDVJGOENHHELL-UHFFFAOYSA-N 452.240 0.552 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2)c1 919806124 LWBHJYCBYWGXMU-HXUWFJFHSA-N 474.539 0.434 50 20 JCGD CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1F 919886660 SZXAAONCVBMSQF-NSHDSACASA-N 450.514 0.034 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 920341664 DEVAWXVJCJATGU-UHFFFAOYSA-N 451.461 0.531 50 20 JCGD Cc1cc(Br)c2c(c1)C(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)CCO2 920370935 OWBCWMOXKHBIAZ-UHFFFAOYSA-N 468.333 0.945 50 20 JCGD CCOc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CN3CCCC3=O)CC2)cc1 920826775 RZYHIMCYCVAOFB-UHFFFAOYSA-N 452.533 0.256 50 20 JCGD C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)C2=S=C3CC[C@@H](C)CC3=C2)cc1 1336956490 RQUBGFUPYKKRBT-CHWSQXEVSA-N 451.570 0.945 50 20 JCGD Cn1ncc(Br)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1778406766 RBMRUUUEJBRGPK-OGHNNQOOSA-N 463.760 0.910 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1779204226 VPOBKROJYPPJSY-RLSLPTNOSA-N 454.293 0.255 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2n1 1780042310 XPFRMDVWZCJVHR-HSZRJFAPSA-N 464.287 0.009 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)C2)C1 1780416144 OQQDCLCYLBOZHA-IYHCKTHZSA-N 457.447 0.500 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2cccnc2nc1O 1781249489 FZJZVHWRMJIIRN-CJFMBICVSA-N 490.325 0.457 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)cc21 1781329880 MMVKFMPVZQMXMV-GUYCJALGSA-N 458.288 0.151 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781335513 UEZYESRMFXSVHO-FZMZJTMJSA-N 454.343 0.367 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2 1782170601 SHUUPPISMWOYFN-QNFHRHJVSA-N 491.029 0.996 50 20 JCGD COc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c(F)c1 1782209529 YKCOBGZZHUDPLA-VGOFRKELSA-N 465.526 0.730 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782210290 NGIYCYOEYFIMNW-DRMXPCRNSA-N 474.606 0.879 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1783615577 PGBHLZBWYVGQTK-NQCMUKECSA-N 466.362 0.990 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccn(-c3ccccc3)n1)CCO2 1783935419 RRLSVXRNICXBLG-HSZRJFAPSA-N 454.531 0.689 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784086144 GNSVGCXKFYSMNA-HJWJTTGWSA-N 453.923 0.840 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1784186345 OXFWTZJNGBYYGE-CKNLXJGOSA-N 459.927 0.342 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1 1784241858 QJXQQAQGLCCZIL-OFVILXPXSA-N 471.602 0.854 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21 1784446610 YGZJLFKQNVFCLK-PYXYIPKBSA-N 458.408 0.530 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)[C@H]2C1 1785331312 RJVLXILIHOYNSK-WUGWMSQLSA-N 452.939 0.990 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCOc3ccccc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979433 INLFFWPRMJTZQU-NYVOZVTQSA-N 452.316 0.429 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)cco3)C[C@@H]21 1787508896 PYMSQXZLKXVQEU-MZONFKNFSA-N 455.471 0.367 50 20 JCGD COCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787509151 WHOLQAIZCWUEAM-RAKJEAAFSA-N 472.502 0.548 50 20 JCGD Cn1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc2ccccc21 1787790920 RIVADACZFGMQIP-LEDOBFOHSA-N 461.327 0.765 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)CC1 1792337151 QYRNUVOAPXGFLO-WDSOQIARSA-N 487.362 0.017 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2 1792780682 OGHYEFCGOXJXNY-YQOMCPPKSA-N 486.396 0.992 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccccc2[C@H]1O 1793036421 ITOMTGLUJDCSGZ-WUGFPGBASA-N 458.559 0.245 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc3cnccc13)C2 1796441676 OSXWPIDLUVXFQG-WNICUGFOSA-N 475.509 0.967 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)cnc2c1 1797609009 CIUDDDYYANFTLM-BJWYYQGGSA-N 454.531 0.628 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798522329 PJPAAFVUWHSCDB-VLWCASSMSA-N 477.474 0.170 50 20 JCGD CSc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1O 1798562831 XJCGZQQYGIKRIE-CCWDJLKJSA-N 456.329 0.311 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2c(O)nnc2O)cc1 1799313439 KVABVFIBRJEBOF-ACHSLPGTSA-N 471.518 0.303 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cn1)C2 1801009427 HMADEMIZYWFCBG-IVWMJMPLSA-N 455.462 0.259 50 20 JCGD COC(=O)[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2)NC(=O)OC(C)(C)C 1802185976 DBCCUNKJUPPMKA-YYIAUSFCSA-N 497.593 0.454 50 20 JCGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1 1804352429 GOUDXWAEZPLIPN-IMIFBBOLSA-N 456.272 0.376 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCc2cnc[nH]2)[C@H]1c1cccnc1 1804427612 QISGQRWPPMXZAJ-IIBYNOLFSA-N 462.514 0.756 50 20 JCGD CNC(=O)CC(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1807454009 RIUIHCIEOLIJLL-RDPSFJRHSA-N 495.584 0.570 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1 1810187153 HBUVNUDHZBFMIB-RDTXWAMCSA-N 473.452 0.566 50 20 JCGD Cn1cc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1810310586 XWTFFHYPCJDQOB-UTKZUKDTSA-N 462.514 0.376 50 20 JCGD COC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1812687142 MIBUGPDNJSEBQT-IEBWSBKVSA-N 451.288 0.034 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1 1813072394 CTUFHOZDNMCIDO-VGSWGCGISA-N 485.545 0.187 50 20 JCGD Cc1nccn1[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813491270 XKZYXPRNROTFMI-BSLALVQMSA-N 461.331 0.847 50 20 JCGD O=C(CCN1CCOC1=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1818846167 WNFAMTHIUMHCJY-QGZVFWFLSA-N 455.280 0.238 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1cnc2[nH]ncc2c1 1818947941 DZUIGLYCMILEQP-OAHLLOKOSA-N 462.300 0.634 50 20 JCGD C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1ccnn1 1819800453 OUVLBJVEEAOUSN-QWRGUYRKSA-N 455.504 0.220 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1826843755 UQPHZKHMSZKPPM-CYBMUJFWSA-N 482.570 0.960 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1827303530 FOCYCRCMDNJBNR-WMZOPIPTSA-N 456.377 0.922 50 20 JCGD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn2[nH]cnc(=O)c12 1829595538 DPHUAYYGCKDIFP-OAQYLSRUSA-N 491.357 0.558 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1S)CCO2 1829793908 DDTNSCWHSNNHKI-IBUSPFOHSA-N 486.554 0.574 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830533514 PINGEORQGLYQSE-HNAYVOBHSA-N 462.385 0.780 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1831464018 NYBKAPMCFNHHQE-COXVUDFISA-N 459.392 0.360 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1831651478 PMJFPZWFSGAIMC-MRUHUIDDSA-N 467.954 0.459 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1832003844 GLHSPTALYNJQDC-ODCFSMADSA-N 481.949 0.905 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1833265452 WUCDELWDWNUNOE-IUODEOHRSA-N 472.384 0.187 50 20 JCGD Cc1cc(CCC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)ccn1 1833745536 UHWUKPZOONYQNK-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(S(C)(=O)=O)cn3)CC2)CC1 1833999521 CWYZKVSNNJFSMA-GOSISDBHSA-N 487.022 0.924 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nccs1)CCO2 1834434499 GBFZZLNSIAZWJT-RXULLKCLSA-N 460.516 0.347 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C[C@@H](N)c3cccnc3)CC2)CC1 1834763116 TVEHSQOVODDSPL-JOCHJYFZSA-N 494.600 0.355 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1835272925 ZXXUNPKXBRNXPQ-AVRDEDQJSA-N 470.950 0.693 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1835709481 QBQZSTSWJLBYEW-WFASDCNBSA-N 464.380 0.956 50 20 JCGD Cc1nc(N)sc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1835806450 KIWZCAOAIIARRC-IAQYHMDHSA-N 451.318 0.794 50 20 JCGD Cn1ccc2cccc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c21 1835930549 MSCWFZPEWKANGZ-VWLOTQADSA-N 477.326 0.242 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cc3F)C2)C1 1835934078 MMAJYKGMGXGSRI-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccc4)no3)C2)C1 1835938195 PSEQFNPLQGNUPI-RUZDIDTESA-N 491.309 0.405 50 20 JCGD O=C(c1cnc2[nH]ncc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1836814928 OPMIHPQRUXAEOJ-DYVFJYSZSA-N 456.272 0.718 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1836841967 SAJWBQRMXKNBTA-XMMPIXPASA-N 484.557 0.381 50 20 JCGD COc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n(C)n1 1837275913 CPBRIYMRWBHNPL-UHFFFAOYSA-N 470.335 0.035 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCC(F)(F)F)C2)C1 1837456466 NANXLNLSPCOCJV-LJQANCHMSA-N 473.452 0.488 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cccnc34)C2)C1 1837459216 MWBJKGDPNOUGBY-RUZDIDTESA-N 490.520 0.617 50 20 JCGD O=C(CCCCn1cccc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837620661 MLHATTQFROXNCS-DEOSSOPVSA-N 469.347 0.108 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(Cl)n1)CCO2 1837922719 KDFZEZWQJCOYDS-ODDBZWQPSA-N 489.920 0.334 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(-c3ccccc3)[nH]n1)CCO2 1838689156 PLNNKCRNCCKFFJ-VWLOTQADSA-N 490.325 0.140 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)N1CCN(C)CC1 1839154588 RTYXKHYLUUSNGL-UXPWSPDFSA-N 465.422 0.315 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839156586 VHQISLMSELYRAB-IERDGZPVSA-N 453.923 0.298 50 20 JCGD O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198314 BWTMVOJLPYWWDH-VHFSOBRXSA-N 490.370 0.924 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)c(C)n2n1 1839200410 HLWWTXNEGDYGCZ-CRAIPNDOSA-N 485.314 0.502 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CCO2 1839388395 PPFCEIBPXXJEOW-NJSLBKSFSA-N 494.383 0.459 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1 1839408252 KZHHNCASJNTPSQ-RUZDIDTESA-N 497.552 0.694 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1840034018 YBVYYUPJSADWMX-UGSOOPFHSA-N 455.309 0.260 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3COc4ccccc4O3)C2)C1 1840150485 LRUIZSUWOSJGDE-XERREHJYSA-N 454.907 0.537 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=C4c5ccccc5C(=O)N4CC3)C2)C1 1840154022 ICYZHBGQHYXNJI-DVECYGJZSA-N 489.956 0.967 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)C2)C1 1840155044 NWUNFIXCFNPLEB-MGPUTAFESA-N 471.894 0.933 50 20 JCGD Cc1cncc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c1 1840182659 PHWCMMOVRJEXQN-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840298609 ZCIISTSIKQZLTA-KBMIEXCESA-N 466.343 0.315 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)n1cnnn1 1840479680 FOFSCHIKOAFEOU-CZPMCIAXSA-N 487.467 0.576 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1843415910 BFKPTZSMBVNHHD-LVSXPEEVSA-N 466.502 0.458 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc3c(c2)NC(=O)CO3)C1 1844079931 PLQZFMXVXLDDEA-VULFUBBASA-N 464.482 0.969 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1844385551 ASIRNUQRLLSIQA-KRWDZBQOSA-N 462.459 0.488 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCCO3)C2)NC(=O)NCc1ccccc1 1845038965 OIBQIBFURNMUKJ-UHFFFAOYSA-N 481.557 0.829 50 20 JCGD O=C(CNCP(=O)(O)O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1 1845940678 DILVBITYJSAJER-HNNXBMFYSA-N 474.292 0.921 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(CNC(=O)OC(C)(C)C)CC1 1847302966 USHBZYZMJHLGTL-HOTGVXAUSA-N 451.568 0.866 50 20 JCGD CN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847563053 MDUIXYGFFWBUFB-FXUDXRNXSA-N 474.986 0.550 50 20 JCGD COc1ccc(C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1S(=O)(=O)N1CCOCC1 10447033 LMSCPDWONYCMGM-UHFFFAOYSA-N 477.495 0.334 50 20 JCGD NS(=O)(=O)c1ccc(N2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)cc1 729220990 GTADXTXZCIBDPT-UHFFFAOYSA-N 471.337 0.601 50 20 JCGD C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1 906487692 BDNHPTZSUGFXSR-ZDUSSCGKSA-N 464.475 0.175 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CCNS(=O)(=O)c1cccnc1 914903841 DEKXIVVXODKRMY-UHFFFAOYSA-N 470.891 0.416 50 20 JCGD CCN1C(=O)c2ccc(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2S1(=O)=O 917515579 SATRETKCKSZUPT-UHFFFAOYSA-N 455.452 0.173 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2nc3ncccn3n2)c1 917899279 BXLKHQXBPVJCCE-UHFFFAOYSA-N 481.494 0.937 50 20 JCGD O=C(CCNS(=O)(=O)c1c(Cl)cccc1Cl)NNC(=O)N[C@H]1CCS(=O)(=O)C1 920212409 IKNRIUSHVLMBIG-VIFPVBQESA-N 473.360 0.179 50 20 JCGD CCCNC(=O)NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2cc(C)ccc2C)CC1 921042650 IEURPOATFMLGFF-UHFFFAOYSA-N 453.565 0.657 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ncccc3n2)C1 1778666458 FFPJLQBQDBGVLW-VGOFRKELSA-N 457.535 0.230 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccn(-c4ccccc4)n3)CCO2)C1 1779032502 LWOANRZQVATPRN-XMMPIXPASA-N 475.509 0.628 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1779181037 DICJLCXGRZKIMI-CKFHNAJUSA-N 468.352 0.598 50 20 JCGD CC[C@@H](NC)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559401 KBWKSYQKPDJGMV-DNRQZRRGSA-N 488.633 0.845 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1780918389 LNTASUVKTDWAAF-DYESRHJHSA-N 450.923 0.952 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(O)nc1)CCO2)NC(=O)NCc1ccccc1 1780968507 MBKOEPTXSLYOFF-DEOSSOPVSA-N 482.541 0.577 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781227558 MSXBGLAWRRPYEB-BKTGTZMESA-N 468.378 0.938 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CCCC3)C2 1782212011 NVINQTDPASCKAC-WZONZLPQSA-N 460.579 0.789 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)[S@](=O)c1ccccc1 1782682530 UJHNLMIPEGWACR-ULVZBFQNSA-N 485.566 0.325 50 20 JCGD CN(C)[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1Cl 1782830099 BGVMVTAFEIOPCF-URXFXBBRSA-N 485.777 0.766 50 20 JCGD CC(=O)NCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1783183367 XDTSGXBLKPEHNS-MGPUTAFESA-N 460.959 0.475 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCC3=O)C[C@@H]21 1785076510 OFDLRLLRMRDOTP-QAETUUGQSA-N 486.997 0.721 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)s1 1786980164 QHGIMPCLFKHIHJ-YYWHXJBOSA-N 456.373 0.962 50 20 JCGD Cn1ncc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)ccc21 1786983465 VFZUSMOFWQUHDV-XJABCFGWSA-N 462.315 0.160 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)N1CSCSC1 1786984291 ZPGGNXONMBGCQE-CBVHJVASSA-N 479.433 0.003 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786985026 LKUANUBLMZMYGU-XJABCFGWSA-N 486.761 0.864 50 20 JCGD CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1Cl 1787133337 LWVKSEPIDWZSGP-YDHLFZDLSA-N 454.959 0.592 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21 1789866554 NKWDIKSACXQHIY-TUUVXOQKSA-N 454.980 0.889 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791056294 RNNDKFNCPOTVEW-GVARAGBVSA-N 454.325 0.062 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCS(=O)(=O)c3ccccc3)C[C@@H]21 1791289280 RLHJEWASHHOANN-IHPCNDPISA-N 494.614 0.203 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)cc(F)c1 1795844063 VJWHWTJETXUIHO-VTEUUUEMSA-N 459.453 0.409 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc2nc(Br)nn2c1 1795927206 IGEQWJAJRXVCHU-GFQSEFKGSA-N 472.727 0.295 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cc1ccccn1)C2 1796445715 HZFJJQQFUUABLK-OODBJQIASA-N 466.542 0.984 50 20 JCGD Cc1onc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)c1C 1799095460 YJDLTUVDXKMVDF-HATOLVCRSA-N 484.557 0.841 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@]1(F)Cl)NC(=O)NCc1ccccc1 1801092259 UYDKWAXBDZIEAV-XQYWQHOKSA-N 481.956 0.847 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1804348863 GPXVJNXXDWVMIX-NRSFXHEJSA-N 464.526 0.755 50 20 JCGD O=C(CNC(=O)c1cccs1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804571549 GHIMMHYDQCBNFS-AVRDEDQJSA-N 492.366 0.573 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(=O)c1ccccc1 1806236254 NOWDGHJZJSMXCZ-IFMALSPDSA-N 457.295 0.964 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cc(C(=O)O)ncn3)C2)CC1 1807576625 YGXQSLABBJXQBY-UHFFFAOYSA-N 467.486 0.332 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810301656 BIFWSTNLUZMYGG-LAUBAEHRSA-N 492.540 0.556 50 20 JCGD CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1812649767 NIVUPOTXEPJFBG-LDZQDMHISA-N 467.530 0.746 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812779270 RDBRMSPYJQKUPA-JENIJYKNSA-N 471.396 0.548 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccn3c(O)nnc13)CC2)c1ccc(B(O)O)cc1 1815340964 RAYIQZHXWCEIFO-ZDUSSCGKSA-N 478.299 0.111 50 20 JCGD O=C1Cc2cc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)ccc2N1 1815356716 NABVXSZBSOHNOT-MRXNPFEDSA-N 476.323 0.857 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3C=CCN3)sc2C1)NC(=O)NCc1ccccc1 1817002274 HMQTWBBNYNNRCG-WMZOPIPTSA-N 483.598 0.929 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1 1817479952 XEPSZFABLFYKPV-LJQANCHMSA-N 461.287 0.808 50 20 JCGD COC(=O)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1 1818223228 BIOZSZMNTPDIBT-LJQANCHMSA-N 477.286 0.891 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819404573 PODWRAMUOVSHNY-INIZCTEOSA-N 464.486 0.936 50 20 JCGD CN1CC(C(=O)N[C@H]2CCc3nc(NC(=O)CN(C)NC(=O)NCc4ccccc4)sc3C2)C1 1822518750 SLYMSIBZZSPFAQ-KRWDZBQOSA-N 485.614 0.963 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CC#N)C2)C1 1829355632 AZGDIXARLBZRLO-DEOSSOPVSA-N 484.557 0.725 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)N1C(=O)OC(C)(C)C 1830719691 HMMFADVURUKFQH-NRVIRDBHSA-N 489.997 0.831 50 20 JCGD Cn1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(C(F)(F)F)n1 1830731254 IXKCRLMFWMKWTJ-WBMJQRKESA-N 454.833 0.109 50 20 JCGD O=C(c1cccc(-c2cnccn2)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731540 LEISEDNCKZIONZ-KNQAVFIVSA-N 460.918 0.813 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1 1832549025 BGBCIRKDSZJINK-NRVIRDBHSA-N 491.029 0.948 50 20 JCGD CC[C@@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833499379 YOOAEJSWMVZRRD-QRWLVFNGSA-N 460.579 0.277 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncn3-c3ccncc3)CCO2)C1 1833656553 IIDVWGQECQKNJH-UTKZUKDTSA-N 463.922 0.591 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3Cc4ccccc4CN3)CC2)CC1)c1cccc(B(O)O)c1 1834800158 USXNBTLJUGXRHR-RUZDIDTESA-N 490.413 0.266 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3CCSCC3)CC2)CC1)c1ccc(B(O)O)cc1 1834800622 SXUZXAYPIAFDNP-UHFFFAOYSA-N 459.421 0.695 50 20 JCGD COc1nccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1F 1834906222 SGYFLGZFWDXAAA-UHFFFAOYSA-N 484.337 0.408 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCNC(=O)C3)CC2)CC1 1835118010 GSTZCZKMBFZVKX-TXMABLNQSA-N 485.589 0.218 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1835644752 FXKCRJFRPMJFQG-DZGCQCFKSA-N 467.336 0.313 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835934128 LUFNWXZIINKHLU-HOYKHHGWSA-N 452.316 0.240 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1 1836413743 NWCUFPFYTLYPNV-WFASDCNBSA-N 485.420 0.576 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836678282 QUEQATBDKUXGNO-AVRDEDQJSA-N 452.935 0.610 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3c(F)cccc13)CCO2 1837061286 XJQFCYSMTVAMEI-QFIPXVFZSA-N 476.509 0.145 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=S)NC)CCO2)C1 1837467000 ARZORLCJYAWABI-GUYCJALGSA-N 465.414 0.100 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)C3(Br)CC3)CC2)CC1 1837921582 QOGOQUZTHCETOI-UHFFFAOYSA-N 479.180 0.906 50 20 JCGD Cn1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1Cl 1838310287 CCDUENHHRZWWTP-ABAIWWIYSA-N 453.696 0.834 50 20 JCGD COC[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838526718 AAOHVIUJFGQQGE-IVZQSRNASA-N 479.486 0.873 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC=CCC1)CCO2 1839127469 XASFRWVRBAOHNH-OCAHMQCSSA-N 457.531 0.933 50 20 JCGD Cn1nncc1C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839743266 HFDYKLFIDVDQSF-AGBQBWRISA-N 472.452 0.770 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)no1 1840032545 BWEYXJRDDYHOLK-SCLBCKFNSA-N 473.324 0.551 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1840034695 UMDLXZCXDGFDSI-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ncccc3OC)C2)C1 1840150928 SVUZNDREPUALGF-IERDGZPVSA-N 455.939 0.733 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(OC)n3)C2)C1 1840151114 VPSPTVVAZPBWDB-UWJYYQICSA-N 455.939 0.733 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccc(C)c34)C2)C1 1840155282 VWMLIZFICOYZIC-UWJYYQICSA-N 450.923 0.967 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1 1840156800 UATQQHPVBPPTOS-MGPUTAFESA-N 492.953 0.553 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nc1 1840185379 PLGFZEPMEDNIHP-DEOSSOPVSA-N 491.589 0.377 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1 1843011812 WJDXYHSOTLQCCY-UHFFFAOYSA-N 452.276 0.471 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCNC(=O)c1ccc[nH]1)C2)NC(=O)NCc1ccccc1 1845038577 VCPWNHIEADMNIO-UHFFFAOYSA-N 495.584 0.684 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)C(C)(C)O 1847094550 RAPVCSOEZWXNAF-MRXNPFEDSA-N 490.561 0.166 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1=NN(C)C(=O)CC1)NC(=O)NCc1ccccc1 1848047764 PLKLZCRNQLEJDM-OALUTQOASA-N 469.546 0.143 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc2c(c1)oc(=O)n2C 23015540 BIWACMHYSSCKLQ-UHFFFAOYSA-N 453.502 0.356 50 20 JCGD CC(=O)N1c2ccc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2C[C@@H]1C 28679162 LANBAOVARKZIKK-ZDUSSCGKSA-N 480.568 0.858 50 20 JCGD CCN(CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)C 726713574 ICDSZCMETMUPEG-UHFFFAOYSA-N 469.608 0.701 50 20 JCGD CC(C)CC(=O)N1CCN(C(=O)CCCCCNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)CC1 727605555 NRQPCTOCJAHPNN-OAQYLSRUSA-N 473.640 0.645 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2N2CCOCC2)N(C)c2ccccc21 728698320 OBFGXURHEONSIE-XLIONFOSSA-N 487.582 0.271 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C(=O)OC)s1 728854122 MMWCUHAHKHCDPB-UHFFFAOYSA-N 483.528 0.337 50 20 JCGD C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)C1=O 748546393 JJFGBWDQPASOGR-SNVBAGLBSA-N 453.249 0.341 50 20 JCGD COc1ccccc1N1C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1=O 849206013 XLQFEZYIPJLWSL-LIRRHRJNSA-N 469.450 0.579 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1cccc([N+](=O)[O-])c1 912770428 CVIHPLJEMREBCS-UHFFFAOYSA-N 450.429 0.496 50 20 JCGD O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)Cn1cnc2ccccc21 913495837 SZNVEDYJWFMKSZ-UHFFFAOYSA-N 466.317 0.925 50 20 JCGD CN(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1 915890969 BQYCJXHXMXNUCZ-FQEVSTJZSA-N 475.571 0.954 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(C(C)(C)C)n[nH]1)c(=O)n2Cc1ccccc1 918016855 LQJDLPTVADYEHO-UHFFFAOYSA-N 492.540 0.910 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)C(=O)c3ccc(Cl)cc3)CCO2)C1 1779028263 BAVCFXLCOKACCY-QFIPXVFZSA-N 471.901 0.665 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372339 FGPCGWVNEOOEEJ-OMXJDXKCSA-N 474.562 0.117 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1779688721 TYMITFTZNIGOKZ-OAQYLSRUSA-N 467.954 0.950 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)Cc3[nH]nc4c(Cl)cccc34)C2)C1 1780941915 CLWZBHDZZMRYIP-QFIPXVFZSA-N 476.965 0.962 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)C1(O)CCC1 1780968865 KEWBCQCCBNCAHF-CYFREDJKSA-N 487.601 0.714 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)C1 1781335391 YSMKLWCCUOMIFW-UMCXVIDHSA-N 494.358 0.735 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1 1781540512 PAHFPTSOFJXBBN-SGCYSOCQSA-N 484.469 0.878 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ncccn13)C2 1782214097 CKCFNMZHBPIBOV-VGOFRKELSA-N 457.535 0.230 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1783537776 NGRLRHPFCMXUDM-ZUZCIYMTSA-N 450.380 0.460 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1783575470 FJEPTJSZUVBYRA-CYFREDJKSA-N 487.362 0.209 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784096576 IMDPEDWVVXXPBO-UYLCUJDWSA-N 477.961 0.913 50 20 JCGD O=C(Cc1ccccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1786516481 NSUWZHSWPSHPRG-CUWPLCDZSA-N 456.735 0.856 50 20 JCGD Cc1ccn2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)c2c1 1787371699 UNAPRKCTNNBNHE-XJABCFGWSA-N 462.315 0.230 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1 1787446105 WPMJCCAZYMGAGK-OJFNHCPVSA-N 463.934 0.871 50 20 JCGD Cc1n[nH]cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726838 WKIPNPZRMUCOHY-JBACZVJFSA-N 483.573 0.658 50 20 JCGD CCOC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1790259867 LDNPQPHLIHAFFX-BVSLBCMMSA-N 480.326 0.450 50 20 JCGD CCn1c(-n2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)cc2C)cccc1=O 1792976281 BRUNKEQUCFUAKE-DOHHPOSVSA-N 477.949 0.165 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](O)CCl)C(=O)C1 1793117644 VBYNAOOIIFOJBB-QKPAOTATSA-N 472.970 0.304 50 20 JCGD CC[C@H](C)[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793396893 VCNLHBDHJSDDEF-DTTOWAHTSA-N 475.590 0.329 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)nn1 1794565682 XJCWIAKXISRZBS-DBWKPXFBSA-N 471.426 0.533 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1scnc1C(F)(F)F 1794980007 XTZZQVDZAFCVQS-DABQJJPHSA-N 469.250 0.359 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736976 QMMKRQVSIBTUSL-REGYPHIPSA-N 455.345 0.145 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796445613 FUONBAZTNNXWJL-SRGQWWCUSA-N 468.352 0.884 50 20 JCGD Cc1cc(C)c(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(C)c1 1797748656 QLHSIUBUHFARKL-OPMZPASUSA-N 481.553 0.893 50 20 JCGD Cc1cc(NC(=O)CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)no1 1798440449 RKASSTZVYXGUSF-BTTYYORXSA-N 455.475 0.262 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)cn2[nH]cnc(=O)c12 1798459431 JTUODYMQVTVPIT-DNVSUFBTSA-N 466.336 0.565 50 20 JCGD CCOC(=O)/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095007 PMGQYOHOLHROTF-IVUUIMBCSA-N 487.557 0.042 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnc(Cl)nc1 1802297214 QAHHANZSLKSSGR-LPHOPBHVSA-N 465.706 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2C(=O)C=CC2=O)cc1 1803882216 CSVRTXLDEUHYQM-VBUUOAMHSA-N 488.504 0.680 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc(O)n3c2CCCC3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359731 DFHUNVYYMWQBEN-AVRDEDQJSA-N 489.341 0.633 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361440 ANYYGVNODVPLJU-NFBKMPQASA-N 450.348 0.567 50 20 JCGD CN1CCC(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1807362114 ZOVRHLRTSSYEFF-IRLDBZIGSA-N 450.348 0.423 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807373326 BLDFHFDNXOZKCD-ZJSXRUAMSA-N 475.358 0.985 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375853 VRQBXUNAIGCEKS-PBEJRMEISA-N 496.373 0.994 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCC(N)=O)[C@H]1c1cccnc1 1808416313 LURBEIVIQZFWLM-RMFAIBCQSA-N 453.503 0.487 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccncc2O)[C@H]1c1cccnc1 1810665036 SWXCDLMOSYZQHD-FOIQADDNSA-N 461.482 0.814 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1 1814639293 TUSWFEPJJLDIOG-FYDYWCEBSA-N 487.586 0.911 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)Cc1ccccc1)CC2)c1cccc(B(O)O)c1 1815360705 XRIMDURODMDHSZ-IEBWSBKVSA-N 465.340 0.652 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccn4c(O)nnc34)sc2C1 1816968745 UCOBLZXARJBVFR-LLVKDONJSA-N 472.531 0.490 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)N(C)C)[nH]n1 1818110873 ROJYELMATXAQBT-IXBOPPFXSA-N 471.522 0.807 50 20 JCGD Cn1nc2c(c1C(=O)N[C@@H]1CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C1)CCC2 1819800836 SCRJIHMWAAMYTN-LLVKDONJSA-N 480.554 0.903 50 20 JCGD CN1CCCC[C@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1822592627 ACKQFYAFWKKVFN-WBMJQRKESA-N 457.560 0.852 50 20 JCGD NC(=O)c1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1 1823119295 WTZOEMPYJVHBQT-IBGZPJMESA-N 461.287 0.808 50 20 JCGD CCCNC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827049444 TYKMTYORLTTXGZ-NRFANRHFSA-N 457.380 0.906 50 20 JCGD O=C(c1ccc2nncn2c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051918 KAPXSEFUXWIEIB-NRFANRHFSA-N 461.331 0.956 50 20 JCGD O=C(COc1ccc(O)nn1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060521 MNOJJHKDVJDPLK-IBGZPJMESA-N 468.319 0.174 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCCC[C@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1828357746 NJXKMLYITRPRCD-ZWKOTPCHSA-N 464.028 0.877 50 20 JCGD CC[C@H](O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548816 PTOLQIVITZKYCD-NJNPRVFISA-N 467.950 0.809 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cn1ccc3c(F)cccc31)CCO2 1830652544 GJPXYOOCBXUMOR-XMMPIXPASA-N 489.548 0.610 50 20 JCGD O=C(c1csc(Br)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830727952 LKXJPMCNCWOASU-NHYWBVRUSA-N 468.757 0.575 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)N1CSCSC1 1830730459 ANMZHDBQSSAHQN-CKEIUWERSA-N 454.014 0.086 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(O)[nH]3)C2)C1 1832549444 PHLIJANVFFUSKQ-RBZFPXEDSA-N 487.941 0.317 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCO3)C2)C1 1832551393 MDNKRIDPAPIKOM-QYWGDWMGSA-N 475.970 0.754 50 20 JCGD Cc1cn(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)c(=O)nc1O 1832774683 PCGVBSAVDIDYDV-IBGZPJMESA-N 497.556 0.189 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)ccn1 1833310757 ZVBZQIKQBJWPCM-SFHVURJKSA-N 451.955 0.825 50 20 JCGD Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1834798591 OANFXAMNRKBSLA-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1835596092 NODMTVAMLWDAGZ-RWAHWCJQSA-N 492.529 0.964 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3csc(C(F)(F)F)n3)C2)C1 1835930960 AXYDKIXMRPTTMN-LJQANCHMSA-N 499.276 0.226 50 20 JCGD C[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1ccccc1 1835932008 KNNKUUOGJLOVSS-CLOONOSVSA-N 466.343 0.630 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1836258158 UUQSHIMLLHAFSZ-ZWKOTPCHSA-N 495.385 0.144 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1 1837047273 NJKWQGQYWKIPBX-OAHLLOKOSA-N 473.368 0.710 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1 1837153071 KZHUUAGNQSRGCA-UWJYYQICSA-N 451.907 0.254 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CCO2 1839084471 DDWVSPHOBGGVAY-PZTGFMGMSA-N 457.955 0.098 50 20 JCGD CCOC(=O)C1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CC1 1839202385 DMEVKFDLGHTPDJ-WBMJQRKESA-N 451.289 0.477 50 20 JCGD O=C(NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1ccccc1 1839203270 GXRZLUAYOVCUPV-YLJYHZDGSA-N 486.338 0.953 50 20 JCGD C[C@H](NC=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802374 UZPQWCVSZMZRFD-CDXJDZJCSA-N 482.375 0.584 50 20 JCGD COC(=O)[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)NC(=O)OC(C)(C)C 1840111967 SQRPJASYSUPPHO-IAMHBRQHSA-N 495.932 0.434 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N4CCN(C)CC4)cc3)C2)C1 1840149705 YIUVNKUICRXMPI-XUZZJYLKSA-N 495.020 0.762 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C(=O)N(C)C)c3)C2)C1 1840155644 BXZPQAROWPXEJW-PGRDOPGGSA-N 467.950 0.712 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1 1841925327 LNTPOUDZIHDBHG-SJORKVTESA-N 496.996 0.792 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)Cc2ccc(Br)cn2)C1 1842091387 CZDDUJJNQZBIDD-UHFFFAOYSA-N 452.353 0.963 50 20 JCGD CN(CCCC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)C(=O)OC(C)(C)C 1843012646 KVTKEGHMYDDNNW-UHFFFAOYSA-N 459.352 0.831 50 20 JCGD O=C([C@@H](O)c1cccc(Br)c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014503 QUDBMQMJKLVWDM-SFHVURJKSA-N 473.132 0.680 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1 1847556422 KMEQDDIDEFIWQM-MWDXBVQZSA-N 467.954 0.976 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc(C#N)cc2)CC1 9746901 SDCXYAIIHHHAPZ-UHFFFAOYSA-N 467.511 0.875 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c(C(=O)OC)s1 726520064 WDDIMOHDTGOXGC-UHFFFAOYSA-N 469.497 0.886 50 20 JCGD CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1 727764605 CGJXHNGLYOKCPM-KRWDZBQOSA-N 472.527 0.939 50 20 JCGD O=C(COC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)NNC(=O)[C@H]1COc2ccccc2O1 728339706 ABKYVTGAXQKZJV-FOIQADDNSA-N 497.460 0.551 50 20 JCGD Cn1c(=O)nc(O)c2nc(CCC(=O)NNC(=O)c3cc(F)ccc3Br)[nH]c21 728546160 OHSFLWHHPOUSSL-UHFFFAOYSA-N 453.228 0.658 50 20 JCGD CN1CCN(c2ccc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cn2)CC1 728944117 MEKUYBYTWFIUDC-UHFFFAOYSA-N 453.551 0.370 50 20 JCGD COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)cc1 728961240 DANVJIINAGJPQF-UHFFFAOYSA-N 467.530 0.900 50 20 JCGD COc1ccccc1N(C)S(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C(=O)NC2CC2)c1 744462370 IIXXJVSBDHSZQX-UHFFFAOYSA-N 460.512 0.868 50 20 JCGD O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)c1cccc(C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)n1 748359040 ZQYSPUNVNLMHTA-OYRHEFFESA-N 487.472 0.611 50 20 JCGD C[C@H](O)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 749348573 QMJJLCLNQKMVBR-HNNXBMFYSA-N 462.528 0.905 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)c1ccc(-n2cnnn2)cc1 749838075 NUNVHESLTLRAGF-UHFFFAOYSA-N 486.333 0.226 50 20 JCGD O=C(COc1ccccc1[N+](=O)[O-])NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O 874071936 OYGGBACKJMFXFW-UHFFFAOYSA-N 452.427 0.968 50 20 JCGD O=C(COc1ccccc1Cc1ccccc1)NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 914830098 WNWRESWGVOZFDW-WOJBJXKFSA-N 485.562 0.839 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1ccc(Cl)nc1 917251131 RUXSUHLSMWWSSL-UHFFFAOYSA-N 454.892 0.839 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCC[C@H]1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886374 RPCAWWJSBLWPOD-JSGCOSHPSA-N 458.924 0.471 50 20 JCGD C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1=O 920473118 IALGIABRUAKWJJ-HXUWFJFHSA-N 458.500 0.208 50 20 JCGD COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 920746262 VHTPLSZQPWLZDB-CYBMUJFWSA-N 482.540 0.627 50 20 JCGD C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)C2=S=C3CC[C@@H](C)CC3=C2)cc1 1336956492 RQUBGFUPYKKRBT-OLZOCXBDSA-N 451.570 0.945 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3c(Cl)ccc4c3OCO4)C2)C1 1777799279 BKIZOPYUTMOIHA-JOCHJYFZSA-N 472.690 0.506 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3cncn3c2)C1 1779138666 UIAQTJKQDOXUFT-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)ccn1 1779373571 ZRXBRFPHLBFHFD-NTKDMRAZSA-N 495.540 0.480 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccn(C(F)F)n1 1779758830 ALMWTNAILVYJCC-DYESRHJHSA-N 462.262 0.399 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(O)ccc1F 1780906389 LLIWSBOSGZVLQA-NFBKMPQASA-N 456.279 0.652 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782208917 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NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4nccc4c3)[C@H]2C1 1788447377 ARQROEBJJWRPLC-YSSFQJQWSA-N 463.498 0.240 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc2ccncc12 1790355811 GYGBWMMLQYIYAY-TZYHBYERSA-N 459.311 0.822 50 20 JCGD CN1CCN(c2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)cc2)CC1 1792457498 MFPIPYFVPLFFAP-HNJRGHQBSA-N 450.967 0.241 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O 1792780333 VRGFCUJATMZVHQ-YHDJZSDMSA-N 496.402 0.929 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792983361 IRSYZSCHKHRJEP-ZQNQSHIBSA-N 466.000 0.432 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 1793208378 ADAMRPREISPENZ-XLIFZOOWSA-N 463.962 0.879 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc3c1CCCO3)C2)c1cccc(B(O)O)c1 1795739002 PMMRFMKDKJWKAB-CCWDJLKJSA-N 456.329 0.270 50 20 JCGD 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COC(=O)c1csc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 749153019 XOGMFLHCACQGIO-UHFFFAOYSA-N 461.543 0.473 50 20 JCGD C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CCCC[C@H]1C 916448091 MILDGVOCNGBVFP-SJORKVTESA-N 467.592 0.914 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 919905515 FTICXZHJJBOCCI-UHFFFAOYSA-N 476.559 0.115 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cn3c(nc1=O)SCC3)C2)[C@@H](F)Cl 1778025186 NARMXNPTLYLPFK-ZXYWRSMDSA-N 458.943 0.940 50 20 JCGD COC1(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CN(C(=O)OC(C)(C)C)C1 1778136410 MQSIBVPCJSAXBG-YWZLYKJASA-N 475.970 0.442 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1 1778287168 IMOUKIAPMONHKI-QHCPKHFHSA-N 464.538 0.970 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1OC 1779032566 NLRVZMAAUCXEOJ-QHCPKHFHSA-N 469.498 0.460 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1 1779032596 VMHJJBUQSWSOMJ-QHCPKHFHSA-N 461.482 0.386 50 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CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1F 1785794365 MUAHTOOUHYILMP-PJODQICGSA-N 459.482 0.017 50 20 JCGD CC(C)Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)n(C)n1 1786979731 BVGFFPLSNJLZBT-XJABCFGWSA-N 468.363 0.206 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3C(F)(F)F)C[C@@H]21)c1ccc(B(O)O)cc1 1786979981 WKPMEQSIJFQMSQ-FNHZYXHNSA-N 477.248 0.687 50 20 JCGD CC(=O)N/C(C)=C/C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1790559879 RZRLYPJYZUBSCR-BCDTYFSXSA-N 458.519 0.140 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCn3cncn3)[C@H]2C1 1791519136 ZZAWCCINTORGQV-QAETUUGQSA-N 484.985 0.780 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2 1792866815 KWJXPVGWSIBPNS-NIFZNCRKSA-N 478.384 0.493 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(F)(F)C(=O)O 1796348976 UWYPOXAMZBGZJS-OPDFLTKYSA-N 483.896 0.818 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1[C@H]2Sc3ccccc3[C@H]21 1797765311 VCRSRQZSOGSQSR-IEOOEQHGSA-N 464.352 0.458 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)[C@@H](O)N1CCOCC1 1797808432 NWGFKTBFYMJBAR-ZPXGPAEQSA-N 496.402 0.233 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1ON=C(c3ccccc3)O1)C2 1798440483 MJDVKOSZBGVRQD-KATBDVFWSA-N 464.482 0.672 50 20 JCGD Cc1n[nH]c(C)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097219 JYFFSZRZHKISCA-HATOLVCRSA-N 483.573 0.576 50 20 JCGD COc1cc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1OC 1799704536 DJLRSXSZKBLBOK-FAQVEIGNSA-N 468.315 0.209 50 20 JCGD COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1OC 1801010600 KPVZTOZIWXGOQJ-MRSFGVLCSA-N 476.574 0.599 50 20 JCGD CC(=O)NCC(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1803716618 GZLMRPWJOJMRLM-CTNGQTDRSA-N 466.347 0.243 50 20 JCGD COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804970984 KEJHQKAMTBRIAK-PXNSSMCTSA-N 461.287 0.193 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1 1805094303 IXZBWCMDRCDKBN-WMZHIEFXSA-N 473.342 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnc(N(C)C)o2)[C@H]1c1cccnc1 1805344835 BXVGZFZTJZLUFA-OXJNMPFZSA-N 457.535 0.828 50 20 JCGD CN1CCN(CCC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CC1 1806916539 QXPSUOISZFENFV-HYBUGGRVSA-N 473.622 0.098 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N3CC[C@H](CNC(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)c21 1807362595 VZEYHJSJRDENEY-GCJKJVERSA-N 499.336 0.987 50 20 JCGD N[C@H](CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cccnc1 1807370563 GWNJMWMKTGPEAG-BGWNEDDSSA-N 473.342 0.566 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)COCCO)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1808633652 SSQJCLLBZRHSHF-ZJSXRUAMSA-N 498.584 0.443 50 20 JCGD Cc1nnsc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808649200 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O=C1CC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCN3C(=O)OCc2ccccc2)=NN1 1829056858 QQDVZMLBPLLAHV-UTKZUKDTSA-N 479.896 0.849 50 20 JCGD C/C(=C\c1cccs1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1829701216 SXUVFVYZGGGMDL-XUUSCSPLSA-N 470.356 0.601 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1830450582 VJMURTSVCXJQFL-SSOJOUAXSA-N 497.552 0.567 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1F 1831313163 BWFRSQHEEILODM-RUZDIDTESA-N 499.543 0.835 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1831654164 RENFFYVJRPBBMU-MDOVXXIYSA-N 463.959 0.693 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1832089692 NZGSMLACQQHFHY-VWLOTQADSA-N 497.552 0.315 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cncc(C)c3)CCO2)C1 1832958286 YOFSCUMKGOBTCX-DYMLFOFBSA-N 496.568 0.913 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1834720808 GBBUNIUQWXLLSV-SFHVURJKSA-N 473.622 0.827 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc2c(c1)OCO2 1835279914 UOGQNZZNOQOFSV-UHFFFAOYSA-N 479.342 0.594 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835717869 QBEPKFOHUFRZCO-LJQANCHMSA-N 451.612 0.504 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1Cl 1835934378 YAMNIIMKBLRHQZ-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CC#CC[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835938135 NAKBCCHEECNVKW-SHQCIBLASA-N 490.365 0.634 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C)CCO2 1836215742 MSLBQQPHTVJPQL-ACTFIFLWSA-N 489.997 0.831 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1 1837011428 BMXCEKSLSALTDN-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1837711833 SEHISRJIRFQXLW-FQEVSTJZSA-N 463.567 0.356 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(Cl)s1)CCO2 1838161223 HYOAYEGLWVFYLU-SFHVURJKSA-N 459.956 0.240 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C)nc1O)CCO2 1838670565 NPYIRJPFOSSGLF-VUEBRRCKSA-N 484.513 0.300 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2)N1CCN(C)CC1 1839154586 RTYXKHYLUUSNGL-NSISKUIASA-N 465.422 0.315 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1 1839200263 FIIWELJHGQLOFD-KDOFPFPSSA-N 474.283 0.629 50 20 JCGD O=C1COc2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cc2N1 1839201263 SSCDZUJDIKFTRU-LPHOPBHVSA-N 486.294 0.778 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1839874507 XAGWDSTXJVNVLU-IVZHQMGZSA-N 490.985 0.100 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1839967050 YEMPNXTZAKUDFC-JJRVBVJISA-N 467.382 0.194 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(N(C)C)cc3)C2)C1 1840184664 AGFPMDKZNQZOSY-VWLOTQADSA-N 489.617 0.515 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185169 MLDMHXKBCAHNIJ-DEOSSOPVSA-N 476.574 0.755 50 20 JCGD O=C(CN1C(=O)C2(CCOCC2)c2ccccc21)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841352526 UAKOKOBYXZWGNW-GOSISDBHSA-N 461.946 0.885 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@H]2O)C1 1843825644 ZPAXVQWWXBUUIG-DLBZAZTESA-N 481.594 0.181 50 20 JCGD COC1(CC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)CN(C(=O)OC(C)(C)C)C1 1843847336 ACUSFUHGZSTIRX-UHFFFAOYSA-N 481.594 0.589 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)(C1)C2 1844265188 DACCEYHMJWRERN-UHFFFAOYSA-N 484.557 0.950 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](Cl)COC)C1 1846365826 XOMYJYRTDAYJGP-KGLIPLIRSA-N 461.943 0.900 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(O)ncn1)NC(=O)NCc1ccccc1 1847893335 YCFDUEORMLSGIV-ROUUACIJSA-N 453.503 0.344 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2)cc1 9931153 FVVFWEXXMQWFCH-AWEZNQCLSA-N 467.525 0.692 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O 14890546 WMQLDDBVGHWJLZ-UHFFFAOYSA-N 484.538 0.121 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)N(C)OC)cc2)cc1OC 18368716 GYUOFPVOUZKIFZ-UHFFFAOYSA-N 481.483 0.504 50 20 JCGD O=C(CCN1C(=O)CCC1=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 21195739 XMYJOFBWTBKZIR-UHFFFAOYSA-N 458.496 0.465 50 20 JCGD O=C(COC(=O)Cn1nc(-c2ccccc2)ccc1=O)NNC(=O)[C@@H]1COc2ccccc2O1 728330352 IOQOTCQOLKFTDB-IBGZPJMESA-N 464.434 0.441 50 20 JCGD O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 742454095 STWVGMNJGMSVOO-TZMCWYRMSA-N 462.450 0.571 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)c2cccn2C)c1 747598566 ANDIKXANYZIQOF-UHFFFAOYSA-N 463.560 0.967 50 20 JCGD O=C(NNC(=O)[C@@H]1Cc2ccccc2O1)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12 748276555 MQUJBWXYNGQKNE-FQEVSTJZSA-N 498.517 0.726 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H]1CCCN(C(=O)C2CC2)C1 749469178 KIPAQQGCGBQZSK-LJQANCHMSA-N 492.598 0.436 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N(C)C)ccc2Cl)n1 752856443 FFPMZMXVIBVRBB-UHFFFAOYSA-N 474.948 0.902 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 846753225 PQDILIAUTNPPQX-KRWDZBQOSA-N 477.495 0.112 50 20 JCGD O=C(COC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1 915395045 WVEJFTUHNPLAEM-INIZCTEOSA-N 490.494 1.000 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1 916268780 QRAZPBDHDKKXIP-UHFFFAOYSA-N 494.574 0.526 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc(F)c(S(C)(=O)=O)c1 918754328 XKNRLWHXPKERFU-UHFFFAOYSA-N 478.549 0.454 50 20 JCGD N#CCCn1cc(/C=C(/C#N)C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c(-c2ccccc2)n1 919887330 ZZMRIFMJQDZFLD-MUMAZLPKSA-N 467.511 0.888 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1 920954289 LOHWOIPZESNTHX-INIZCTEOSA-N 486.554 0.492 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)Cc2ccccc2)c1)N[C@H]1CCS(=O)(=O)C1 1326932263 CUPCLEGOMAGNEA-INIZCTEOSA-N 451.526 0.792 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)n1 1337139787 KZYAHWHPSSWSBA-UHFFFAOYSA-N 466.560 0.884 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2Cc3ccccc3CN2)C1 1777986140 LGPJOYSZCPGCQA-BPYKYCOYSA-N 471.602 0.588 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/C(=O)NCc3ccccc3)CCO2)C1 1779028269 BCGIMPHDNGCUEC-ZHBSTKLQSA-N 492.536 0.001 50 20 JCGD C=CCCc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(O)n1 1779029137 REHHUIUOVDRWAH-DEOSSOPVSA-N 480.525 0.662 50 20 JCGD CCc1cc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)nn1C 1779832919 NNGVFFOIUYCBLI-VCOZGABYSA-N 455.519 0.560 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cccc(OC4CCOCC4)n3)C2)C1 1779903706 GHNYJQOCBTYRKL-RUZDIDTESA-N 495.341 0.077 50 20 JCGD Cc1[nH]nc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)c1F 1780968491 AWJLKOOICFHRFI-QHCPKHFHSA-N 487.536 0.647 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782000780 BFKMXRYANPFONA-OAQYLSRUSA-N 460.679 0.188 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)C2)C1 1782053445 LENQVYPAVRHZJD-QFIPXVFZSA-N 476.534 0.477 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)ccc1O 1782212077 GUBUMLCGFNDVTC-AUSIDOKSSA-N 462.547 0.901 50 20 JCGD O=C(COCCO)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783021593 CXXKBGYTHJOFQI-PXNSSMCTSA-N 455.349 0.831 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)COc3ccccc3F)C2)C1 1783358731 VQFYTUPNLAXYRE-QFIPXVFZSA-N 457.462 0.347 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1 1783540152 SIJRJDJOKKGCEH-VQIMIIECSA-N 481.384 0.296 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](CC(=O)OC)NC(=O)OC(C)(C)C)CCO2 1783879365 QVPNSDIVAOPXKY-ZSDSOXJFSA-N 491.969 0.527 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Cc1cccc(F)c1)NC(C)=O)CCO2 1783882934 AEQRCWBJJBEOMU-CNNODRBYSA-N 469.941 0.957 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])cc1F)CCO2 1783934293 CQFFQIJPJQKMOM-HXUWFJFHSA-N 451.455 0.550 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(=O)NCc3ccccc3)[C@H]2C1 1784055138 RGNSEEFKSNXSEG-NHUOFJSZSA-N 485.585 0.212 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCC(=O)N3)C[C@@H]21 1785076584 WGNISMXWJGFWBT-QXKUPLGCSA-N 472.970 0.377 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCC[C@@H]3NC(=O)OC(C)(C)C)C2)C1 1785602769 WNXSDDYJVWQMMO-XFAGBWLFSA-N 495.621 0.883 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980951 GPPXJLKTNRCDNJ-JLMWRMLUSA-N 475.314 0.059 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(F)c1 1786984781 IYIVVJULOJQICR-ZRCAFCQKSA-N 456.279 0.421 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789191870 ATJDCWQBIIJJPY-QRFRQXIXSA-N 491.313 0.027 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1 1789870597 PXGPZVACFLAGPW-GMHRPJKWSA-N 467.346 0.697 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)CCOC1 1789914004 QAOXMWPLRJVVLJ-FKAQHNMISA-N 475.970 0.250 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CC(=O)NC1=O 1793834161 FPHVIERQGMHYGU-SDGGPSBXSA-N 473.436 0.013 50 20 JCGD Cc1ccn(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n1 1794147153 GMIOXTYHQSBCMN-JHDGKUDLSA-N 483.573 0.127 50 20 JCGD COCCOCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796367773 VHJUWKCYMNIVSS-CYGHRXIMSA-N 454.923 0.197 50 20 JCGD COc1ccc2c(/C=C/C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)c[nH]c2c1 1797142481 OBQGNCZSIUCLGP-SQKWKTBVSA-N 489.337 0.773 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798440553 AQAAGJLDBMQZJE-QDMKHBRRSA-N 486.554 0.190 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1 1799333464 IGSNEFDIACAAQL-CKBPBPHLSA-N 475.970 0.514 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2)[C@@H](F)Br 1799347474 NPMKHQVSCDUTPV-RDBQEKCUSA-N 493.293 0.465 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799871455 HBAPRNYWYZFJLW-FCGDIQPGSA-N 473.578 0.418 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800409065 PEMFEPKWHWRNDL-UPHUGPLXSA-N 476.260 0.831 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)[C@H]2C1 1800723334 NRBADVSIJSCNTE-AJOQJMSBSA-N 475.945 0.992 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1801157400 JSRBHAWCIWDKNG-RGHULWKBSA-N 459.927 0.102 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(F)c1 1805082660 IDIUJNZUPWDSTP-HTAPYJJXSA-N 478.289 0.938 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2)CC1 1805410598 MIVJJWJARMTUGL-QGZVFWFLSA-N 483.610 0.476 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCc2cncnc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371051 OXZAQKFZWMSEPX-NFBKMPQASA-N 459.315 0.504 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373236 PSKGBYKXQKOZAJ-GCJKJVERSA-N 459.315 0.538 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374163 DYUUNOWQVILIIV-JRGCBEDISA-N 479.371 0.108 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(Cl)ncn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374508 HOZVDWBNCYKZQT-UZLBHIALSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccnc(Cl)n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375472 PEIAOENLJKGSBU-VQIMIIECSA-N 465.706 0.838 50 20 JCGD COc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1 1807376773 XXBVMADGDKMQNF-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C(=O)N(C)C)[C@H]1c1cccnc1 1808414957 QPIRUWCMHOYHGJ-SWUPIQEVSA-N 453.503 0.310 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@@H]1c1cccnc1 1810294750 MZLOPGLAPCTBLL-UZUQRXQVSA-N 499.535 0.845 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303247 RIOKBZNITSHPAQ-CEQIKUNHSA-N 481.557 0.705 50 20 JCGD Cc1nccnc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303532 UOPCGXRLCUKRAY-UZLBHIALSA-N 460.498 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C(=O)Nc2cccnc2)[C@H]1c1cccnc1 1810461122 GKXQHXGTPIOVIQ-OXQOHEQNSA-N 488.508 0.433 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)n1ccccc1=O 1810518828 SUWZPGORGUAEFI-BOCKYXSRSA-N 468.558 0.883 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1C 1811142374 RWBFZGKYWFIRMP-AVRDEDQJSA-N 461.331 0.691 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CS(C)(=O)=O)sc2C1 1814321893 CFLFHPVDNLYQBL-QQUGTJAQSA-N 466.545 0.234 50 20 JCGD COc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c(F)c1 1815337481 SRCSDKGDNPHRHY-ZDUSSCGKSA-N 470.291 0.905 50 20 JCGD O=C(CCNC(=O)c1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347722 MKTITNPFZOFLMP-GOSISDBHSA-N 492.366 0.869 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nn[nH]c3c1)CC2)c1cccc(B(O)O)c1 1815360136 OMFRPPHMRRLFJM-AWEZNQCLSA-N 462.300 0.634 50 20 JCGD Cc1cc(NC(=O)CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)no1 1818093394 CCYDYOORQYIACW-QGZVFWFLSA-N 480.290 0.721 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1 1818112132 UJZBCSLRCGVNEL-HJGVYBFFSA-N 463.520 0.580 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)[nH]n1 1818113096 BVCXYYGOIOSHEZ-IXBOPPFXSA-N 480.485 0.461 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)Cc2ccc3ncnn3c2)n[nH]1 1820701849 JSRZTVCSEZRUMZ-GOSISDBHSA-N 488.512 1.000 50 20 JCGD COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1 1822371431 SCBWSSZWUXFTHD-DZGCQCFKSA-N 461.972 0.386 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(=O)n2[nH]nnc2n1 1823005397 YVGGKMPGNVJGMF-XUOSJQGZSA-N 471.272 0.185 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc(C)c(O)nc1=O)CC2 1826008457 BIUCPNGFIIQXHH-WDEREUQCSA-N 455.924 0.580 50 20 JCGD Cc1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c(=O)[nH]c1C 1827050702 UXSXZFQHDVLPNW-HXUWFJFHSA-N 466.347 0.614 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccc2c1OCCO2 1830728174 QAKKDCPRLHQWSH-IIBYNOLFSA-N 454.907 0.436 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)CC1 1831897342 GAYPOFNIYAZNQY-QGZVFWFLSA-N 469.269 0.278 50 20 JCGD Cc1csc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1832980033 OZAZKHXCRJGCSL-HSZRJFAPSA-N 472.372 0.439 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(C)n1)CCO2 1834047130 TWFHOEZFOOLUIU-NWJFTTBMSA-N 468.514 0.594 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)nc3F)CC2)CC1)c1ccc(B(O)O)cc1 1834797795 HJWQHCNXDIGDST-UHFFFAOYSA-N 472.301 0.539 50 20 JCGD Cc1nnsc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800173 WLICVBLZCZORDJ-UHFFFAOYSA-N 457.365 0.025 50 20 JCGD CC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1834871204 WUFOKEMXBDIYBH-QFIPXVFZSA-N 477.470 0.959 50 20 JCGD Cc1nc[nH]c1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835736771 HFUSHCAZKOGXCF-UHFFFAOYSA-N 454.535 0.216 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835848592 ZJGBJHKOVOAEQZ-QGZVFWFLSA-N 494.600 0.766 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(F)(F)F)C2)C1 1835939740 ZDOUEFIQMALRLE-QFIPXVFZSA-N 492.259 0.769 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@H](F)Br 1836412486 IUKVEDDFKIEZBK-KRWDZBQOSA-N 470.148 0.242 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(C(F)(F)F)o1 1836511229 SRGYDZZGGLVEMJ-MEDUHNTESA-N 455.817 0.672 50 20 JCGD Cc1nc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c(=O)[nH]c1C 1837266496 IVJVEXRSPXIADR-UHFFFAOYSA-N 497.556 0.311 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c(C)cc(C(N)=O)cc3C)CCO2)C1 1837438465 ZDDMFSFLWSYJFD-VGSWGCGISA-N 467.950 0.726 50 20 JCGD COc1cnc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1837573243 VJUIXSXMWXGWCK-UHFFFAOYSA-N 468.319 0.091 50 20 JCGD C[C@H](CN)C(=O)N1CCC(OC2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1837832122 ZTTVOWVTJJMAJZ-LJQANCHMSA-N 488.633 0.926 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3nc4ccccn4n3)CC2)CC1 1837919368 JKEUDBBYGNOAKE-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cnc4ccccn34)CC2)CC1 1837920347 NTDFWTOCNPGQFU-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnn4ccncc34)CC2)CC1 1838249956 QTCALYXUARHXNN-UHFFFAOYSA-N 492.540 0.654 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cncnc3)C2)C1 1838527442 SUJACHZDEDGSEW-QHCPKHFHSA-N 499.480 0.623 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1839145988 SNZZTLDSGDKJFX-AUSJPIAWSA-N 453.927 0.069 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1839148384 XHLALDGLISKJRF-UTKZUKDTSA-N 453.971 0.806 50 20 JCGD O=C1Cc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc2N1 1839200419 HSCHHDLIFWJRPF-LPHOPBHVSA-N 470.295 0.942 50 20 JCGD O=C(c1nn[nH]c1C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201896 MYLMYVWXOLMOMG-MFKMUULPSA-N 474.209 0.584 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)CCO2 1839396096 WWLNRXINNVXRIA-RUZDIDTESA-N 490.325 0.140 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)ccc(O)c1F)CCO2 1839412536 YLQLLAVOMMUGQZ-NRFANRHFSA-N 470.473 0.113 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839668007 UVHOSBWLQOXLNP-ZBQZNYHESA-N 487.326 0.347 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1840032864 MJKIZFUBUWYYOK-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD CCOc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)cnc2c1cnn2C 1840151552 FRZIBENRMSVQRV-VGSWGCGISA-N 495.964 0.691 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4c(F)cccc4n3)C2)C1 1840154719 DSYZVSZVLAIYGE-JLTOFOAXSA-N 454.886 0.797 50 20 JCGD Cc1nc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)s1 1840183510 INWCDORTUCLJPH-FQEVSTJZSA-N 453.565 0.203 50 20 JCGD C[C@H](Cc1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840471235 SCYWPTRLKCFCOL-MWTRTKDXSA-N 471.514 0.227 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2 1840542976 CHZREYJNBWLZEU-KGMOOGKZSA-N 471.558 0.726 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)[C@H](F)C1 1843013225 WIINRGZLARMGLI-RTBURBONSA-N 489.353 0.779 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CN1C(=O)COc3ccc(Cl)cc31)C2 1846384091 BUASTWKHOBTDKH-UHFFFAOYSA-N 477.949 0.642 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN 1847650048 RSFJSURDZFQFOT-PMACEKPBSA-N 465.510 0.920 50 20 JCGD CC(C)Oc1ccc(NS(=O)(=O)CC(=O)NNC(=O)CNC(=O)c2cccs2)cc1 725739359 CPTQMMXHKHCRFI-UHFFFAOYSA-N 454.530 0.854 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)s1 726088785 QQDJXVMRUKSUBW-UHFFFAOYSA-N 457.534 0.632 50 20 JCGD COc1cccc(-n2c(CC(=O)NNC(=O)Cn3cnnn3)csc2=NCc2ccco2)c1 726184620 DITYSMHYJVSNEJ-UHFFFAOYSA-N 468.499 0.618 50 20 JCGD CCCS(=O)(=O)Nc1cccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 728320153 ZUVDJHYGZNKODG-GOSISDBHSA-N 477.495 0.983 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(OC)c1OC 728981721 YIXBWAAFFXEUKY-UHFFFAOYSA-N 472.502 0.296 50 20 JCGD CCOC(=O)/C(C#N)=C\NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 730963616 QBAJDQHSPQZNQD-WJDWOHSUSA-N 465.470 0.019 50 20 JCGD C[C@@H](Oc1ccc2ccccc2c1)C(=O)NNC(=O)NCCS(=O)(=O)N1CCOCC1 748111186 IDDVGBCHHYYADS-OAHLLOKOSA-N 450.517 0.600 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)C2=CC=CN3CCS(=O)(=O)N=C23)c2ccccc2c1=O 761441563 AVFTVSXINBKWHZ-UHFFFAOYSA-N 484.538 0.845 50 20 JCGD Cc1ccccc1C(=O)NNC(=O)[C@H](CCC(N)=O)NS(=O)(=O)c1ccc2c(c1)OCCO2 769682275 MWOISQRHFIIHEJ-INIZCTEOSA-N 476.511 0.140 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H]1Cc3ccccc3O1)c(=O)n2Cc1ccccc1 789855617 ZACIHXNJLLZAAH-IBGZPJMESA-N 488.504 0.579 50 20 JCGD O=C(NC[C@]1(N2CCOCC2)CCSC1)NNC(=O)c1csc(N2CCOCC2)n1 915257717 HCFPURXWPSOBPP-GOSISDBHSA-N 456.594 0.132 50 20 JCGD CN(C)[C@H](CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccco1 915896430 DNEHBKICRVODQZ-LJQANCHMSA-N 493.586 0.866 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1nncn1C 916580670 PHLAAKJOTIACNS-AWEZNQCLSA-N 457.516 0.999 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 919745091 SMFUZGWXYIPFOZ-NSHDSACASA-N 474.948 0.840 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)CS(=O)(=O)N2CCN(c3cccc(C)c3)CC2)cc1 919807525 UMVVYGSEKBBQBL-UHFFFAOYSA-N 460.556 0.982 50 20 JCGD NC(=O)[C@H]1CCCN(c2ccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2)C1 1321931651 QDJOYOZXNFIGPC-HNNXBMFYSA-N 458.544 0.756 50 20 JCGD COc1nc(C)ccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032465 KWCIDELBUGBVID-QFIPXVFZSA-N 454.487 0.154 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NNC(=O)C2)C1 1779307137 LLKQGOJCGPLTHI-XMSQKQJNSA-N 487.469 0.524 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1779350072 CNTUCDLDDCQBIS-LJQANCHMSA-N 451.210 0.471 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CC(N)=O)CCO2 1780095238 LHNDZRQZIROZJO-LRTDBIEQSA-N 462.459 0.475 50 20 JCGD O=C(CC(=O)Nc1ccc(F)cc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1780522374 KBDVFEWVWWAAEX-PXDATVDWSA-N 497.332 0.662 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccn1C)CCO2)NC(=O)NCc1ccccc1 1780969954 PKIHCEWEBQCOMX-DEOSSOPVSA-N 468.558 0.815 50 20 JCGD CN1CCC[C@H](C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)C1 1781001374 MWPRJGFHMVZMIE-OFVILXPXSA-N 486.617 0.504 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c(C3CC3)c1F)C2 1782209499 UHZHTQOTCNSPSG-IVZQSRNASA-N 464.542 0.927 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1 1782214232 MFFWRNZTIUJROH-CJFMBICVSA-N 488.585 0.903 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)[S@@](=O)c1ccccc1 1782681481 RAFBPWVQUMXFAE-CXBRMTMQSA-N 470.356 0.006 50 20 JCGD CC(=O)NCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783023003 SACGDSIRQCPHOT-YLJYHZDGSA-N 452.349 0.959 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2cc(C)c(O)nc2=O)C1 1783118087 IUYVFYGEYCDCHS-BXTJHSDWSA-N 485.379 0.945 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783535605 AGMKWUWCYFPZNX-IIBYNOLFSA-N 496.406 0.946 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1783553687 DOFQRCQARMKCPD-XYHYBEPMSA-N 499.373 0.209 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1)CCO2 1783871231 OEOJWZNCGZPASM-HRAATJIYSA-N 489.997 0.832 50 20 JCGD N#Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(Cl)c1 1786984985 GJRZAYNJCJWXRZ-LRQRDZAKSA-N 467.718 0.799 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CN(C)C3)C[C@@H]21 1789221843 KLLDCYPGNZVYRL-DCPHZVHLSA-N 460.487 0.675 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1789382938 OAZZLUXHFMPOLE-ZWOKBUDYSA-N 462.595 0.993 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1797939974 CSHDSWUSKWLOGV-JBXGNFEISA-N 472.970 0.399 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799045041 WGVOMDQIVYTRTQ-BBIADKPPSA-N 490.325 0.252 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1799070885 SIIQTIRSCPUGMG-DDOVSQSKSA-N 491.894 0.340 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)c2n1 1801012607 BUPDDRRVSSUQHA-UPHUGPLXSA-N 456.547 0.527 50 20 JCGD C[C@@H]1[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)CCN1C(=O)OC(C)(C)C 1802254635 XYAHVZRDKGWHKZ-ZIKOTGLESA-N 495.621 0.595 50 20 JCGD CC(C)c1nc(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)no1 1804412751 HHBWQHSZMMZDAU-XMSQKQJNSA-N 477.330 0.830 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994166 QMURBCKICBSFIX-IERDGZPVSA-N 462.271 0.201 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1 1810485043 BLFOIFGVGDVHRX-JENIJYKNSA-N 461.950 0.988 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)CS(C)(=O)=O)CC2 1817275736 BLSYEAZPCSGEJS-WBXLDWLQSA-N 494.599 0.870 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1CCc2nc[nH]c2C1 1822687899 XEIIVECSBQMNTI-VLIAUNLRSA-N 462.319 0.924 50 20 JCGD O=C(COc1cccnn1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822752795 RAUMAPLXNWJWLA-QGZVFWFLSA-N 450.264 0.264 50 20 JCGD O=C(CN(CCO)CCO)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2 1825327794 QTKYEJBJLPEMMW-RNCFNFMXSA-N 453.334 0.032 50 20 JCGD O=C(CSc1nc[nH]n1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060553 PSTLFYWZNULYTF-GOSISDBHSA-N 457.365 0.510 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(O)O)C2)C1 1829221103 KKBRUTNGJMTIKR-SFTDATJTSA-N 488.368 0.986 50 20 JCGD C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1829263396 ZCQKTDIZLZPUDP-RUZDIDTESA-N 475.310 0.065 50 20 JCGD O=C(O)C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829330214 CFBVJQCKFFLVPE-JTSKRJEESA-N 477.901 0.126 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829715236 VIQBGKSRAXLGBX-QZTJIDSGSA-N 454.420 0.728 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725997 NELWJJOGEQDZAJ-CNNODRBYSA-N 452.935 0.747 50 20 JCGD COc1ccc(-c2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)n[nH]2)cc1 1830727690 BJAGPOVLERFLIZ-DENIHFKCSA-N 478.933 0.755 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccc2c1OCCO2 1830728176 QAKKDCPRLHQWSH-KKSFZXQISA-N 454.907 0.436 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873723 URTRCLBLCGMRIA-RBUKOAKNSA-N 453.584 0.130 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccnc3OC)CCO2)C1 1833508097 BEPHCJPICKUXEI-ACJLOTCBSA-N 457.325 0.729 50 20 JCGD Cc1noc(C)c1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834154296 IZRHPEUBUPHOAC-UHFFFAOYSA-N 454.336 0.470 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4cccnc4[nH]3)CC2)CC1)c1cccc(B(O)O)c1 1834800170 WIJBEOHNBWMHFV-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1 1834801051 KRQJWUASJIARJM-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1834823380 QTIDSSJBXIIQKF-LJQANCHMSA-N 471.352 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(Cl)cc3)CCO2)C1 1835059211 LDFBHUSYSJKSDJ-HSZRJFAPSA-N 487.944 0.651 50 20 JCGD CC[C@@H](C)[C@@H](N)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737059 UZTJEPLAICLSGZ-FOIQADDNSA-N 459.595 0.244 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835819059 SVSIUEIWKIVYSS-MRXNPFEDSA-N 487.605 0.175 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc12 1835930689 UKWWLTPAVMMPTF-VWLOTQADSA-N 477.326 0.540 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835933814 GIEDBTSAZKSNLX-AVRWGWEMSA-N 477.326 0.377 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1Cl 1835934380 YAMNIIMKBLRHQZ-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD O=C(c1nc(-c2ccccc2)ns1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836249884 MTKUBHOIJBWZOB-QRWLVFNGSA-N 466.947 0.875 50 20 JCGD CC(C)Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)n(C)n1 1836337959 JSJZPSBZDKHBRQ-HSZRJFAPSA-N 478.594 0.062 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1 1836413524 IHUDZEHRGNWIGQ-OAHLLOKOSA-N 456.378 0.683 50 20 JCGD Cc1occ(C(F)(F)F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836557358 ULEWFGVTZUXURI-NRFANRHFSA-N 496.247 0.670 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)n1ccccc1=O 1837684377 QTOBLDHAYLXQRA-HNAYVOBHSA-N 456.337 0.651 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(=O)nc3sccn13)CCO2 1838418741 MUZHKFQAAMBAOY-FQEVSTJZSA-N 480.619 0.678 50 20 JCGD CC(C)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054056 DXIDMUGAFLIVJG-HSZRJFAPSA-N 461.563 0.445 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccco3)C2)C1)NC(=O)NCc1ccccc1 1839054179 KKWSAHJMSJYLIR-XMMPIXPASA-N 485.541 0.696 50 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KLFVCGPAPQKTED-HSZRJFAPSA-N 461.563 0.234 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1F 1840793557 DNPGPUFXVJMHIK-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015491 JZFCFWLEZYMRMF-GOSISDBHSA-N 459.352 0.877 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1844692336 LULLCMPTOKVNLF-UHFFFAOYSA-N 467.243 0.331 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1847078566 USQLVYLKGQZTKB-YTQUADARSA-N 469.347 0.581 50 20 JCGD Cn1c(CC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)nc2ccccc21 26538290 CZDXOSKNTMPQCZ-JOCHJYFZSA-N 452.446 0.870 50 20 JCGD CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(F)c1 728854026 JWCJLNHWGHMXEN-UHFFFAOYSA-N 472.524 0.213 50 20 JCGD N#Cc1nc(C2CC2)oc1N1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 728959852 QZAAYWDSJWBSTR-UHFFFAOYSA-N 465.518 0.993 50 20 JCGD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 729281645 AEUAERRFQZUUFY-OAHLLOKOSA-N 471.547 0.337 50 20 JCGD CC(=O)Nc1cccc(OCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 729613161 ADUYMLIRJLIGAB-UHFFFAOYSA-N 463.516 0.918 50 20 JCGD COc1ccc(NC(=S)NNC(=O)Cc2ccc(OC)c(S(=O)(=O)N3CCOCC3)c2)cn1 729693085 HROGPYZZGIRCCH-UHFFFAOYSA-N 495.583 0.680 50 20 JCGD CCn1c(CCC(=O)NNC(=O)C(=O)N2CCCC2)nc2cc(S(=O)(=O)N(C)C)ccc21 748246938 GMDVWKKCUQHVQL-UHFFFAOYSA-N 464.548 0.009 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H](C)N1[C@H](C)CC[C@H]1C)c(=O)n2Cc1ccccc1 750602700 INXSGDOBGWPEHQ-KURKYZTESA-N 495.584 0.837 50 20 JCGD NS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 819844883 SDDJIJLMSSZOBA-OAHLLOKOSA-N 469.859 0.132 50 20 JCGD COc1ccccc1N1C[C@@H](C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1=O 849206412 MSKNBOWNHBOHQC-AWEZNQCLSA-N 456.411 0.961 50 20 JCGD Cn1nc(C(=O)NNC(=O)NC[C@H]2CN(Cc3ccccc3)CCO2)c2ccccc2c1=O 915895018 UBCWNCNFALBOFZ-KRWDZBQOSA-N 450.499 0.779 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)[C@@H](C)Oc3ccccc3F)cc2S1(=O)=O 916742333 FJXCXVDVHMDKJQ-GFCCVEGCSA-N 465.459 0.845 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(C)c1 917728724 JISTXZTVYAAKPU-UHFFFAOYSA-N 497.595 0.967 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cnsn1)N(S(C)(=O)=O)CC2 918319655 WEBMZZYBIPTNQI-CYBMUJFWSA-N 455.518 0.265 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778057507 ZAPAVAQSTJCJDE-ASSNKEHSSA-N 474.905 0.268 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C2)C1 1778174858 KKJLPTARUPQSCQ-XXBNENTESA-N 457.531 0.707 50 20 JCGD Cc1nccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)n1 1778310250 RKQGOJTZBDZZRZ-XMSQKQJNSA-N 453.503 0.225 50 20 JCGD CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028588 NBPYRKIMWSYZHX-PXDATVDWSA-N 478.553 0.185 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1779350000 BUPMZRNINCRHLM-LJQANCHMSA-N 466.420 0.789 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)C1(O)CCC1 1780968874 KEWBCQCCBNCAHF-NTKDMRAZSA-N 487.601 0.714 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)C2)C1 1781116028 ZJNZUCNNHMFOEY-CJXDPKRBSA-N 490.395 0.828 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cccc(-c4cnco4)c3)C2)C1 1781792857 QMQJOXILNDBOMJ-XMMPIXPASA-N 461.283 0.779 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782545046 LLCLVIRWWFKQTP-XKDCRVNJSA-N 469.546 0.345 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1783555586 QYWGNBMOSGPOOQ-ZULIPRJHSA-N 460.579 0.344 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1csc3c1CCCO3)CCO2 1783934111 YORVMCKIFREFHN-NRFANRHFSA-N 450.561 0.890 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(-c3cccnc3)[nH]n1)CCO2 1783935062 NMLGSOFWHIKDRL-QFIPXVFZSA-N 455.519 0.288 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(Br)cc1O)CCO2 1783935475 UVZIFOWBUGLEHS-FQEVSTJZSA-N 483.363 0.971 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1 1783939170 APYCRXNDQJLMKX-OAQYLSRUSA-N 455.556 0.104 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)CCS(C)(=O)=O)C2)C1 1784741268 HTXDJPWLPRYORW-LIRRHRJNSA-N 481.999 0.383 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cc(F)ccc4n3)C[C@@H]21)c1cccc(B(O)O)c1 1786984224 RMROTKWEWCZKDV-QSFXBCCZSA-N 466.278 0.060 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cccnc4n3)C[C@@H]21)c1cccc(B(O)O)c1 1786984270 XHOSKYCZBXIZAX-CUWPLCDZSA-N 460.299 0.217 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786985234 UDAYQNSRXWEZTD-VDGAXYAQSA-N 480.305 0.369 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789925990 KXUJVRGZLCUPRO-LXFSFDBISA-N 467.288 0.151 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C(C)(C)C)cn3)C[C@@H]21 1791291470 WBMWGOBEEJEZLC-BQFCYCMXSA-N 460.579 0.740 50 20 JCGD COc1ccc(F)cc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791376389 GLMQSYFQKZKTTE-BUKVSMQUSA-N 470.306 0.350 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792980993 ORSYZTSOWQMCJB-RBNVPPIJSA-N 455.851 0.323 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(O)nc1O)C2 1793879725 BXYXNCWFDXOMQY-XCCSTKFXSA-N 485.925 0.223 50 20 JCGD CS(=O)(=O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1795362305 MFJDLUSLZZWRPC-KYHPRHEASA-N 473.389 0.627 50 20 JCGD Cn1ncc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)cccc21 1797090104 RZRIUEWHLJMJRT-VTEUUUEMSA-N 463.498 0.089 50 20 JCGD CC(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095452 XWEXTCCFTXWOGC-HATOLVCRSA-N 461.563 0.347 50 20 JCGD 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FKDIVRVXKDPVQJ-SFHVURJKSA-N 497.599 0.745 50 20 JCGD C[C@@H](CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)N(C)C1CC1 729617983 XHVYSHZMTIBCRJ-INIZCTEOSA-N 467.592 0.453 50 20 JCGD O=C(Cc1ccccc1F)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 731358441 ULNCENGJYLOQGJ-UHFFFAOYSA-N 450.492 0.920 50 20 JCGD C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1=O 748547602 VYMBYXFZSPMGCZ-UHFFFAOYSA-N 488.464 0.126 50 20 JCGD CSCC[C@@H](C(=O)NNC(=O)CNC(=O)c1ccco1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 751204162 DYETYNBPLAGSJK-MJBXVCDLSA-N 450.517 0.454 50 20 JCGD O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)cc1Cl 751283690 ZJPXXGOBWIUWEG-UHFFFAOYSA-N 459.864 0.916 50 20 JCGD COCCNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)NNC(=O)c2cccs2)c1 803098443 NMASBEAWMMEHAU-UHFFFAOYSA-N 455.514 0.599 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)N1CC[C@@H](B(O)O)C1 864234060 OVVFRNGBQZGHKW-BXUZGUMPSA-N 465.200 0.924 50 20 JCGD COC(=O)c1c(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)n[nH]c1C 912520611 CZMMWZIUBBKEQT-UHFFFAOYSA-N 465.517 0.549 50 20 JCGD CCOc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1 913479267 RZRHWZUMPMXCFE-UHFFFAOYSA-N 477.568 0.837 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CC(=O)N(C3CCCCC3)C2)cc1 914830739 UQRYAGJKQBCNJD-INIZCTEOSA-N 450.561 0.944 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@@H](c3ccccc3)N(C)C)nc2)CC1 915891033 CRCCVBGXOBXFEG-IBGZPJMESA-N 461.592 0.947 50 20 JCGD O=C(NCCS(=O)(=O)NCc1ccccc1)NNC(=O)c1csc(N2CCOCC2)n1 916645334 ROPPZOXXXWHCCR-UHFFFAOYSA-N 468.561 0.043 50 20 JCGD Cn1nc(C(=O)NNC(=O)CNC(=O)c2ccc(Br)s2)c2ccccc2c1=O 917387818 NVZCQWYJQQMGFJ-UHFFFAOYSA-N 464.301 0.949 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)COc3ccc(F)cc3)cc2S1(=O)=O 917917068 TWWOBCJVTXJRJS-UHFFFAOYSA-N 451.432 0.457 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(Cc3ccccn3)C2)ccc1Cl 917919821 YISZNZHTPZIMPM-GFCCVEGCSA-N 451.892 0.192 50 20 JCGD C[C@@H]1CCCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)C1 919886394 WDNKOWYLRNINLS-UKRRQHHQSA-N 458.562 0.238 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(N3NC(=O)CCC3=O)cc2)c1 920288013 PSPMLHJALNPJAT-UHFFFAOYSA-N 487.538 0.950 50 20 JCGD CSCC[C@H](NC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(=O)NNC(=O)NC1CC1 920766455 UZIQSKBYCZUDHQ-KRWDZBQOSA-N 499.615 0.052 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCC(=O)NC1)C2 1778091347 BMHPIGCMHKIQBW-GGGSDYILSA-N 472.546 0.161 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3c(Cl)cccc13)CCO2 1779037287 UYISNBUYHDXRQU-QFIPXVFZSA-N 483.916 0.972 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(Cl)cnc1O)C2 1779371552 BXJGEDQYTQYPAM-VGOFRKELSA-N 488.932 0.880 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc(O)c4ccn(C)c34)C2)C1 1779979365 BDDCHJPEFAEDQM-QFIPXVFZSA-N 458.519 0.095 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](N)c1ccccn1)CCO2)NC(=O)NCc1ccccc1 1780969431 GPVQQZMLUPZIFZ-WIOPSUGQSA-N 495.584 0.258 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1781112295 WMHUINVLDHOUFI-APWZRJJASA-N 457.413 0.770 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1781998423 UDDGJZDOJOHVAS-YRILPIOLSA-N 489.392 0.749 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2C[C@]2(F)Cl)C1 1782287562 PYUKQRKQUQRMQO-KQEPKPNTSA-N 453.902 0.737 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)CC1 1783592712 XJLGTWQNJCWYQJ-VGWMRTNUSA-N 459.971 0.871 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(Br)c(O)c1)CCO2 1783934385 FRPJEKHALSIUPM-FQEVSTJZSA-N 483.363 0.971 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1cc(F)ccc1[N+](=O)[O-])CCO2 1783939574 JUEONBXQSOMBFT-OAQYLSRUSA-N 465.482 0.479 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3C(=O)Cc4ccccc4C3=O)[C@H]2C1 1784160848 HTEOLMXCGMUNQQ-LEAZDLGRSA-N 491.972 0.835 50 20 JCGD COc1ccc(Cl)c(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1784944322 HHARODGLEMJPQY-QFIPXVFZSA-N 458.707 0.786 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1785113951 ZMKQZZQKDGCKDN-HSZRJFAPSA-N 466.498 0.401 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(=O)n3O)[C@H]2C1 1785625819 ISXQAIFMMNPFBV-JKQORVJESA-N 498.964 0.811 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc2nc(Br)nn2c1 1787149622 UDFSHXVMBFIZCN-FQUUOJAGSA-N 486.754 0.685 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)ncc1[N+](=O)[O-] 1787641933 CELGGIIKFAOHRQ-MPGHIAIKSA-N 462.507 0.265 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCNC4=O)[C@H]2C1 1788258069 DUFSARUNMFFXMA-DVZHBHJUSA-N 468.352 0.393 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc2cc(F)ccc2[nH]1 1788269441 VRIJOCXTCLKBBF-OHEPNIRZSA-N 465.290 0.894 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C[C@@H]21 1788609937 UMPUFKXNTILQSC-LRQRDZAKSA-N 492.536 0.477 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cc(F)ccn3)C[C@@H]21 1788611521 IUUIJVBWGPCBHA-GKCIPKSASA-N 470.505 0.445 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](COC(C)=O)OC(C)=O)[C@H]2C1 1788640489 SAHAOSQGYGTQNT-QUSNUVHPSA-N 477.352 0.634 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(F)(F)F)[nH]3)[C@H]2C1 1788795663 RKQGTIMOGQKYRP-YDHLFZDLSA-N 459.469 1.000 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4snnc4c3)[C@H]2C1 1789202751 DBRSLGFEOFHRSX-IVXIXMAJSA-N 496.553 0.814 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)n(C(F)F)n1 1789332072 NLZKNLGLQRKHKN-NUTKFTJISA-N 477.472 0.492 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)C1CCN(c2ccccc2)CC1 1792905655 LWSCNZPONKOXNQ-RUMRUAAYSA-N 477.370 0.486 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792983961 WCOUHYRXOYHGEP-XWCCPHMRSA-N 455.914 0.062 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNCP(=O)(O)O 1795966786 PUTPRRRKAFCLJA-BTTYYORXSA-N 484.402 0.497 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1CC(=O)N(C2CCCC2)C1 1796188019 VOMILMPLSVPDLA-FRTACKCFSA-N 453.348 0.409 50 20 JCGD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[S@](=O)c1ccccc1 1796190399 UNAKCSVDMTXTLL-SNTIRWHOSA-N 454.357 0.815 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl)NC(=O)NCc1ccccc1 1796367279 DKFLBQWSOUXTEC-CYGHRXIMSA-N 455.918 0.457 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1N(C)C)C2 1796441323 YOEUGSDELSKWHN-IHBLFXCCSA-N 467.530 0.485 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(OC(F)F)cc1F 1798553054 GIGQFVINPRBSED-HBCWATKFSA-N 478.232 0.624 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@H](F)Br)CC1 1800159451 GQEQVOSSDHKBOO-CRWXNKLISA-N 454.362 0.987 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2 1800638088 PTAZRNRHKDKCGY-ZQNQSHIBSA-N 478.384 0.635 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)=NO2)C1 1800710341 DWIAXCBXMHPXQR-NEBZKDRISA-N 474.917 0.876 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)cn1 1801016053 DKIODJVITRKMJL-DABQJJPHSA-N 450.344 0.633 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1c(Br)cnn1C)C2 1802336587 NOLAMQBLBQWHMV-CLLJXQQHSA-N 455.357 0.807 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1C 1803288293 DGELXZNEBQCKPU-HTAPYJJXSA-N 476.541 0.684 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1804190813 NZJQSMPSNFWEQY-ZQIUZPCESA-N 466.336 0.813 50 20 JCGD CN(CC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)C(=O)c1ccccc1 1805845953 MJBZXNJGZYZXGD-UHFFFAOYSA-N 477.370 0.983 50 20 JCGD COc1cccc(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807362990 NJFLNQJIAMTTDT-YADARESESA-N 474.326 0.727 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(-n3cncn3)c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365361 IUEDFHZPLJCLDK-XUZZJYLKSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnc2[nH]ncc2c1 1809703365 KVNLPCVZZVTUTA-UWJYYQICSA-N 470.298 0.666 50 20 JCGD N[C@H](CC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)c1cccnc1 1809885422 ZXZPNEWJFXURFE-OAQYLSRUSA-N 450.348 0.696 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)nc1 1809968389 YWJZQSGBELKQKH-UHFFFAOYSA-N 485.371 0.324 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809978759 OOAFDSJMMRQJDT-HUXSYLCKSA-N 457.336 0.740 50 20 JCGD COCCOCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810298168 GXFLGVZKEGGHJL-JXFKEZNVSA-N 456.503 0.063 50 20 JCGD COc1cnc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1 1813071077 MKVPVBFDQNJLBT-IERDGZPVSA-N 455.519 0.573 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1)[C@H](O)CCl 1814874937 JLDUQSQKOXOCBZ-GXTWGEPZSA-N 452.855 0.772 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnn2ncccc12 1817954142 NVFNMMQMUVSLRO-IBGZPJMESA-N 459.275 0.752 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnn2c1OCCC2 1821429635 GPPXSARWCKHTLN-GOSISDBHSA-N 464.291 0.688 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1 1824188582 SSYVIYSUOGBUJZ-RDJZCZTQSA-N 454.911 0.976 50 20 JCGD O=C(Cc1ccccc1O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825299627 JQRNXJLOIUAQQY-MRXNPFEDSA-N 451.313 0.997 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3ncccc13)CC2 1826085197 JMEZMALJBLHKCO-GFCCVEGCSA-N 456.532 0.785 50 20 JCGD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052432 ZEEUHBYOUQTMKA-KRWDZBQOSA-N 455.280 0.545 50 20 JCGD O=C(COc1cccnn1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059552 DBIMBAJCSQAXAI-FQEVSTJZSA-N 452.320 0.469 50 20 JCGD C[C@H](O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829321361 DNPDQIJHVTVEBI-LUQKVYGDSA-N 453.923 0.419 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829640306 FQFSKFKBWUKSSW-OAQYLSRUSA-N 451.332 0.612 50 20 JCGD CSCC[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1 1830544139 ODFCUGXJHRMASF-KEYYUXOJSA-N 453.399 0.588 50 20 JCGD CC(C)COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccn1 1830727726 CPSXELGPSWDWOJ-DYESRHJHSA-N 455.939 0.786 50 20 JCGD O=C(c1ccc(N2CCCOC2=O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830736611 UYSNRJMEGRDADX-XMSQKQJNSA-N 481.933 0.703 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830736942 XUZYIVMPFCLGOJ-ZPGKAZOCSA-N 487.981 0.300 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1831139333 QOJMHCFJXYYLBS-IERDGZPVSA-N 473.954 0.220 50 20 JCGD Cc1nn2cc(CC(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Br)C4)C3)nc2s1 1832109986 WSAYOCKFVUGCEE-PBHICJAKSA-N 490.355 0.789 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccnc1S 1833079908 NSORDQUTCVASCY-UHFFFAOYSA-N 468.388 0.549 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC(N2CCC(NC(=O)C(O)O)CC2)CC1 1833220282 KNPSBIFZUANHHV-HNNXBMFYSA-N 462.975 0.001 50 20 JCGD O=C(Cc1ccc2c(c1)OCO2)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834537781 BNUDDVPHQIOHGF-UHFFFAOYSA-N 493.369 0.523 50 20 JCGD CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc1 1834797457 KZGPBZUSTYRCKA-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C(Cl)(Cl)Cl)CC2)CC1)c1ccc(B(O)O)cc1 1834799122 ONBOOLJIPQHTHQ-UHFFFAOYSA-N 476.597 0.922 50 20 JCGD CSc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801087 KGIFKTLTFNKADU-UHFFFAOYSA-N 482.415 0.982 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1834973310 PSOBNYHGHPYNFC-AWEZNQCLSA-N 495.382 0.171 50 20 JCGD NC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1 1835817506 FHTWNDOSEAXJHU-TXPKVOOTSA-N 458.328 0.876 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccnc(Cl)n3)CC2)CC1 1835910967 IUJZXFDMXHSRPY-UHFFFAOYSA-N 486.964 0.628 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(Cl)s3)C2)C1 1837456915 SLYQOJFFBWSNCC-NRFANRHFSA-N 493.973 0.713 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccn3C)C2)C1 1838528037 BCSRHTCHSCHUJV-QFIPXVFZSA-N 487.469 0.637 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1F 1838537464 MHSMYMFEPKZEMS-KKSFZXQISA-N 472.897 0.672 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)c1ccc(F)cc1 1839037930 FOOVWAOOORVKJR-SQGPQFPESA-N 459.877 0.994 50 20 JCGD O=C([C@@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1 1839199853 XBROGSNPYATYMZ-MBOZVWFJSA-N 470.339 0.848 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccn3nccc13)CCO2 1839538772 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O=C(COC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)NNC(=O)[C@@H]1COc2ccccc2O1 823476856 ZJOATPZNUNTFRG-IBGZPJMESA-N 486.437 0.576 50 20 JCGD O=C(NCCCN1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 915880549 JOBBIAZCWRREMU-UHFFFAOYSA-N 475.571 0.831 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(S(N)(=O)=O)c1 916197072 MUSSUTCPQMTLTD-GFCCVEGCSA-N 469.545 0.290 50 20 JCGD CC(C)(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 916622257 DBIKUWSZJULQGI-UHFFFAOYSA-N 475.593 0.133 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1cc[nH]n1)N(S(C)(=O)=O)CC2 916636084 QRONLFNZCRUDBL-OAHLLOKOSA-N 466.520 0.206 50 20 JCGD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 917278640 HTIZSFPWLKKQGQ-YOEHRIQHSA-N 469.516 0.111 50 20 JCGD Cc1c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)nnn1-c1ccccc1 917531854 GKIGHHOJBAPOIK-UHFFFAOYSA-N 498.565 0.990 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O)c1cccc([N+](=O)[O-])c1 918547304 NUBPKWPXRRCBLU-HNNXBMFYSA-N 474.451 0.993 50 20 JCGD Cc1c([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cnn1C 1115854205 BSFJVCBARMSXHI-ZDUSSCGKSA-N 450.521 0.455 50 20 JCGD Cc1c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)ccc2c1OCCO2 1777930992 OHPZZWDEZZHCKW-ATIYNZHBSA-N 494.353 0.887 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(-n2nccn2)c1 1779032481 LHQZUVYQGMHUEV-XMMPIXPASA-N 490.524 0.332 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC[C@H]1CCOC1)C2 1779374850 FQULBWZSRIPREW-XKDCRVNJSA-N 459.547 0.629 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCCN3C)C2)C1)NC(=O)NCc1ccccc1 1781030805 CQPHARCOHUYRFI-PXDATVDWSA-N 486.617 0.647 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1781222396 TUMCPMCSATWAHG-XLIONFOSSA-N 450.960 0.530 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)N1CCCC1)C2 1782209085 KCEPNALQYNBLCS-WZONZLPQSA-N 465.595 0.276 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ccncc13)C2 1782214159 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50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cccn3)[C@H]2C1 1787099877 VZPRNAOFGRSCER-QAETUUGQSA-N 469.970 0.995 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS(=O)(=O)N3CCCC3)[C@H]2C1 1787505521 DWJKYBFNDGCRDM-XSWJXKHESA-N 470.419 0.628 50 20 JCGD CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788143511 KHNFFXIBTAQTLI-UHFFFAOYSA-N 452.320 0.487 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ncn3)C[C@@H]21 1789220661 BVEJPPYIEOSHDZ-AXHNFQJDSA-N 485.453 0.923 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCN(C)C4)C[C@@H]21 1791257231 SMURUQQSQRQTPH-XPYUAMARSA-N 453.971 0.566 50 20 JCGD Cn1c(=O)c2c(CC(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@H](O)CCl)csc2n(C)c1=O 1793115569 RRVMKMBNZAGUCN-XJFOESAGSA-N 468.963 0.079 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1 1793147200 SNOFXJCIWGTWIC-DVWBAYGPSA-N 499.398 0.294 50 20 JCGD 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CN1CCC(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1802568225 YOKDYRQHVXBUCI-GHTZIAJQSA-N 465.558 0.742 50 20 JCGD NC[C@H](C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccc1 1807250646 ALXCOZXCQLZMMP-NHTMILBNSA-N 472.354 0.824 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359760 DLZNYUNRNIBEJO-GCJKJVERSA-N 470.298 0.438 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)[C@H]1SC(=N)NC1=O 1808392740 IHYIQLIDQWFQLD-XKNKYKOPSA-N 453.952 0.490 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810121446 KUEDLDMTJPYBCB-AKZDSRSJSA-N 457.361 0.240 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n[nH]1 1810420677 WDROYSLSDHTAHV-HRAATJIYSA-N 462.514 0.674 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)n1ccccc1=O 1810517731 YISYMLISTYZNSD-HCLVMJGWSA-N 474.326 0.504 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810542606 UQASIEMDYKYJSR-NQIIRXRSSA-N 455.396 0.933 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1813074632 URWMTWZMDMYJGF-XXBNENTESA-N 497.600 0.761 50 20 JCGD O=C(CNC(=O)c1ccco1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815340827 PGGQSSIRULCOTB-AWEZNQCLSA-N 468.300 0.072 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)nc3sccn13)CC2)c1ccc(B(O)O)cc1 1815343848 SCUDUCAXYSDEDA-CYBMUJFWSA-N 495.351 0.432 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)CC1 1824572905 QXCARQYBWNNAMV-YKLHELRZSA-N 458.519 0.849 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1C(N)=O)CC2 1826088665 INRWTEMPTHINCH-GFCCVEGCSA-N 458.544 0.841 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)OC(C)(C)C)CC2 1826089682 LJJKQMXKXCZOEL-GFCCVEGCSA-N 468.580 0.953 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2)n1cccn1 1826858330 CXNJVBSWFOMJJM-NWDGAFQWSA-N 454.516 0.825 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(O)O)CCN2C(=O)OCc1ccccc1 1828522555 LWNSIYXKKSKMHP-JOCHJYFZSA-N 479.606 0.601 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829056574 NFUFQXDBTKHZSM-ORGXJRBJSA-N 482.940 0.696 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)s3)CCO2)C1 1834058434 SRQZPDQLEJGHHQ-FQEVSTJZSA-N 479.946 0.784 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccccn3)CC2)CC1 1834127008 IASPIRUHRUZNKW-UHFFFAOYSA-N 451.531 0.579 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1834734718 AIWCQVFKEDSNAC-DNVCBOLYSA-N 450.411 0.387 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(C)n1 1834798280 BLRMKHMMEJPHMB-UHFFFAOYSA-N 464.375 0.877 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3n[nH]c4c3CCCC4)CC2)CC1 1835002840 SBSGHPSJSFRYTP-UHFFFAOYSA-N 473.622 0.847 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3nccc4nc[nH]c34)CC2)CC1 1835028538 KXAOXDNVARXDBC-UHFFFAOYSA-N 491.556 0.455 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc4nccn4c3)CC2)CC1 1835738193 XDVKVSYRFWAVER-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3scnc3C3CC3)C2)C1 1835929589 XMTZHACBMMIJLD-QFIPXVFZSA-N 471.344 0.084 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ncc(Cl)cc3Cl)C2)C1 1835934011 LCAJGOFHTAWWDJ-NRFANRHFSA-N 494.140 0.452 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc(Cl)ncn1 1836026345 BPUAYWCDPMFWMA-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD N#Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(C(F)(F)F)n1 1836320459 DKFBUQOMWGHBQT-KDOFPFPSSA-N 476.839 0.642 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)CC1 1836717564 YGPGEOLAUABBTL-GOSISDBHSA-N 480.027 0.256 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1 1836884362 VXPWDNLPMSCQHV-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC=CO1)CCO2 1837410741 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458.519 0.006 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1 1840185254 ODYXIJVUXHENHI-QFIPXVFZSA-N 466.510 0.277 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C(=O)OC)cc3)CCO2)C1 1840279681 WOLHTEOMPUVDJA-AVRDEDQJSA-N 468.934 0.726 50 20 JCGD C[C@@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1ccccc1=O 1844366433 VNGCWFHBKAUSKJ-IBGZPJMESA-N 480.569 0.959 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)C(=O)Nc1cccnc1)C2)NC(=O)NCc1ccccc1 1845038985 QTNAYJQXXJDSLI-UHFFFAOYSA-N 479.541 0.570 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Br)C1 1845220812 PBNMPYCDQOEWTO-JQWIXIFHSA-N 465.320 0.649 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C)C2 1846364714 GHCKVLDVTCXYKW-GJZGRUSLSA-N 496.026 0.772 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cccc(B(O)O)c3)O2)C1 1847287931 RYTBCAYYSIRVBK-SLFFLAALSA-N 499.373 0.350 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)O[C@H]2C1 1847563276 HYMZREZIHUCIOJ-YTLBIWTGSA-N 457.955 0.812 50 20 JCGD CCCn1c(CCC(=O)NNC(=O)Cn2nc(C)cc2C)nc2cc(S(N)(=O)=O)ccc21 12666366 RFVKREALXUYNBM-UHFFFAOYSA-N 461.548 0.687 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1 15379469 YTFBQZBHTMUALM-UHFFFAOYSA-N 495.583 0.384 50 20 JCGD COc1ccc(NC(=O)COc2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2OC)cc1 15639479 JYERYFWOXMMOJG-HNNXBMFYSA-N 491.522 0.917 50 20 JCGD CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)s1 21967737 PIOAGUZMFBGXBB-UHFFFAOYSA-N 459.575 0.208 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)OCC(=O)NNC(=O)c3ccccc3)cc2)CC1 22426001 BEFSCAWLUGEZJQ-UHFFFAOYSA-N 488.522 0.157 50 20 JCGD O=C(Cc1ccccc1)NCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 28028178 LSNDRWWTAUZABI-UHFFFAOYSA-N 474.539 0.218 50 20 JCGD Cc1ccc(NCC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c(C)c1 726101773 PSHUXLUFXMNWPQ-LJQANCHMSA-N 496.611 0.645 50 20 JCGD CC(C)N(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)cc1 726242177 VQATWXQSUHGNFT-UHFFFAOYSA-N 451.505 0.569 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(=O)N2CCc3ccccc32)cc1 726281292 KMZGSNGUSUAIEH-UHFFFAOYSA-N 459.528 0.535 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)c1 729274949 HXUHJKNXIBPOOV-CQSZACIVSA-N 468.557 0.803 50 20 JCGD CNS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1 747408901 DKYFHYXBCJUNMD-UHFFFAOYSA-N 459.502 0.244 50 20 JCGD Cn1c(CC(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)nc2ccccc21 748464566 FJBGYUKMDDTHHW-UHFFFAOYSA-N 464.530 0.580 50 20 JCGD COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 749561441 QKHRERCITLLCDJ-UHFFFAOYSA-N 469.541 0.432 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 859422170 OWZLGWBVJASLTD-SFHVURJKSA-N 462.484 0.253 50 20 JCGD COc1cc(OC)cc(C(=O)NCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1 913391866 JTQDUBKPWSOSHA-UHFFFAOYSA-N 469.542 0.793 50 20 JCGD O=C(NCCC(=O)N1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 916251448 QWIJUUHQKHMYRD-UHFFFAOYSA-N 467.548 0.054 50 20 JCGD COc1cccc(/C=C(\C(=O)NNC(=O)c2csc(N3CCOCC3)n2)n2nnnc2C)c1 920425134 RYPPMYJMDBIIOU-GZTJUZNOSA-N 470.515 0.743 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)NCC1CC1 920859657 YQOIJRXXFIEYKF-CKDIWJPDSA-N 458.562 0.120 50 20 JCGD COCCN1C(=O)/C(=C/NNC(=O)CSc2nc3ccccc3s2)C(=O)NC1=S 920977571 CUELPXSPIQEGBF-CSKARUKUSA-N 451.555 0.783 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1778952445 DFBIEJHDRLRYEK-JLCFBVMHSA-N 491.501 0.671 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029703 XIWFWLVRCFHRSW-HSZRJFAPSA-N 454.531 0.706 50 20 JCGD COC(=O)NCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780098056 AFKWXCIHMGDLIC-FQEVSTJZSA-N 464.431 0.320 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@]3(NC(=O)OC(C)(C)C)CCOC3)C2)C1 1781312885 ZRRZNWXLRWURBZ-ONGXBYRLSA-N 475.970 0.754 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781337520 SZLOBCSMBNIEKH-SRBZOADZSA-N 495.346 0.276 50 20 JCGD O=C(COc1ccc(O)nn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2 1781492206 WHUFUDXXXHSYFY-FZKQIMNGSA-N 457.325 0.860 50 20 JCGD O=C(COc1ccc(O)nn1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1781493752 GYBILSPESLUQRN-XQAQDONZSA-N 461.288 0.765 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ccc1C 1781909817 CMRPUKWOLAZYLW-XMMPIXPASA-N 465.315 0.391 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781997696 DJYHYIWLIFLLBM-VVFCZOMOSA-N 453.142 0.277 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)COCCOCCOCCOC)C2)C1 1783679433 IONOSKCUTARVDL-NQIIRXRSSA-N 464.987 0.920 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4ccccc4[C@H]3O)[C@H]2C1 1784151852 KPUVWWIXPBLYHD-SREQLBMHSA-N 472.586 0.635 50 20 JCGD COC(=O)c1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 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467.526 0.828 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754490 ZGIRAMXSZSGCQW-MFCZKXCZSA-N 452.515 0.162 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(C(F)(F)F)ccn1 1798191161 KHBDMUOFHGWALG-ZSBFGKGUSA-N 463.221 0.297 50 20 JCGD O=C(/C=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)NCc1ccco1 1798569957 SOFCWGAHIDLXBP-MMLHABCJSA-N 451.288 0.084 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2 1800759771 HNUZWYZYXPXNEM-HAFSJTIUSA-N 478.384 0.635 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800917520 VYQQCOUBWJABKC-QEOTZNIISA-N 461.987 0.973 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1801244031 AGHPLLNWVGQGHF-GWCDLVAZSA-N 485.969 0.035 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1804074758 CTZXYYTXEHOJSH-FCGDIQPGSA-N 459.352 0.922 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H](CNC(=O)CNC(=N)N)[C@@H]1c1cccnc1 1807051709 KLAWIQMHIPPUNJ-VYDXJSESSA-N 481.985 0.703 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3cccnc23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362575 MDHJBBLIWZRNLI-RXVVDRJESA-N 470.298 0.438 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807368047 PPEPQAXVMASJPM-XUZZJYLKSA-N 499.373 0.151 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)Cc2ccccc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372366 DSXZCWFQYRNXFC-XWGVYQGASA-N 473.338 0.685 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807372977 LIIWIZBKLKRMHU-XFQXTVEOSA-N 469.303 0.643 50 20 JCGD O=C(CCc1cncnc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807499637 HWYZIXYVAWTAPL-NFBKMPQASA-N 459.315 0.504 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807616727 OJEZOGXBULFJJB-TZIWHRDSSA-N 496.373 0.994 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)N1CCN(C)CC1 1807897800 FZWNBLJDDXTAPA-LQBOVUBWSA-N 494.600 0.036 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1 1807913210 SYHWLLVKGZYJCT-KFKAGJAMSA-N 480.974 0.941 50 20 JCGD C[C@H](CN)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2 1814750542 WEKNNLZGKNLKMS-ZBFHGGJFSA-N 473.603 0.996 50 20 JCGD NC[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccc1 1815159742 JMUSXUASVLOANM-QZTJIDSGSA-N 464.356 0.791 50 20 JCGD COc1ccc([C@@H](O)C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1 1815335573 FPQICUBKTXZKRH-OXQOHEQNSA-N 481.339 0.791 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(OCF)cn1)CC2)c1ccc(B(O)O)cc1 1815337964 YDYRQWQHYQAQOT-CYBMUJFWSA-N 471.279 0.458 50 20 JCGD CCn1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1C 1815344367 VVYOCBFSRQMKDQ-OAHLLOKOSA-N 453.333 0.887 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 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NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCOC2=O)CC1 1828923295 BSFCXNOHJHCILH-GOSISDBHSA-N 458.519 0.371 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1828923907 YWOCLSMVELJTIZ-LJQANCHMSA-N 484.517 0.723 50 20 JCGD O=C(COc1ccc(O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1830346173 JEWHGSDMBRUGBI-AEFFLSMTSA-N 461.284 0.918 50 20 JCGD Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1C 1830532970 CKXYYVQIJVVLTA-LIRRHRJNSA-N 457.369 0.758 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1=O 1830726697 UAVUDDUTPYYHEG-IECBHUPTSA-N 493.988 0.712 50 20 JCGD O=C(c1ccnc(Br)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731483 LUNZJHVXMNFJNX-DYVFJYSZSA-N 462.728 0.514 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CC(N)=O)CCO2 1831610400 ZIHULXUYFPKXCQ-FPTDNZKUSA-N 492.485 0.102 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCCC(F)(F)F)CCO2 1832264852 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncon3)CCO2)C1 1838313934 JOKBKVUYZHYOGC-DJJJIMSYSA-N 473.914 0.272 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cccc1Cl)CCO2 1838870376 PDXNCPKTNVPNNQ-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839153839 SYYLXKZRPDAXDF-MDASCCDHSA-N 452.379 0.984 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839465839 QDRWQVWQBTUMGX-APWZRJJASA-N 457.867 0.279 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccc(O)nn1)CCO2 1839649925 RYEUHPJSDWAKCH-SFHVURJKSA-N 457.325 0.356 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839742318 VLMDHRKUYJZJCU-IXNCKXOBSA-N 497.520 0.763 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#CC(=O)O)C2)C1 1839743898 DAXDIXNXDMULLX-KYIYGJGQSA-N 459.405 0.416 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1839962513 IQOFZHNYOBMNSD-HZMBPMFUSA-N 493.248 0.972 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1 1840077726 ICIBLJWVMUGCGM-VQIMIIECSA-N 481.384 0.296 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cccnc4n3)C2)C1 1840184196 CMZIDIOIBHQKDU-HSZRJFAPSA-N 470.530 0.073 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1 1840511380 LORNOUWBCCIOOI-GQUZIAHASA-N 496.568 0.995 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840714592 ZUTWWCGVCKQSRW-AVRWGWEMSA-N 477.326 0.377 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cc(O)nc(O)n1)C2)NC(=O)NCc1ccccc1 1845038776 RUOCVHKXSTVWIR-UHFFFAOYSA-N 469.502 0.051 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847565551 UONRNMPNUMKDFP-QZWWFDLISA-N 461.868 0.953 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(F)c(C(=O)O)c1)c1cccc(S(=O)(=O)N2CCCC2)c1 13362397 BAQDQEPRFLWIAL-UHFFFAOYSA-N 471.488 0.932 50 20 JCGD CC(=O)N(CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Cc1ccccc1 726133665 OZNGDERWNJFPEK-UHFFFAOYSA-N 488.566 0.907 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccc(Cl)cc2)cc1 726276460 UAKONNXFHHJUDV-KRWDZBQOSA-N 494.957 0.968 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)nc1 726277029 GUNJCHXMASNYLP-QGZVFWFLSA-N 469.612 0.681 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(C(=O)OC)s1 726519849 OXAHKELZDFVLPM-NSHDSACASA-N 456.454 0.471 50 20 JCGD O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)c1csc(N2CCOCC2)n1 728260155 CGCQJDIBKPGCGI-UHFFFAOYSA-N 471.473 0.282 50 20 JCGD Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1 729275997 UVOBNTUDHNGHDJ-CYBMUJFWSA-N 454.530 0.495 50 20 JCGD CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNC(=O)C(=O)N1CCCC1)n2CC(C)C 748247571 RAMFCWNHCPCOMU-UHFFFAOYSA-N 475.550 0.457 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(OC)c(C(=O)NNC(=O)CNC(=O)c2ccco2)c1 751201883 MNARTGJZQDFPNA-UHFFFAOYSA-N 452.489 0.510 50 20 JCGD CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)CNC(=O)c3ccco3)c2)CC1 751207361 WNPIXVCHQHGFEW-UHFFFAOYSA-N 497.961 0.450 50 20 JCGD O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)[C@H]1COc2ccccc2O1 913416699 QDNVFLKHUHYLEK-LJQANCHMSA-N 477.495 0.504 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C1CCN(C(=O)N2CCCC2)CC1 915636474 MMWORRJKWWKEBG-UHFFFAOYSA-N 450.565 0.977 50 20 JCGD O=C(NCCCN1CCCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916195711 FYBROSFNEQCCRN-UHFFFAOYSA-N 453.565 0.528 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2cccc(Cl)c2)c1 919743665 QKYXFGLLAKVCNA-NSHDSACASA-N 474.948 0.840 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCC(=O)N2CCOCC2)cc1 920854127 VVVLSGWVHGAULB-JXAWBTAJSA-N 480.525 0.706 50 20 JCGD Cc1nn([C@@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)N3CCOCC3)c12 1318056509 GKDOZTYYCLWLCP-CQSZACIVSA-N 462.532 0.663 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc4c(F)cc(F)cc4[nH]3)C2)C1 1777797011 IBPWJRWOMHUXPF-HSZRJFAPSA-N 469.253 0.883 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C2)C1 1778930275 KDIWADUITURPNY-VOIUYBSRSA-N 480.525 0.392 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccc[nH]1)C2 1779373459 UFLYQSJWOWGTML-AUSIDOKSSA-N 454.531 0.774 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ncccc3C(F)(F)F)C2)C1 1779717211 IIXYUYNVYCUPGG-IBGZPJMESA-N 457.453 0.917 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCN(C)C2)C1 1780572085 DPJOUPKFFUIPJD-KETOKLHRSA-N 472.590 0.976 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)OC(C)(C)C)C1 1781937719 NKVKTZRHVTYSTK-OPAMFIHVSA-N 469.583 0.398 50 20 JCGD Cc1nccn1CCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782490750 MVGBAARWWKCIMG-ZJSXRUAMSA-N 468.363 0.479 50 20 JCGD CS(=O)(=O)CC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1782864556 OFFKUDDKBOJNPP-FWAYRLMKSA-N 453.467 0.746 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1783355320 NWQZMXVXRMROQV-SCLBCKFNSA-N 471.308 0.760 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783933682 VPGYKEREXNFGIV-GAJHUEQPSA-N 481.594 0.659 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@H]3C[C@@H]3N1C(=O)OC(C)(C)C)CCO2 1783939742 KXQRLWDRQGTPLP-MNFWLRKXSA-N 493.605 0.587 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)C2)C1 1784373496 OSQDBPAZJFWCBP-FRQCXROJSA-N 470.368 0.460 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)COc3cccnn3)C2)C1 1784458487 IIXLAAHVKRZWPB-JOCHJYFZSA-N 485.453 0.833 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1785683033 LSXHRHQTKVPNAW-MZGVZZPPSA-N 492.367 0.910 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1NC(C)=O 1786981153 VQOQBLHCITUWOP-LEDOBFOHSA-N 495.341 0.241 50 20 JCGD CC(=O)N1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)CC1 1788248814 ZPIZDAAVXPFOIC-OGNFBWPZSA-N 463.406 0.367 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c2cc(O)ccc2n1 1788281027 CXYJIJHZXYEQKO-OWSXEPHWSA-N 489.337 0.836 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccco4)no3)C[C@@H]21 1788610071 AXYKRASSFCJBOC-RISOHXOYSA-N 480.481 0.840 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611348 VRIAVHABQJAOBY-ZRCAFCQKSA-N 480.525 0.551 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnn3)C[C@@H]21 1789221771 CNTHVWFUKLUVFW-QSFXBCCZSA-N 499.480 0.982 50 20 JCGD COc1ccc(F)cc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1791378591 NXURFGGFMUPHGD-QSFXBCCZSA-N 464.538 0.730 50 20 JCGD COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1OC 1793657166 XOQVJTUBKJSKBG-GPVSGQMNSA-N 497.552 0.538 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnnc1 1794668585 LJJQNAFCIFDWJO-FZKCQIBNSA-N 453.927 0.812 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1794722149 PCPNRFTVDFHWGG-QDMKHBRRSA-N 486.554 0.190 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cncc(C(F)(F)F)c1)C2)c1ccc(B(O)O)cc1 1795736918 QGHHVEWTWFEJNI-UPHUGPLXSA-N 491.275 0.616 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)SCC(=O)N2 1796293529 CQHUFNQFHALQAL-USGNIVHTSA-N 475.571 0.307 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCNC(=O)c1ccc[nH]1)C2 1796890989 SMCLJCHIIAIUIK-RCPNXQIRSA-N 467.530 0.907 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NO[C@H](c2ccccc2)C1 1797179353 RQHXZVFDKCIIBF-YZIUBNRHSA-N 457.531 0.467 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)(F)F)ccn1)C2 1797751556 GBOXSLYZFDHLDV-DPIQGUFMSA-N 478.431 0.616 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1798471836 CTIGJTZONRINDG-JRIUASGASA-N 475.502 0.253 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799240458 LBTWYESHBJPFPH-NHKMSHSESA-N 477.301 0.500 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Cc1ccccn1 1801224228 WQDJFTGXPCIWLA-WITPMNRCSA-N 466.542 0.984 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc([N+](=O)[O-])o1 1802258365 DOYZSXUBAWRBSR-OXJNMPFZSA-N 464.243 0.896 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C1 1803130797 LFMVPWPUEOJIMY-TWWGPRNNSA-N 479.342 0.670 50 20 JCGD CN1CCCC[C@H]1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1803173358 ZLHNOBOORBXQAQ-HJNYFJLDSA-N 450.348 0.565 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1 1804967881 GJIJSJNWBXXHHA-AUUYWEPGSA-N 490.480 0.202 50 20 JCGD Cc1[nH]nc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1F 1805116238 GALDFPHTJQTYIT-AUUYWEPGSA-N 466.477 0.884 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC2(CCN(C(=O)CN3CC(=O)NC3=O)CC2)C1 1806757982 CUJLGSCQMXUFEH-HNNXBMFYSA-N 499.996 0.902 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807359639 KTPQQMWVQWEEOT-KNQAVFIVSA-N 461.331 0.745 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1 1809778038 ZSXIRKPPFHMFGZ-OXJNMPFZSA-N 485.508 0.756 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C2=NNC(=O)C2)[C@@H]1c1cccnc1 1810221337 ATJCSMQZYYKMGB-IFQKHITRSA-N 464.486 0.097 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1 1810490315 STHKZEXKHZDPAB-CVDCTZTESA-N 497.600 0.761 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cn3ncccc3n1)CC2)c1ccc(B(O)O)cc1 1815340248 HFIYERIRUNIEFU-CQSZACIVSA-N 462.300 0.405 50 20 JCGD O=C(O)c1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)ncn1 1816154582 NGFCDGXCKUCHQU-QGZVFWFLSA-N 464.247 0.197 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N[C@@H]2CCc3nc(NC(=O)[C@@H](F)Cl)sc3C2)n(C)c1=O 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CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2cnnn2)CC1)NC(=O)NCc1ccccc1 1830166517 ZRUUSISXNFBIIY-OAQYLSRUSA-N 497.604 0.639 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCSC(=N)N)C2)C1 1830537850 QGBBXHRZEPSKKP-WBMJQRKESA-N 451.387 0.491 50 20 JCGD CC(C)n1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1 1830538438 FTMQZHIXLHIEFT-RDTXWAMCSA-N 458.357 0.960 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnn(C)c3)C2)C1 1830538969 WUTITEHKVGSPAA-HNAYVOBHSA-N 457.369 0.840 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1830539054 ZWAXMAQVVYWGOB-XOBRGWDASA-N 484.347 0.954 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccccc3)CCO2)C1 1830679233 LOSWAMCGAQJEMK-WMEGFXLRSA-N 479.961 0.569 50 20 JCGD O=C(c1ccc(C(F)(F)F)nc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725099 LDTGYMLLAXLOKK-DYVFJYSZSA-N 451.829 0.770 50 20 JCGD O=C(c1ccc(N2CCOCC2)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830727986 MLOHDCXZWVNSLV-DENIHFKCSA-N 467.950 0.193 50 20 JCGD C[C@@H]1[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CCN1C(=O)OC(C)(C)C 1830738976 WQARMSBSVKZKOC-FSNCLGKMSA-N 489.997 0.688 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1831654385 KQPMTKRKUKFSDH-IERDGZPVSA-N 485.006 0.755 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873462 LZBBOUUNDLUPJO-PXNSSMCTSA-N 487.605 0.588 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832246429 FOZBXQZCXGNPAR-YGRLFVJLSA-N 493.248 0.829 50 20 JCGD CC(C)c1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)no1 1832790608 AOTZLCNZSFCRKN-YOEHRIQHSA-N 463.304 0.882 50 20 JCGD CCc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1F 1833738873 NATWNXRLBPTTMS-CZUORRHYSA-N 451.268 0.872 50 20 JCGD CN[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1)C(=O)O 1834738581 HHEUWZBFBIBTOP-CJNGLKHVSA-N 461.401 0.652 50 20 JCGD Cc1nc(C)c(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1834797377 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NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)c3ccco3)C2)C1 1837459348 DELVVMANSYKZGB-FQEVSTJZSA-N 479.440 0.140 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1cnccn1)CCO2 1837609185 OOVQBKVYQQMEIF-AVYPCKFXSA-N 453.927 0.069 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)CC2)CC1 1837920073 IZUOPVUFKCDRLM-NJDAHSKKSA-N 456.373 0.854 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 1838568783 LRSSASYBMTYISR-BTYIYWSLSA-N 499.358 0.689 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cc[nH]c3cc1F)CCO2 1838572304 MIXVGTRQBJGJHJ-DEOSSOPVSA-N 481.289 0.371 50 20 JCGD CC(C)n1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1C(=O)O 1839197726 GQDOGJXIDYMGHD-KSSFIOAISA-N 491.314 0.923 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ccoc4c3)CCO2)C1 1839536439 FYAURUWRQHQYPC-XMMPIXPASA-N 479.493 0.815 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839767665 UVHJNTDPGCFNQU-KOSHJBKYSA-N 478.565 0.834 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCS1(=O)=O)CCO2 1839780115 ZIHXTVDWFDAGIT-KEYYUXOJSA-N 467.382 0.051 50 20 JCGD O=C(O)C#CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839801765 CAAUJPRAHXIQSR-LAUBAEHRSA-N 479.327 0.537 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1840032192 QJANDPJQIBVIQW-UGSOOPFHSA-N 458.309 0.249 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc([N+](=O)[O-])c(OC)c3)C2)C1 1840155294 WSFOUHZOMHYEEK-KKSFZXQISA-N 485.921 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccsc3)C2)C1 1840182445 JLJKDPKDOITWNU-GUWAZMKPSA-N 450.561 0.591 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184720 CCVKFYDXRHLBJT-QHCPKHFHSA-N 480.537 0.206 50 20 JCGD CCCOc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840185368 OXOGIHNSMBILLG-XMMPIXPASA-N 476.574 0.918 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)cc1 1840906175 XLGNDISVYGQMQI-HXUWFJFHSA-N 458.342 0.985 50 20 JCGD O=C(CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)NNC(=O)c1ccccn1 17329339 VGVVPOUAFPBHEY-UHFFFAOYSA-N 459.484 0.625 50 20 JCGD CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 19198791 WDDSIBFVFJEYHP-UHFFFAOYSA-N 496.567 0.728 50 20 JCGD CNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cc1 19395524 PTTBLAIBCQQSAO-UHFFFAOYSA-N 455.876 0.875 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C 29385972 VQSWCJGHYUDQHD-JTQLQIEISA-N 476.287 0.623 50 20 JCGD COCC[C@@H](C)NC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 726261946 XWRAUWQYIYMZSR-CJNGLKHVSA-N 472.564 0.708 50 20 JCGD O=C(COC(=O)c1ccn(-c2cccc([N+](=O)[O-])c2)n1)NNC(=O)[C@H]1COc2ccccc2O1 728328169 PIPSXANAFSJHBC-GOSISDBHSA-N 467.394 0.925 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)CCNS(=O)(=O)c2cn(C)c(C)n2)c1 728525565 CEZAFBPGQDESIT-UHFFFAOYSA-N 474.337 0.629 50 20 JCGD O=C(NN=Cc1c(N2CCOCC2)nc2ccccn2c1=O)C1CCN(c2ncccn2)CC1 728783468 QWTGDJXFQVSWFS-UHFFFAOYSA-N 462.514 0.688 50 20 JCGD CC(C)(C)c1ccc(C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)C(=O)N2CCCC2)cc1 748241119 PZRAUNYQOGMVPM-QGZVFWFLSA-N 480.587 0.287 50 20 JCGD Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)c1 749352074 FJSKTCHASMEHGO-UHFFFAOYSA-N 455.581 0.405 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)cc1OC 831123156 GLDIJKZAVOBMKU-UHFFFAOYSA-N 485.902 0.640 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)c1 913466284 RTGKEBPQZPXIQJ-UHFFFAOYSA-N 474.948 0.330 50 20 JCGD O=C(COC(=O)c1ccc(=O)n(-c2ccc(F)cc2)n1)NNC(=O)[C@H]1COc2ccccc2O1 914856455 YKQFRUIPKNYBGA-GOSISDBHSA-N 468.397 0.516 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CCOC[C@@H]1CCCO1)N(S(C)(=O)=O)CC2 915639296 HYWSGWZGDFDZDG-FUHWJXTLSA-N 499.586 0.686 50 20 JCGD CCNC(=O)c1cccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1 916645023 MOSNGTUIGRCQQV-UHFFFAOYSA-N 475.575 0.594 50 20 JCGD Cc1nn([C@H]2CCS(=O)(=O)C2)c(C)c1C=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 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CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(N3CCOCC3)cc1)CCO2 1783935617 WQDDDDDKUMQLOX-DEOSSOPVSA-N 473.574 0.340 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784096577 INWIIPFMZCSQRT-KSWRQPAISA-N 457.955 0.482 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4nc(O)nc(O)c4C3)[C@H]2C1 1785331922 IDUVIAJRSIQTMG-RPVAFNKOSA-N 468.938 0.226 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cnnc4)cc3)[C@H]2C1 1786769109 WJXYOYLERJEFOA-NDXORKPFSA-N 490.524 0.173 50 20 JCGD Cc1nc2ccccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983639 YYADGEVCQNPLQW-IHPCNDPISA-N 462.315 0.230 50 20 JCGD N#Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)ccc1F 1789906888 VDEKIJMUNKUYDS-ZRCAFCQKSA-N 480.500 0.532 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)ccc1C 1790199870 LGGHQASGDJEXBB-RRPUWOKSSA-N 479.342 0.540 50 20 JCGD 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0.953 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796189667 NFEKHCCKXGJQKJ-KNJMJIDISA-N 489.353 0.966 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1F 1796190571 MMUXPUWAKXACCA-BCDXTJNWSA-N 474.319 0.475 50 20 JCGD C[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[S@](=O)c1ccccc1 1796192960 FLLPKXQSEXXNGU-PTHBEVMPSA-N 454.357 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc([N+](=O)[O-])c1)C2 1797748418 XFOKPIHEVXZCIY-YVWYUNDQSA-N 468.470 0.039 50 20 JCGD CO[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)c1ccccc1 1797750428 BZUFJYKYMLWDEX-WOUAJJJCSA-N 453.499 0.276 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cc(O)ccc3n1)C2 1797750896 UORXHBLWZVYLAB-USGNIVHTSA-N 476.493 0.456 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)nn1 1799098071 ZMFYYLSROMHNIM-OPMZPASUSA-N 497.556 0.035 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C 1799364497 DMCHLBVWRPQCOL-PFFSRIRZSA-N 463.959 0.106 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(O)nn1 1800205028 NKGZLUONQMGUEQ-AHXJXLJNSA-N 499.952 0.283 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccccc1[N+](=O)[O-])C2 1801014162 JBTQLIOEBBWZNS-YAACOUJCSA-N 459.503 0.571 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1802039812 SCUZRAQIQVRFTC-LLXJHRPKSA-N 460.535 0.015 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1802879946 OLJQKGBMTLZTIB-AHRSYUTCSA-N 467.530 0.314 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1 1803132519 XKJHHHFHYDKQRI-ZMUPPCTCSA-N 479.342 0.670 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807359627 BMRKCJZLAFBRJQ-WVBUVRCRSA-N 466.347 0.386 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1807360132 HJTYKPUMTRXEIY-BBMSBQBJSA-N 462.359 0.421 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2[nH]nc3ccncc23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370416 CZZPPKPHMUFGPQ-VGSWGCGISA-N 470.298 0.666 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnn2cccnc12 1809740792 GUFSVOQNIDMUMT-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD N[C@H](CC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)c1cccnc1 1809976560 FQFKLPJXPWUNKI-OAQYLSRUSA-N 450.348 0.696 50 20 JCGD CCc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n[nH]1 1810301829 CWIAPXJHYGEPIL-FOIQADDNSA-N 462.514 0.999 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H](O)Cc1ccccc1 1812769094 BDPFIIKFMDUYEV-OEMFJLHTSA-N 473.338 0.685 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C[C@](C)(O)CC(=O)O)[C@@H]1c1cccnc1 1813066412 AMCHGXGILODZCP-XGRCMKMKSA-N 463.535 0.076 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)nc3sccn23)[C@@H]1c1cccnc1 1813073835 OZQWJMFXSAGTRM-HRAATJIYSA-N 497.581 0.844 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)C1 1814861102 HDJFRNAVWIXSEE-MDZRGWNJSA-N 468.319 0.985 50 20 JCGD CNc1nsnc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815335565 FMYFWBGAGGKNBV-LLVKDONJSA-N 458.334 0.256 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N[C@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)c21 1815343762 OCNVILFXNFMOCD-AWEZNQCLSA-N 491.338 0.955 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(C)C 1817476643 YBHNHNYTBHAJTD-AZUAARDMSA-N 456.308 0.983 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2 1819470718 NRGAZFGEFMXQRG-PNLAZUSQSA-N 453.290 0.810 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3ON=C(c4ccccc4)O3)sc2C1)c1cccc(B(O)O)c1 1819586978 YWNXRJFGZHLYTQ-OPAMFIHVSA-N 492.322 0.783 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)[nH]n1 1822413277 QZVFNJDPOFEVTH-QGZVFWFLSA-N 491.574 0.887 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1824515295 JLFUPWDULOKQRY-IBGZPJMESA-N 462.377 0.506 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)C[C@@](C)(O)CC(=O)O)sc2C1 1826077627 LSZQKGJBRRZOLA-NSPYISDASA-N 455.537 0.044 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2 1832392814 MFDJHNOCZFQDPA-QHCPKHFHSA-N 476.549 0.687 50 20 JCGD C#CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1833465865 SUFXBXSUAHPVEQ-OVKKOYPGSA-N 470.574 0.730 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3cnnn3)CC2)CC1 1833726807 JJUZQKXDLNXHML-KRWDZBQOSA-N 499.016 0.377 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C)nc3OC)CCO2)C1 1833864654 LUUSQOQIFMINMH-KSSFIOAISA-N 459.341 0.672 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)F)CCO2 1834915405 IVWKOXSTBWFNDG-IBGZPJMESA-N 457.386 0.855 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CN)CCO2 1835529584 ZGVLCQJFGSGPCI-LHSJRXKWSA-N 464.475 0.185 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1835938107 LQAXHVJRHZRSIN-RUZDIDTESA-N 490.325 0.140 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)CCO2 1836638257 FUNFVERMHGZZIB-DRSNIGMVSA-N 489.997 0.954 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837171320 JIYNBPHYAFSPPK-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD O=C(CSc1ncccn1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920399 UFOQBCPXHPAZGL-UHFFFAOYSA-N 484.387 0.561 50 20 JCGD CC[S@@](=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838363090 UXJCJQMPTIZDMD-WJOKGBTCSA-N 458.625 0.517 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839524690 DHFKMBWHANBVER-MGPUTAFESA-N 454.886 0.452 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1 1839578427 BUEIPMIKAZVBIS-VBKZILBWSA-N 484.962 0.450 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1839666541 PEWCOWYESYRFMN-YWZLYKJASA-N 483.363 0.441 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nn(C)cc4c3)C2)C1 1840155319 XQUVNQBOBKPMFM-DYESRHJHSA-N 450.923 0.897 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3F)C2)C1 1840183754 XZYYUOGTEZVBHR-FQEVSTJZSA-N 471.917 0.317 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1847084429 GWMSQQOLAQMXGV-OALUTQOASA-N 471.363 0.877 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)N1C(=O)OC(C)(C)C 1847216800 OJPUUXVQGXSHHF-KNTRFNDTSA-N 471.363 0.970 50 20 JCGD COc1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1S(=O)(=O)N(C)C 10682093 TYFLYGVGAXGNBT-KRWDZBQOSA-N 493.494 0.090 50 20 JCGD O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)c1csc(N2CCOCC2)n1 12804720 LNLGUXLVQLBRLX-UHFFFAOYSA-N 494.327 0.799 50 20 JCGD C[C@@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C2=O 25416510 HNYQZFNECJWRLE-JLCFBVMHSA-N 493.586 0.835 50 20 JCGD Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 28692674 OTNWZRJJMUSVKR-UHFFFAOYSA-N 483.553 0.610 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2cccnc2)c2ccccc2c1=O 46901020 DSVXOYZJTLSSMC-UHFFFAOYSA-N 458.500 0.283 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1)c1ccc(-n2cnnn2)cc1 109280153 GSJLNUWACWZJPD-UHFFFAOYSA-N 479.569 0.536 50 20 JCGD C=CCNC(=S)NNC(=O)C1CCN(S(=O)(=O)c2ccc(C(=O)OCC)cc2)CC1 725908766 SGIMNMPLXQZEKU-UHFFFAOYSA-N 454.574 0.945 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c2ccccc2c1=O 726282871 UGUYYZWTKLDGSS-HSZRJFAPSA-N 477.481 0.615 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H]1CCCOC1)c(=O)n2Cc1ccccc1 727726422 YQTVSTQTOIVOLA-SFHVURJKSA-N 482.541 0.638 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)NC(=O)c2n[nH]c3ccccc23)cc1OC 728365251 JHDXXYWPPLHFCS-GFCCVEGCSA-N 469.454 0.703 50 20 JCGD Cc1nn(-c2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)c(C)c1Br 729275052 JWZFKBWVFRRMBP-JTQLQIEISA-N 458.338 0.950 50 20 JCGD COC(=O)c1cccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1C 731180659 GOZNHZBMBJQDLT-UHFFFAOYSA-N 469.541 0.720 50 20 JCGD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)C1 731219042 QNVLWIXTFTZBFN-AEFFLSMTSA-N 469.550 0.329 50 20 JCGD Cn1c(CCC(=O)NNC(=O)c2ccc[nH]2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 747663587 MYQVAHMOPDADQL-UHFFFAOYSA-N 460.516 0.316 50 20 JCGD N#Cc1ccccc1S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1 769182519 FYRAYDZXCQTNFG-UHFFFAOYSA-N 450.860 0.494 50 20 JCGD CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 811588123 YFGBAFAGOPDCJS-KRWDZBQOSA-N 497.913 0.735 50 20 JCGD O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)N[C@H]1CCS(=O)(=O)C1 915880292 FCEVRLADDQZXAQ-NSHDSACASA-N 458.543 0.680 50 20 JCGD C[C@H](CN1CCOCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 916469572 AZFXNAYLRRABDE-MRXNPFEDSA-N 453.565 0.526 50 20 JCGD Cc1cc(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC(C)C)n(Cc3ccccc3)c2=O)nn1C 917522547 HNCHWTNGEJIZEJ-UHFFFAOYSA-N 492.540 0.567 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc(C)c1C(=O)O 1779037196 TWSUOKDZIVQWJH-DEOSSOPVSA-N 481.509 0.757 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)C1 1780653059 JYIIRAVQHWZEPW-XBJPRQPRSA-N 489.997 0.328 50 20 JCGD Cc1cc(CC(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nn1C 1780970037 QSEDGHSLRTWCHY-VWLOTQADSA-N 497.600 0.447 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781333600 IKLGKIJZKLFOTK-NVXWUHKLSA-N 455.321 0.577 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782417978 CFBZEJDVZZWMLB-QRJOEMBSSA-N 465.359 0.768 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1782850373 MNQAJGLAVGAOPT-ZUOKHONESA-N 486.495 0.346 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1783345123 XSUFQPUZSOZMJN-XIKOKIGWSA-N 454.325 0.244 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1783354950 ZNGSQNOCUVXZKE-BDJLRTHQSA-N 464.407 0.850 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1783555576 QYWGNBMOSGPOOQ-UMGGQSCQSA-N 460.579 0.344 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1 1783707036 FRYKCVVZYZXJQV-PRGCVLSDSA-N 490.561 0.864 50 20 JCGD CC(=O)NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785079750 YRHGSCMCJXLEMP-VGWMRTNUSA-N 460.959 0.234 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1785658128 XDYWMKHFRCHNGS-HSZRJFAPSA-N 471.489 0.519 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H](N)c3cccnc3)C[C@@H]21 1787508932 MZKDKJZIUBUPTD-QNNUHGRASA-N 481.557 0.585 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ccccn4n3)[C@H]2C1 1787844378 XTUBEBRUZQJJRQ-DCPHZVHLSA-N 463.498 0.240 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ncccn4n3)[C@H]2C1 1787940334 TYLOMHIVJGUFDT-XUXIUFHCSA-N 451.325 0.891 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CNc4ccccc43)C[C@@H]21 1788610595 JRJPTJOUHVYTRP-UEXHFKJGSA-N 464.526 0.488 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CSCN3C(=O)[C@@H]3CCC(=O)N3)[C@H]2C1 1790696083 PTRUIKZWXSEKHR-JNNCMOEMSA-N 487.022 0.164 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2 1792869002 XYMAWEKWNVWLFT-QEYWKRMJSA-N 463.222 0.962 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792975525 TUSBHNUILMUDHS-JYYAWHABSA-N 463.959 0.107 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnnn1C 1794229766 SHXPCULZMGGHLX-IVWMJMPLSA-N 458.431 0.166 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCOCC1 1795441951 CHTXLZFGTQLZJR-BDCURPAKSA-N 460.481 0.794 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1nnc(C)o1 1795789975 ZVFFIUDKBDSAFB-VTEUUUEMSA-N 473.442 0.657 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796890881 NXCAKFJVHNPBPD-RCAJWXFUSA-N 466.564 0.086 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)c2C1 1797315644 NQNUGYIHZNZYOM-FAXLKDOZSA-N 486.932 0.766 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)ccc(F)c1F)C2 1797748554 HSHZBJIJNPVIQN-OYHTYJOISA-N 477.443 0.548 50 20 JCGD CC(C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)[nH]n1 1797751498 AKOBOPVIPAEMOI-IVWMJMPLSA-N 455.519 0.223 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2Sc3ccccc3[C@H]21 1797770001 HPAKUMKUDBKWJS-YCVZEPRFSA-N 458.584 0.837 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799871740 ZQDOZMQVLOQYDF-NYUBLWNDSA-N 490.561 0.035 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)CO2)C1 1800709058 XDGMAJZNFUGMJG-KSWRQPAISA-N 487.981 0.202 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)CC1 1801938855 MGXOFSSHAQACAX-YVSFHVDLSA-N 457.955 0.743 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1802003844 PJILVEMLBZXYSM-YBCDSMPPSA-N 471.982 0.983 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)C1 1802258057 PEBOGUBUVXMDHQ-OVYGPGRDSA-N 457.531 0.916 50 20 JCGD CNc1nsnc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1802482457 SNFGHUXCZPXMNQ-DYVFJYSZSA-N 481.542 0.607 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1 1803132514 XKJHHHFHYDKQRI-HKBKIPCKSA-N 479.342 0.670 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810305909 PXVZZQKORXXILF-ALKREAHSSA-N 484.513 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(=O)nc3sccn23)[C@@H]1c1cccnc1 1811266275 IOKANQLTUSZCDM-IERDGZPVSA-N 497.581 0.844 50 20 JCGD Cc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(O)n1 1811481866 RRDOHMXROQKRSH-NQIIRXRSSA-N 460.299 0.804 50 20 JCGD CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1812649768 NIVUPOTXEPJFBG-LMVOGOLTSA-N 467.530 0.746 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3c1CCC3)CC2)c1ccc(B(O)O)cc1 1815348115 DVCZFYULDSUGDH-AWEZNQCLSA-N 451.317 0.505 50 20 JCGD Cc1cnn(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)c1 1815759397 PSXYOCDBGLEZOU-GFCCVEGCSA-N 454.516 0.573 50 20 JCGD COc1nccnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817473123 GWLHPFLUIAHJDB-MRXNPFEDSA-N 450.264 0.508 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCn2cncn2)[nH]n1 1819404428 KJLIKHLEFBVPIN-MRXNPFEDSA-N 452.479 0.396 50 20 JCGD Cc1nccn1CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1824706427 SDINKSYIKKZKMH-GFCCVEGCSA-N 454.516 0.573 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2 1828132860 PCBYTIVXNWMRJX-HIFRSBDPSA-N 452.581 0.733 50 20 JCGD CC(C)CNC(=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828926521 MBDKOOCNZXZVRX-IBGZPJMESA-N 458.563 0.691 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1828939597 UIDDZBDEMXZXLR-LAUBAEHRSA-N 465.363 0.890 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830353673 JJNMKSNWOKPRFA-YCRPNKLZSA-N 477.986 0.593 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830353909 MGULXUQRBAPSER-ZHRRBRCNSA-N 492.013 0.984 50 20 JCGD CC(C)(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830720042 RISCRWPCEFENLF-VFNWGFHPSA-N 477.986 0.736 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2n1 1830727823 GXMOREVOQRXDDP-OXJNMPFZSA-N 451.911 0.016 50 20 JCGD COc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc(OC)c1OC 1832100241 SQKBKRXPUZJXJL-AOMKIAJQSA-N 486.949 0.311 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(N(C)C)cn1)CCO2 1833646607 PAVRJWWVLPCYJA-FXZATJRASA-N 497.556 0.352 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccncc1)CCO2)NC(=O)NCc1ccccc1 1834017900 FQGPFAHRBJBDCR-RUZDIDTESA-N 496.568 0.498 50 20 JCGD COc1cccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834048839 UYAWABICUKRFLQ-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ocnc1C)CCO2 1834366209 YSEIKKJVNUZOAI-SGSZHJQISA-N 458.475 0.187 50 20 JCGD C=C(Oc1ccccc1O)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835116133 VOWVCHIXYQRIFZ-UHFFFAOYSA-N 493.369 0.850 50 20 JCGD Cn1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(C(F)F)n1 1835241821 JPKVWVSEVFUXCK-UHFFFAOYSA-N 489.332 0.537 50 20 JCGD CNc1nsnc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835734917 XOBBIQFVJPJZSM-UHFFFAOYSA-N 487.590 0.077 50 20 JCGD Cn1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc2ccccc21 1835928263 HNOJKPQGBXDTKJ-RUZDIDTESA-N 477.326 0.242 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3ncon3)CC2)CC1 1836046095 SMEAPUPYCXKZAO-AFUMVMLFSA-N 456.507 0.389 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccn3ccnc13)CCO2 1836998466 UWILIHJIDIFZMF-FXZATJRASA-N 493.524 0.538 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1 1837443365 HNBUILLSLXDQPY-RHRDFPHASA-N 487.561 0.049 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4c(c3)CCC4)C2)C1 1837455859 GDYDMDOSAVNOLF-AREMUKBSSA-N 493.564 0.487 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1 1837457496 FRINXJIUTPWXRQ-HSZRJFAPSA-N 471.489 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)CC1 1838395432 PSWSXNYKYQUOMN-MRXNPFEDSA-N 495.584 0.826 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc3c1OCO3)CCO2 1838477977 UHIFAACKMVDYDB-HXUWFJFHSA-N 451.552 0.732 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)n(C(F)F)n3)CCO2)C1 1838709622 XXVXNTMVYMLRON-FZKQIMNGSA-N 450.870 0.910 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1839220295 FVNOUXUOQXCVKB-AZUAARDMSA-N 484.949 0.064 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3-n3nccn3)CCO2)C1 1839381210 GNKDMZYBADBIGC-UWJYYQICSA-N 463.922 0.591 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1839667928 QFECHGLEJGCHHH-JHVJFLLYSA-N 487.384 0.893 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1839966213 XSHAXAORAPQJJD-BFUOFWGJSA-N 499.387 1.000 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(C(=O)OC)(C3)C4)C2)C1 1839966662 MADDJRWLJSVNLZ-HJXCVWKLSA-N 473.364 0.960 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 1840155610 BFVCCELWCVAUGE-UZLBHIALSA-N 473.885 0.987 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3Br)C2)C1 1840185600 PXTAARWHEBFZIL-FQEVSTJZSA-N 498.378 0.287 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1840381308 VNIWXZGJLGODHS-CVEARBPZSA-N 452.364 0.590 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1843953991 GBVMPCXBBMJGJJ-QHCPKHFHSA-N 490.536 0.851 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCN1CCOCC1)C2)NC(=O)NCc1ccccc1 1845038737 MWKTTWHOSLZDNH-UHFFFAOYSA-N 472.590 0.258 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C 1847644296 AAQXIYZLCISIRQ-ULQDDVLXSA-N 465.551 0.140 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)C1 1847726138 IZZINYGMMSKOGA-OALUTQOASA-N 455.320 0.359 50 20 JCGD COC(=O)c1sc(S(=O)(=O)N2CCC(C(=O)NNC(=O)C3CC3)CC2)c(C(=O)OC)c1C 26966611 BNMZPFBHPDIZIU-UHFFFAOYSA-N 487.556 0.588 50 20 JCGD CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1 115385385 URPVDQJBBHLODJ-UHFFFAOYSA-N 466.516 0.906 50 20 JCGD Cc1cccc(O[C@H](C)C(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)c1C 726710599 IFNODBPZBCDJAJ-GOSISDBHSA-N 469.546 0.930 50 20 JCGD O=C(CCc1nc(-c2ncccn2)no1)NNC(=O)CCN1CCN(c2ccccc2)CC1 727705523 SPUGULWFCPWZHK-UHFFFAOYSA-N 450.503 0.819 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)OCC(F)(F)F)c1 727800333 YFCLWPIAEMMZDW-CYBMUJFWSA-N 466.438 0.861 50 20 JCGD CCOc1ccc(S(=O)(=O)N(C)c2ccc(OCC(=O)NNC(=O)c3cnn[nH]3)cc2)cc1 729455609 NUJAHDYHBWFSSU-UHFFFAOYSA-N 474.499 0.869 50 20 JCGD CCN(CC)C(=O)CN1CCCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 746512701 VXROUAJQDMCHLY-UHFFFAOYSA-N 467.596 0.210 50 20 JCGD Cc1cc(C)cc(OCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)c1 747696256 PPXIWNQSOHUQCJ-UHFFFAOYSA-N 463.560 0.972 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNC(=O)Cc2cccc(F)c2)c1 749013861 AOCICVNWPCHXMK-UHFFFAOYSA-N 465.507 0.379 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNC(=O)c2cccs2)o1 751206157 FGBQDMVNWMANPT-GFCCVEGCSA-N 498.539 0.248 50 20 JCGD CCn1c(CCC(=O)NNC(=O)CNC(=O)c2ccco2)nc2cc(S(=O)(=O)N(C)C)ccc21 751206281 BZWXCEIQKKHGIT-UHFFFAOYSA-N 490.542 0.410 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc(C)n1C)c(=O)n2Cc1ccccc1 789856928 OLKMLDRBAADIDW-UHFFFAOYSA-N 493.524 0.163 50 20 JCGD O=C(COC(=O)CNC(=O)c1ccc(C(F)(F)F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 801980945 FHNIZPFVPSREGA-INIZCTEOSA-N 481.383 0.966 50 20 JCGD COc1ccccc1NS(=O)(=O)c1ccc(O)c(C(=O)NNC(=O)C(=O)NC(C)C)c1 843404193 DKEZCQWCHDAOEM-UHFFFAOYSA-N 450.473 0.487 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1 914715118 OVHOJRLMXPPPOV-AWEZNQCLSA-N 467.500 0.928 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CCOC[C@H]1CCCO1)N(S(C)(=O)=O)CC2 915639297 HYWSGWZGDFDZDG-SJLPKXTDSA-N 499.586 0.686 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1ccnc(C)n1)N(S(C)(=O)=O)CC2 918106815 OHRRNYJINLUDBM-QGZVFWFLSA-N 492.558 0.582 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Nc2nc(CN3CCOCC3)cs2)c1 920931571 WQAWOIZYXGEVPF-UHFFFAOYSA-N 468.561 0.692 50 20 JCGD Cn1nc(C(=O)NNC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)c2ccccc2c1=O 933556741 CGFQPCOUZCNFEK-HSZRJFAPSA-N 460.450 0.088 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1778165693 CRLSSWWYUNNJGW-VFNWGFHPSA-N 450.923 0.424 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1778788687 JCZFFCAKAHUWPH-CSODHUTKSA-N 498.374 0.887 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3ccnc23)C1 1779057448 LVDQSAVZGOAFHP-WZONZLPQSA-N 456.547 0.835 50 20 JCGD CNC(=S)NCCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097663 DDCRCAHWEYNHCZ-OAQYLSRUSA-N 493.542 0.448 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)no1)CCO2)NC(=O)NCc1ccccc1 1780969050 UGFVDSXIYNQOMC-QFIPXVFZSA-N 472.502 0.170 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)c1 1780969545 OAESXJBAJXYWCK-CJFMBICVSA-N 497.600 0.929 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1782158205 YMMOTKACSKQWEI-IPRDPGLQSA-N 478.590 0.629 50 20 JCGD C[C@H](NC=O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783021830 FYKOXQFQSBXJRV-VPWXQRGCSA-N 452.349 0.957 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3cncc(O)c3)C2)C1)NC(=O)NCc1ccccc1 1783620216 LEOLKBHFUHLWQR-XMMPIXPASA-N 482.541 0.577 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COC3CCCCC3)[C@H]2C1 1783859455 FEWJEMDVVQJOHF-YSSFQJQWSA-N 459.547 0.628 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1 1783880233 GVENTLBPFQSWFE-GHTZIAJQSA-N 480.986 0.156 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1)CCO2 1783935114 NYCPYSNJZIWURA-ZEQRLZLVSA-N 495.621 0.836 50 20 JCGD N#Cc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786978650 HVQHBRWTZVCUKE-PMVMPFDFSA-N 461.327 0.464 50 20 JCGD O=C(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)Nc1ccc(F)cc1 1786984852 QQMSDDFFQXGKJV-NDXORKPFSA-N 483.305 0.128 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cn3)[C@H]2C1 1787033823 CNLMBOZUARLTSK-ZMEUDLNSSA-N 470.505 0.877 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4ncccc34)[C@H]2C1 1787375418 MJPADVVPQAMXHR-PGMBAZLQSA-N 478.513 0.457 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C[C@@H]21 1788611082 KTJIRILPHJVSIY-DCPHZVHLSA-N 478.509 0.087 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#CC(=O)O)[C@H]2C1 1791072717 XSSMIPIZZPWEEA-AJNGGQMLSA-N 457.911 0.186 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1792229180 BIWLWWVNRDRJFD-ZRCAFCQKSA-N 485.277 0.250 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c[nH]c1C 1792975496 SOIZZDYRZHLSJB-YYAJDYIMSA-N 455.939 0.622 50 20 JCGD O=C([C@@H](F)Br)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)C(F)(F)C(=O)O 1793730656 ZNWJKUPXBACOQV-ULAWRXDQSA-N 453.158 0.622 50 20 JCGD CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1Cl 1795903568 CDZFHCSQRSHGIW-GPVAFHQSSA-N 475.937 0.963 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(Cl)nc2n[nH]cc12 1796189235 NZXSMIPKNNSGMU-QDMKHBRRSA-N 453.695 0.857 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnsc1C1CC1 1796642363 QAKKEJCRAAEXLZ-GRSZLDEUSA-N 471.543 0.753 50 20 JCGD Cc1cc2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)[nH]c2cc1C 1797671210 DJEKLQWPXJQRPT-UPHUGPLXSA-N 462.315 0.377 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccccn1)C2)NC(=O)NCc1ccccc1 1799094835 BKJTVZGYEZPHDA-GQEURGSBSA-N 494.596 0.950 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(O)n1)C2)NC(=O)NCc1ccccc1 1799095146 VPCQZDIXYFXHOF-OPMZPASUSA-N 482.541 0.337 50 20 JCGD CC(=O)C[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097102 BJYROGUCPCUFJO-ALOBAPJISA-N 473.574 0.537 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(F)c(C#N)c1 1799325715 SFUFDSGUIANMCM-ZCZLHUBVSA-N 480.500 0.963 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ccnn2c1 1800024103 NYEKSJXXZLUYME-KEMUROEHSA-N 463.498 0.672 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2nscc12 1800034362 CDMGRUIABMZJJN-DBWKPXFBSA-N 466.523 0.812 50 20 JCGD O=C(Cn1ccncc1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1800198987 SUURMMKKTHJDLF-BMQTXXJKSA-N 489.370 0.839 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCCNC(=O)OC(C)(C)C)C2 1800759908 PJONUVWSZJUYIZ-HGTKMLMNSA-N 478.384 0.901 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801009076 OOMNMOMLULMBLR-OAFZBRQQSA-N 469.583 0.110 50 20 JCGD CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801014307 LLUQVGNMDXJDCZ-QIBQCXCESA-N 497.637 0.888 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1 1804153376 QMIJCDUWLNGALJ-JPYJTQIMSA-N 493.568 0.802 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1F 1805145925 UKIHDUGXDJZJET-BEFAXECRSA-N 480.504 0.895 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n[nH]1 1805253813 CLXBMEGCJPKJGK-DYESRHJHSA-N 461.287 0.321 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)n[nH]2)[C@H]1c1cccnc1 1807284979 PDNNAPRVXWVVIK-SCLBCKFNSA-N 450.459 0.142 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807367595 MITDKEIOMTYYNO-IHPCNDPISA-N 457.361 0.195 50 20 JCGD Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)s1 1807534362 XEPJXVUGUJVGOR-LAUBAEHRSA-N 465.344 0.484 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1 1810302440 JDIRRSBGAFWGRL-QVKFZJNVSA-N 485.508 0.985 50 20 JCGD COCc1c[nH]c(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1 1811350730 XBASARKOVZAPFN-KNQAVFIVSA-N 462.315 0.869 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nn[nH]c2C(F)(F)F)[C@H]1c1cccnc1 1811561678 CSGFKXWNYPWSEB-CXAGYDPISA-N 482.467 0.911 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccc(-n2cncn2)c1 1811822264 CLQOHRVCCVVPRG-XUZZJYLKSA-N 496.336 0.976 50 20 JCGD CN1CCN(CCC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CC1 1813070160 DJLOYZVQOSYNLP-HYBUGGRVSA-N 473.622 0.098 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1 1813072348 GCJNHQPOVXHOQZ-JTSKRJEESA-N 469.546 0.963 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCCC2=O)n[nH]1 1817157696 AQIUHERJYRCIMQ-MRXNPFEDSA-N 454.491 0.337 50 20 JCGD O=C1Nc2c(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)[nH]n3)cccc2C1=O 1819194656 QEHSSHSJJNUHFQ-GOSISDBHSA-N 487.281 0.844 50 20 JCGD O=C(O)c1cnncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819759610 LNYCYNZDBOYYJQ-KRWDZBQOSA-N 464.247 0.197 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1nccn1)CC2)NC(=O)NCc1ccccc1 1822518911 XMUQLEMZILZEBU-MRXNPFEDSA-N 497.585 0.693 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)[C@@](C)(Cl)CCl)sc2C1)C(=O)C(=O)O 1822869293 IAMIHWZYYYVKCL-PWJLMRLQSA-N 451.332 0.834 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2 1823015065 JMGJYAFTYWHGLV-KGYLQXTDSA-N 476.983 0.931 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)c1cccnc1)CC2 1826083887 UTDBRRAHCPYUDE-AWEZNQCLSA-N 473.559 0.253 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCn3ccnn3)sc2C1 1826873821 DIYCRBONHDWPAM-NSHDSACASA-N 455.504 0.049 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923299 BSPYYDJVANCQRW-HNAYVOBHSA-N 494.618 0.246 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(O)O)CCO2 1830404003 CMXLOXTUMDTIEB-YWMGUWEJSA-N 480.315 0.123 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CCC(F)(F)CC1)CCO2 1831006377 GKRIXYFWRZSLQQ-NRFANRHFSA-N 481.500 0.581 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832246427 FOZBXQZCXGNPAR-IINYFYTJSA-N 493.248 0.829 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1 1833450493 INDQCIFGURZIFU-LBPRGKRZSA-N 457.424 0.690 50 20 JCGD COCCOCC(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1834565944 CNRQPRYPBXAJLK-YZSQISJMSA-N 476.578 0.355 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cccn2c(O)nnc12 1835044063 KRZDZXKRYQNUBH-INIZCTEOSA-N 450.927 0.220 50 20 JCGD C=CCOCCCC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835734433 HFDVCWKMQDFVGE-UHFFFAOYSA-N 472.590 0.853 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3sccc3Cl)C2)C1 1835931245 JUGFTKQSEYBYCP-FQEVSTJZSA-N 464.736 0.465 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3nccnc3C(N)=O)CC2)CC1 1836047552 PRHSVWREFBUSFX-ZDUSSCGKSA-N 481.395 0.792 50 20 JCGD Cc1ccc2oc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cc2n1 1836265409 QCVGYCFEEQINAU-DEOSSOPVSA-N 494.508 0.519 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3cnccc13)CCO2 1837032771 VDJOVVDQLQROEG-VWLOTQADSA-N 475.310 0.298 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1ccccn1)CCO2 1837741428 RVGSBPMLMDHYKC-HYSQFFRZSA-N 497.556 0.472 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1F 1838537462 MHSMYMFEPKZEMS-IERDGZPVSA-N 472.897 0.672 50 20 JCGD O=C(c1cnn2c1OCCC2)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839518079 HKCPWVPGNQDRIE-CXAGYDPISA-N 461.288 0.426 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnn3c1CCC3)CCO2 1839531705 AMRNTPAYENDZCE-LRULAXNGSA-N 483.529 0.033 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2 1839961547 AXBPJGBDRVGVAD-OHLRXGENSA-N 458.353 0.475 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OC)cn3)C2)C1 1839963403 JJIPUAOYMWIJGN-ACJLOTCBSA-N 457.325 0.729 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(NC(C)=O)c3)C2)C1 1840152830 VVMFKSMONJYAPR-OXJNMPFZSA-N 454.911 0.364 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccc(F)cc3)C2)C1 1840154316 RYULPGAOAMDPFA-VPKVUBIPSA-N 485.940 0.654 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccc(F)c34)C2)C1 1840154707 DCRNGQKXIYAUBJ-FOIQADDNSA-N 454.886 0.797 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CN2CCSCC2)C1)NC(=O)NCc1ccccc1 1841041252 MAIATJBOIRMGRP-UHFFFAOYSA-N 474.631 0.585 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cccc(O)n2)C1)NC(=O)NCc1ccccc1 1842450774 LMQQEBPIVVHHSN-UHFFFAOYSA-N 452.515 0.950 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1844264124 HJCDLWVQVQHIHK-UHFFFAOYSA-N 461.482 0.295 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038303 OCXRGVKINKMBAR-KHPPLWFESA-N 468.558 0.394 50 20 JCGD CN1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1845039154 KKBGDNLEMSQABI-HXUWFJFHSA-N 456.591 0.878 50 20 JCGD COc1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CCC(=O)NN(C)C)cc(OC)c1OC 1847975468 ITMIQICHSUISCT-IRXDYDNUSA-N 462.547 0.830 50 20 JCGD CSCC[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 17407136 DAHWTHJAKALDGK-INIZCTEOSA-N 482.584 0.908 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728889412 ICCMDOZMLVZKBF-UHFFFAOYSA-N 460.560 0.826 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)cc1 748246644 FKZVRRZSERJFKC-UHFFFAOYSA-N 472.523 0.751 50 20 JCGD CN1CCN(S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(CCCCl)cc3)CC2)CC1 750853837 KVICAAXIRFNCGJ-UHFFFAOYSA-N 465.041 0.657 50 20 JCGD Cc1nn(C)c2ncc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc12 751261018 QSPRRXQHOMKLFT-UHFFFAOYSA-N 478.556 0.685 50 20 JCGD O=C(CSc1nnnn1C1CC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 849129183 BJULWEDXONVBEC-UHFFFAOYSA-N 465.561 0.736 50 20 JCGD CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NCCCCCC(=O)N2CC[C@@H](B(O)O)C2)c1 864234405 RIEPIBPIHSUIPS-CQSZACIVSA-N 473.788 0.956 50 20 JCGD COCCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C 914877308 RSCDYTSJKVOJFC-UHFFFAOYSA-N 471.557 0.894 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC(C)(C)N3CCCCC3)nc2)CC1 915899615 OFFZAHIDLJMIAD-UHFFFAOYSA-N 453.613 0.908 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(C)(C)N2C[C@H](C)O[C@H](C)C2)cc1 916234766 QDYFMKSBVCXFBG-CALCHBBNSA-N 469.608 0.834 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919887093 ZCLYNYKHXPDJNW-INIZCTEOSA-N 472.589 0.311 50 20 JCGD CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)c(F)c1 919956037 SCFZJLDUKPAOQG-UHFFFAOYSA-N 455.287 0.911 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030360 OYFQCLRTGZLPPG-XCLFUZPHSA-N 459.532 0.086 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1779473075 GFACVKUBVZXCFW-DKEWWPDHSA-N 486.342 0.799 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)n1cnnn1)CCO2 1780099174 XJTBISPENVOLPN-RBZFPXEDSA-N 473.446 0.211 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)Cn1cccn1)CCO2)NC(=O)NCc1ccccc1 1780969771 JPKZESKHHCLCLL-HSZRJFAPSA-N 469.546 0.059 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782788708 IKYIQZSSZQHQBA-SCLBCKFNSA-N 471.308 0.760 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCc3cnc4[nH]ccc4c3)CCO2)C1 1783937531 UCPAVHDCTFNTET-QHCPKHFHSA-N 456.547 0.698 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3cccc(N(C)C)c3)[C@H]2C1 1785060908 XSJMQXUPCRJUJN-YYWHXJBOSA-N 475.590 0.484 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)NC(=O)NCc1ccccc1 1787448602 BFIHIEBDBXPJOC-DWRORGKVSA-N 469.945 0.847 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4ccc(Cl)cc4n3)[C@H]2C1 1788080480 FYVSIOQDYDSNLN-IXDGSTSKSA-N 497.943 0.893 50 20 JCGD Cc1cnc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]43)cnn2c1 1788338203 UWPJOBBQXHKYMJ-SZMVWBNQSA-N 457.535 0.004 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(N4CCN(C)CC4)CC3)[C@H]2C1 1789807753 KRYSKDWSYWZVNB-QAETUUGQSA-N 457.413 0.530 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C[C@@H]21 1791291572 ZXAFUEHAHWPWNR-IEZWGBDMSA-N 457.531 0.148 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)CC1 1791294853 SIMNJHUHTMXXGT-IHRRRGAJSA-N 456.392 0.441 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@H]3CCNC(=O)C3)cc2)CCC1 1791657974 YSOOOEWHCAFYRF-AWEZNQCLSA-N 450.499 0.959 50 20 JCGD COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1795127418 BBPRNISWHFQFKI-BBIADKPPSA-N 452.316 0.211 50 20 JCGD COC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1795519796 UUMKNKKBTOIQNY-REPLKXPHSA-N 459.547 0.924 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3cccc(Cl)c31)C2)c1ccc(B(O)O)cc1 1795736800 KRSUTASDUVFOMC-YZIUBNRHSA-N 468.746 0.953 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2 1796441340 AVTVNUAXULYUBI-FXOZFUDCSA-N 497.537 0.093 50 20 JCGD COc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)ccc(F)c1F 1797753749 FCQIKHNCMAFSSJ-KSPBDQMDSA-N 475.452 0.489 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccn(C(F)F)c1=O 1798669051 JDMDEVJDETVJGI-CLLJXQQHSA-N 460.441 0.808 50 20 JCGD Cc1cnn(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)c1 1799094749 IMDXTXBQPOYBLE-JHDGKUDLSA-N 483.573 0.127 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799346875 HVTHAHSOXIVVOR-QIRZIZBZSA-N 457.300 0.480 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1799382945 RRJGPMXWTSLEEM-XEMDLRDOSA-N 495.411 0.447 50 20 JCGD O=C(/C=C/c1ccc(O)cc1Cl)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1800903301 PJTIDKGSSPWDPI-MBQWOLKWSA-N 470.718 0.642 50 20 JCGD COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O)C2 1802281966 FIMWSZXLYZDGMU-YYIAUSFCSA-N 486.997 0.958 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cncn1-c1ccncc1 1805103920 IBHFJWICHKGKOK-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCCC2(CCN(C(=O)c3cnccc3C(=O)NN)CC2)C1 1806185319 VQKWPGRYGYDPRA-UHFFFAOYSA-N 458.563 0.692 50 20 JCGD O=C(CC1CCOCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1806933207 KHUJIMOMLSESRX-NZQKXSOJSA-N 451.332 0.898 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)(C1)C2 1807373356 CKHYYVNIDJKHTM-IBBYJXFNSA-N 477.326 0.424 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cccnc3CS(C)(=O)=O)C2)CC1 1807642304 QFSFIVBTCAFLLK-UHFFFAOYSA-N 493.630 0.844 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccn3c(O)nnc23)[C@H]1c1cccnc1 1808194914 SBHMPCFBELSZOT-OXQOHEQNSA-N 480.529 0.523 50 20 JCGD CNC(=S)NCCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808417905 RZYOESDNDNQYNH-RBESNOOPSA-N 498.613 0.705 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc2n(n1)CCCO2 1809856382 BYAIYNDTCQIXMF-AVRDEDQJSA-N 475.314 0.374 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810324897 YUHQNRAMVZJYSY-DKZVUGQWSA-N 474.330 0.372 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810478267 RUFSYMPMJFYZLA-MDYRTPRTSA-N 477.529 0.328 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1 1812775465 HYKXOHNHXXQETF-DWRORGKVSA-N 469.380 0.912 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813069535 ZMBMDEMDZSYFKY-KBXCAEBGSA-N 460.564 0.667 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cccn4c(O)nnc34)sc2C1)c1ccc(B(O)O)cc1 1816963532 AQSXGYXPHDKZRL-CYBMUJFWSA-N 478.299 0.111 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnn2ncccc12 1817954076 LZMPPIRHRSQRHP-IBGZPJMESA-N 459.275 0.752 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)COC(=O)C(F)(F)F)n[nH]1 1819315861 BAXWSPAGNPRWCH-LBPRGKRZSA-N 462.429 0.880 50 20 JCGD Cc1noc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n1 1819402907 NHIBDVKVSGXTOI-HNNXBMFYSA-N 453.463 0.648 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1cncnc1)CC2 1819796776 FTBIGANFSYZRDY-CYBMUJFWSA-N 466.527 0.790 50 20 JCGD CC[S@@](=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797922 ONBYGVBXWQSYKY-VMTQLHELSA-N 464.573 0.526 50 20 JCGD Cc1ncncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1820700956 OKFOREIEYMBWST-LLVKDONJSA-N 452.500 0.780 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)C[C@](C)(O)CC(=O)O)n[nH]1 1822415152 USQVOZBMLWWLKF-XOBRGWDASA-N 452.512 0.391 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2 1824713622 BJWSDYVIDFINKP-BXKDBHETSA-N 455.880 0.425 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CNC(=O)C3)sc2C1)NC(=O)NCc1ccccc1 1825203900 DGKHJANARXSVBO-JKSUJKDBSA-N 499.597 0.537 50 20 JCGD O=C(c1ncon1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828550975 FOSUNXFSXGJBHT-IIBYNOLFSA-N 477.905 0.735 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N4CCN(C)CC4)cc3)CCO2)C1 1829696501 BTDUNRGPZBNPIP-ZJSXRUAMSA-N 495.020 0.762 50 20 JCGD O=C(Cc1ccc(Br)cn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725907 MRPACBBYVXKTBH-QAPCUYQASA-N 476.755 0.443 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@H]1O)CCO2 1830818613 IPAFWYBMXWIYRW-JZJXAQOMSA-N 452.935 0.339 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NS(=O)(=O)CC)CCO2 1831317732 LDDXPDITHPDFGU-MPGHIAIKSA-N 453.989 0.178 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccco3)CCO2)C1 1833048962 XKCYPBDRKWPPRT-QADUPLGGSA-N 471.514 0.803 50 20 JCGD CN(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)nc1 1833648130 NNNKVUKZNGGYPJ-QAPCUYQASA-N 459.316 0.908 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1 1834423532 PVPCAJXYFVHOSA-LJQANCHMSA-N 462.385 0.959 50 20 JCGD CC(C)N[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)C 1834800936 BJTKEOXGNTUMBL-QHCPKHFHSA-N 472.439 0.574 50 20 JCGD O=Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1834803001 REGIXPOYMGUJMP-UHFFFAOYSA-N 469.372 0.739 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cc4cccn4cn3)CC2)CC1 1835423268 QKANQCUSEXVZIN-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccncc1Cl 1835898300 IRVHMSQRCHYTFE-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836678288 QUEQATBDKUXGNO-PGRDOPGGSA-N 452.935 0.610 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCO[C@]3(COCCN(C(=O)C(C)(C)CCl)C3)C2)no1 1837545273 KQPZWIAAONLVRL-HXUWFJFHSA-N 456.927 0.434 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837677891 IRQVVOQQAILPRK-IFIJOSMWSA-N 452.321 0.438 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)N1CCC(OC2CCN(C(=O)[C@@H](F)Cl)CC2)CC1 1838083618 YLSNXYMMZQZBOM-QGZVFWFLSA-N 453.964 0.945 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)cn2[nH]cnc(=O)c12 1838468616 KITHEZQKSJDDND-RBZFPXEDSA-N 496.362 0.432 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(C(N)=O)cc3)CC2)CC1 1838789208 LGDUORVJMZJDOF-UHFFFAOYSA-N 473.574 0.771 50 20 JCGD CC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054322 UECUSKTXSZQZED-DEOSSOPVSA-N 489.573 0.158 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1 1839145541 LEPMLYLSTVOKMY-KKSFZXQISA-N 454.955 0.761 50 20 JCGD CCOc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nn1 1839201924 NPJZNLDNYPOXEV-WMLDXEAASA-N 461.288 0.636 50 20 JCGD COc1cc(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839255342 LIDZYDCTKMKPAP-DEOSSOPVSA-N 483.525 0.386 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)c12 1839557229 PAIHPWPPQQOTQV-VWLOTQADSA-N 493.325 0.240 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN(Cc3ccccc3)C(=O)OC)CCO2)C1 1840083945 JQCNAUZASHTYQE-CVDCTZTESA-N 497.976 0.965 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1 1840152474 JKNPWDKOHPLHSN-UWJYYQICSA-N 450.923 0.897 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccccc4o3)C2)C1 1840184615 XJINNJUKIUTDEZ-HSZRJFAPSA-N 458.515 0.876 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(C(F)(F)F)c3)C2)C1 1840185490 NIZJSRSYKKIWIH-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD CCOc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185521 SRYKTLIKSBGWJI-HSZRJFAPSA-N 462.547 0.528 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187242 OVFHOMRFUNDIGJ-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(F)c1F)CCO2 1840719316 GPZIPKHZJCMKRL-OAQYLSRUSA-N 472.464 0.547 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cccc(OCC(F)(F)F)n2)C1 1842198282 MLMKTTNSRGHPFG-UHFFFAOYSA-N 463.221 0.833 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1 1845076577 QMOOMOKVTAIVCV-QKPAOTATSA-N 457.955 0.814 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2COC3(C2)CN(C(=O)OC(C)(C)C)C3)C1 1846121384 VZGCKJMWNIRHNK-KRWDZBQOSA-N 493.605 0.589 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@](C)(O)C(F)(F)F)NC(=O)NCc1ccccc1 1847987660 CRXFHTDTKKKOSY-TWOQFEAHSA-N 471.480 0.848 50 20 JCGD COc1ccc(CC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1S(=O)(=O)N1CCOCC1 17581037 ICQIUVCJVGEYHW-UHFFFAOYSA-N 487.538 0.676 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccc(NC(=O)CCN2CCOCC2)c1 725873874 SYFDXGFVIAXDOY-UHFFFAOYSA-N 488.570 0.669 50 20 JCGD Cc1ccc(F)c(NC(=S)NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)c1 745195920 WBLXDNQSCQEVEY-UHFFFAOYSA-N 453.477 0.707 50 20 JCGD NS(=O)(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3ccc(F)cc3)CC2)cc1 751508742 CDYJETOZAWIWAG-UHFFFAOYSA-N 498.558 0.264 50 20 JCGD O=C(COC(=O)c1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1 756830644 DDWRTRQZCKOEGI-UHFFFAOYSA-N 462.440 0.753 50 20 JCGD O=C(COC(=O)CCCN1C(=O)c2ccccc2C1=O)NNC(=O)[C@H]1COc2ccccc2O1 792891617 SRQKXTPVBHLERP-GOSISDBHSA-N 467.434 0.593 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CC[C@@H]1CCCO1)c(=O)n2Cc1ccccc1 914755009 BRHCHNPZJWKOAA-KRWDZBQOSA-N 468.514 0.535 50 20 JCGD COc1cc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)ccc1OCC(=O)N(C)C 916641374 AIQPPBLLNPQASW-UHFFFAOYSA-N 482.497 0.553 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c1cccs1 917918242 NNTXHTYQAALXDP-LLVKDONJSA-N 459.575 0.478 50 20 JCGD O=C(CCNC(=O)Nc1ccc(Br)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919885754 NMNJBFIYSYWAIE-LBPRGKRZSA-N 462.326 0.478 50 20 JCGD O=C(CCCOc1ccc(I)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919889011 SYVPSTRJDPADOV-LBPRGKRZSA-N 481.312 0.968 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)NCc2ccco2)o1 920855964 JLEMWWYNYPCYJY-CYBMUJFWSA-N 454.461 0.733 50 20 JCGD Cc1nn([C@H]2CCS(=O)(=O)C2)c2nc(C3CC3)cc(C(=O)NNC(=O)N3CCOCC3)c12 1318056504 GKDOZTYYCLWLCP-AWEZNQCLSA-N 462.532 0.663 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ncccn4n3)C2)C1 1778464397 QXHRDBXBJYFHCS-BHSKHCGUSA-N 464.486 0.307 50 20 JCGD C[C@@H]1CCc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)n[nH]c21 1778602494 URZQAOKVMFDPEJ-ZCLJVBCSSA-N 466.347 0.581 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028437 FEAXHELSVIGQLQ-WNSKOXEYSA-N 490.561 0.289 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(F)cc(F)c1F)CCO2 1779035185 AQTGORPQJQPMEV-NRFANRHFSA-N 463.416 0.860 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c1OCCO3)C2 1779372716 ZJQKJVZILBNHQJ-CJFMBICVSA-N 495.536 0.898 50 20 JCGD COc1ccnc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)c1 1779532600 TWIGCSWCYZZWHQ-BHSKHCGUSA-N 454.487 0.668 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1780021079 GKHHHTKDQXARCB-IFXJQAMLSA-N 466.336 0.948 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2)[C@@H](F)Br 1780777138 SDTMLUFAJFPQIP-DDUZABMNSA-N 489.298 0.961 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2cccc([N+](=O)[O-])c2=O)C1 1781562388 ITKKBDUKGIHGHY-YYFZDKIDSA-N 470.910 0.524 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)C=CC2=O)C1 1782311642 ABKQBOCTBNJRRU-IQUTYRLHSA-N 456.337 0.456 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)C[C@@H]3NC(=O)NC3=O)CCO2)C1 1782863721 KIWZUWLCSLVMNO-WEAMYWHDSA-N 473.436 0.300 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1783510572 ZCAVOSXEGYEXFS-IQGLISFBSA-N 495.341 0.125 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1783684247 DOFQRCQARMKCPD-PISWEHOVSA-N 499.373 0.209 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccnc1OCC1CC1)CCO2 1783936566 PHIRLIBMHPFSMZ-HSZRJFAPSA-N 459.547 0.687 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C[C@@H]21)c1cccc(B(O)O)c1 1786984980 FUUXFCREUCBMFY-LRQRDZAKSA-N 485.277 0.250 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cccnc4n3)C[C@@H]21 1787508699 PDNQZMVXXQZDAR-BRZMCFHBSA-N 478.513 0.457 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(N4CCOCC4)n3)[C@H]2C1 1787656901 DHTQSRUZLRUIKX-DWRORGKVSA-N 466.966 0.765 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cn2c(Cl)cccc2n1 1787862365 GEQHSRLKHSKZCO-IEZWGBDMSA-N 482.733 0.575 50 20 JCGD Cc1cccn2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cnccc5C(=O)NN)[C@H]4C3)c12 1788609859 OHMONLGOSMHKJZ-YSSFQJQWSA-N 477.525 0.548 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)N1CSCSC1 1788611081 KMAKBMWSGVMHQJ-USJZOSNVSA-N 494.643 0.321 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nnc3C)C[C@@H]21 1789222184 DPGHCLOOXBQRFH-OWQGQXMQSA-N 472.458 0.854 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CC(O)C3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724902 QNYFEKGBURNBQY-WMCAYINRSA-N 473.574 0.083 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1789927756 CGUJXDAAOXLFLZ-RMEBNNNOSA-N 451.923 0.776 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)c1ccc(F)cc1 1791291003 VTURTNPLZHCHEO-QUZFRVLNSA-N 491.564 0.356 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4CN3)C[C@@H]21 1791291356 SBMTZWREFQWUNC-TUFLPTIASA-N 457.575 0.054 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791574664 NEDBMEBVKBQTQD-LQJIQPLVSA-N 469.372 0.536 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(-c2ncc[nH]2)cc1 1792032601 SFCYHYRAEOCHIT-BVSLBCMMSA-N 474.326 0.664 50 20 JCGD COc1ncc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1792402987 YWFJIRFLGRLYBT-IVWMJMPLSA-N 453.927 0.320 50 20 JCGD COc1ccc(Cn2cc(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)cn2)cc1 1793995812 TZRBYMXIABKGHH-TWWGPRNNSA-N 476.961 0.672 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC[C@H](N)C(N)=O)C2 1794142864 ZZEYCFUVFVFWOU-AICCOOGYSA-N 459.975 0.350 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1 1796193226 XBJQPBFJRSKAHY-WKCHPHFGSA-N 484.383 0.655 50 20 JCGD C[S@](=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796361334 NYQXZSGJRCFFHY-LMOVZMPUSA-N 483.990 0.772 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn2nc(N3CCOCC3)ccc12)[C@H](O)CCl 1796431213 RRMWSTDZJICOQH-JYYAWHABSA-N 462.938 0.417 50 20 JCGD Cn1ncc(Br)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1797252182 GNZCKYAVEXIFBW-QDMKHBRRSA-N 461.125 0.428 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1C)C2)NC(=O)NCc1ccccc1 1799094925 KAQPBGAMOMSBAI-IIZPIQPGSA-N 472.590 0.016 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1799247706 FJIGMWAQIKVQRZ-STGWMILLSA-N 479.933 0.957 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1799273643 FLGWWEQNHSLMSO-KJPXCLDGSA-N 473.357 0.819 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2ncnn2c1 1810053060 SEUQUVTXGYLYNP-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD CN(CC(=O)N1CCC2(CCCN(C(=O)Cn3ccnn3)C2)CC1)NC(=O)NCc1ccccc1 1810207375 JWHRLQOUEIPAOR-UHFFFAOYSA-N 482.589 0.856 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1810546128 OQEFFBYUISTADY-DFQSSKMNSA-N 450.612 0.590 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361700 NLELOVWWSFMIBM-QGZVFWFLSA-N 491.375 0.118 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)Nc2cc([C@H]3CCCCN3C(=O)C(Cl)Cl)[nH]n2)n(C)c1=O 1815800059 XIRZEMJPVAXKTC-LLVKDONJSA-N 497.343 0.653 50 20 JCGD CC(C)(CCl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816669211 ZHFNOLGSQSMVHE-QMMMGPOBSA-N 450.912 0.760 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)sc2C1 1817282764 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O=C(c1ccoc1I)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830723059 KXIUOMBYRXMLJH-BLLLJJGKSA-N 498.701 0.554 50 20 JCGD COc1ccc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)[nH]c2c1 1830727789 FGZSBKIRWJDNTH-WIYYLYMNSA-N 451.907 0.846 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830735745 MLTFQPZWUIRFDI-VQIMIIECSA-N 459.858 0.333 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833083569 BKDOFZRMVRTTCH-IBGZPJMESA-N 493.417 0.557 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833393398 RRHJAUGAUYYADX-KKSFZXQISA-N 469.922 0.317 50 20 JCGD CC(C)(C)OC(=O)CC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833608998 WQAFGHGEBPOXNG-UHFFFAOYSA-N 473.379 0.283 50 20 JCGD CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)cn1 1833888731 VGWAMUMDLHOONY-VNSNFZHPSA-N 482.541 0.848 50 20 JCGD O=C(c1ccc(C(F)(F)F)nc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1834272920 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O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)C2CCN(c3ccc(F)cn3)CC2)C1 1845829684 KCAWBSXQCKJSRT-UHFFFAOYSA-N 466.322 0.634 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCC(=O)NC1)NC(=O)NCc1ccccc1 1847321067 KIOYSNTYDSSSIX-FHWLQOOXSA-N 456.547 0.061 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)C1 1848095027 IHZYDWMJRJWFHP-PMACEKPBSA-N 469.347 0.749 50 20 JCGD COc1ccc(CC(=O)OCC(=O)NNC(=O)c2cccs2)cc1S(=O)(=O)N1CCOCC1 8853625 JENGNWSQVBOMMO-UHFFFAOYSA-N 497.551 0.325 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)Nc2ccc(F)cc2)c1 9931179 UOVKUUNADPNSIE-ZDUSSCGKSA-N 455.489 0.822 50 20 JCGD O=C(CCc1nc(=O)c2cnn(-c3ccccc3)c2[nH]1)NNC(=O)c1csc(N2CCOCC2)n1 12804638 PZYDOHYEQWJCCD-UHFFFAOYSA-N 494.537 0.796 50 20 JCGD COc1cc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc(OC)c1OCC(N)=O 726862302 IKLQDHXFNBXBCC-UHFFFAOYSA-N 464.500 0.766 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1 728203178 HOMFJECCGBQGDT-AWEZNQCLSA-N 497.603 0.182 50 20 JCGD CC1CCN([C@@H](C)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1 743340557 HDJVNEKIZKTFHK-KRWDZBQOSA-N 453.613 0.764 50 20 JCGD CCS(=O)(=O)NCc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 857431666 PETDEHFPCCJADV-UHFFFAOYSA-N 467.573 0.802 50 20 JCGD C[C@H]1CN(C[C@@H](C)C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)C[C@@H](C)O1 874090895 IBVLEVXAVGWKNA-KURKYZTESA-N 456.547 0.727 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)C[C@@H](C)O1 912920152 WHLVAYQARFXGOC-CHWSQXEVSA-N 477.381 0.374 50 20 JCGD O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1 913416551 KLSAUCMVYPRONL-CQSZACIVSA-N 459.402 0.971 50 20 JCGD COc1cc(N2C[C@@H](C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cc(OC)c1OC 914437960 TXSMUQAAKKSHAJ-UONOGXRCSA-N 455.533 0.558 50 20 JCGD NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=O)COc1ccc(Br)cc1 914602733 OUVZKZMPTOZKLM-UHFFFAOYSA-N 499.299 0.231 50 20 JCGD O=C(CCCNC(=O)C1CC1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 915059647 JFTJOEOWPRMYQY-UHFFFAOYSA-N 466.560 0.094 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2CN(CC(C)C)CCO2)cc1 915922742 AWXGPOXBBUKMKJ-QGZVFWFLSA-N 455.581 0.303 50 20 JCGD O=C(COC(=O)CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)[C@@H]1COc2ccccc2O1 916530177 MUUPSNFBNKOEQW-SFHVURJKSA-N 482.449 0.283 50 20 JCGD COc1cc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1OCC(=O)N(C)C 916641625 ZGNYNECYPRRAFE-UHFFFAOYSA-N 468.474 0.282 50 20 JCGD CCS(=O)(=O)N1CCC[C@H](C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)C1 919649677 DAQPCVQFHFFLSI-AWEZNQCLSA-N 457.505 0.070 50 20 JCGD O=C(NNC(=O)[C@H]1COc2ccccc2O1)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 919805949 FBCWNIUKLIJKIJ-AUUYWEPGSA-N 490.494 0.983 50 20 JCGD NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1 920020341 ROQBRJRBUWFBGN-OCKNTNFFSA-N 450.451 0.980 50 20 JCGD O=C(COC(=O)Cn1cc(C(F)(F)F)ccc1=O)NNC(=O)[C@H]1COc2ccccc2O1 1317690983 JBHLJNPIFMMODE-CQSZACIVSA-N 455.345 0.398 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2Cc3ccccc3CN2)C1 1777989848 KYSKHYVYDRLYDA-VVZHRXSXSA-N 492.580 0.527 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2snnc2C2CC2)C1 1778366809 ROALPPVPDZCQSB-QVKFZJNVSA-N 464.592 0.916 50 20 JCGD Cc1noc(C)c1CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029097 QVJQQEJPDREIMJ-QFIPXVFZSA-N 456.503 0.366 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@H](N)c1cccnc1)C2 1779373177 KJKUIBDCTOJOBC-YOSAUDMPSA-N 481.557 0.298 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCC(=O)N3C)C2)C1 1781366499 DSVPCFSBEDBCAD-HTAPYJJXSA-N 474.470 0.584 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCc3ccc(N(C)C)cc3)C2)C1 1784246812 PENAAWSOKJASKY-XMMPIXPASA-N 459.591 0.888 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccncc34)C[C@@H]21)c1cccc(B(O)O)c1 1786985193 PRPZNHYDLLHNIG-TZYHBYERSA-N 459.311 0.822 50 20 JCGD Cn1cc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)ccc2n1 1786985292 ZRTNDKZRXPDUKE-XJABCFGWSA-N 462.315 0.160 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CS(=O)(=O)C4)[C@H]2C1 1787152386 LJZFWQBKQVOPSL-KSSIRIBKSA-N 479.386 0.668 50 20 JCGD C[C@@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)n[nH]c21 1787950808 RQERMYDTVJNXLY-UVDFWXMISA-N 452.320 0.046 50 20 JCGD O=C(CCN1C(=O)c2ccccc2C1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1793862569 ZXHUOAUXRHYIGZ-LZDSYCOUSA-N 482.306 0.953 50 20 JCGD Cn1c(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc2ccccc21 1795732803 MVDUYGUJZRCWCG-NHKMSHSESA-N 461.327 0.304 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(F)(F)F)C2)c1ccc(B(O)O)cc1 1795734986 FEMAXKYOTSYQGT-CCWDJLKJSA-N 462.233 0.902 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl)C(C)C 1796367674 MXKNZAWEMKHUPH-FQMQPWHVSA-N 490.960 0.482 50 20 JCGD COc1cccc(Cl)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754026 JOMWAYMQIFMZLW-DBWKPXFBSA-N 473.917 0.864 50 20 JCGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@](C)(Cl)CCl)cn2[nH]cnc(=O)c12 1799276753 LFAGWKZKLSJMCI-MAAUKKLOSA-N 456.330 0.771 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1 1799333466 IGSNEFDIACAAQL-QKQGURCUSA-N 475.970 0.514 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(-n2ccnc2)ccn1 1799459675 RLXYHHVOOAPKJQ-ACHSLPGTSA-N 460.498 0.831 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)nc2ccc(Cl)cn12 1800089488 KWDGBLFSONNXAA-VTEUUUEMSA-N 497.943 0.812 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H](O)CN1)C2 1800335671 ALFZLCTZMLZQHR-XEGNAJDBSA-N 489.370 0.668 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803142066 XAQLUSWSKFYCBS-KCYZZUKISA-N 456.927 0.530 50 20 JCGD CC(=O)NCC(C)(C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1803720318 OCMMRMCFBCQUDI-WIYYLYMNSA-N 460.579 0.623 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CN3CCSCC3)C2)CC1 1804816010 SALQQPONFGMNBH-UHFFFAOYSA-N 460.604 0.579 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1 1807364775 KCKMSAVFDPFJNH-TWWGPRNNSA-N 479.342 0.670 50 20 JCGD O=C1Cc2cc(C(=O)N3CC[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)ccc2N1 1807376604 VFSNUQPYXSOWSS-YADARESESA-N 484.321 0.889 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1808195400 FQIBAMGIDDZMKK-LUKYLMHMSA-N 470.954 0.573 50 20 JCGD COCCn1nccc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1808638595 UZCWYMCCNBMTHX-UTKZUKDTSA-N 492.540 0.556 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1)[C@H](F)Br 1808650846 GIZJBMSUMBVVAT-GLQYFDAESA-N 456.272 0.330 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc2nonc2c1 1809127138 PVJAPTJVUPTFPI-GCJKJVERSA-N 471.282 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1 1810298246 HFERUTVHSBQMOT-UZLBHIALSA-N 461.482 0.347 50 20 JCGD Cc1nccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810301936 DXFCBVJAVMVYOQ-UZLBHIALSA-N 460.498 0.812 50 20 JCGD CC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1812621029 IHXLQZMXMVDCII-URXFXBBRSA-N 495.584 0.570 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2 1817275711 AAVZLZKEMNQKSX-OIYSOREESA-N 452.924 0.789 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474875 INFSLNKPCKMQPF-AZUAARDMSA-N 462.319 0.360 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)[nH]n1)c1cccc(B(O)O)c1 1817477046 XGKXLFCNTPISDB-QGZVFWFLSA-N 487.285 0.112 50 20 JCGD O=C(CNC(=O)c1ccco1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1817603813 CPVIJGBNBYYERR-KRWDZBQOSA-N 465.275 0.418 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)CC1 1818814120 SHPWQBSMTAUBIU-LSDHHAIUSA-N 461.972 0.673 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1cncnc1)CC2 1819793663 QYGWFGKZBLGNHR-LBPRGKRZSA-N 452.500 0.400 50 20 JCGD CN1CCCn2nc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)[nH]n3)cc2C1 1821593731 VJPVAYMHRLURNH-OAQYLSRUSA-N 491.361 0.741 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N1CCN(C)CC1 1822415602 LVMVHJJJHIGWGO-WMZOPIPTSA-N 462.599 0.411 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3C[C@H](O)CN3)sc2C1 1822612263 HCDPFJQNNAZOGM-RBOXIYTFSA-N 489.510 0.925 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCc3nc[nH]c3C1)CC2 1826092301 YGKUZSCYPFHKGJ-STQMWFEESA-N 459.576 0.956 50 20 JCGD O=C(c1cnc(O)[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551511 QFIHWPANZNIWJC-JTSKRJEESA-N 491.932 0.781 50 20 JCGD O=C(C#Cc1ccc(Cl)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830467346 YYRPKMZZUHQGPQ-XMMPIXPASA-N 482.729 0.142 50 20 JCGD C[C@@H](Sc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831158841 DWINSMCTEFBXPL-MZNJEOGPSA-N 499.593 0.936 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3n(n2)CCCNC3=O)CC1 1831873056 HMPFAZWVHCLPBS-IBGZPJMESA-N 487.605 0.623 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1 1832423432 DMHUGDJTDUPEJA-OAQYLSRUSA-N 455.628 0.697 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3csnn3)C2)C1 1832549031 BXLQPXBOMUMXCS-ORAYPTAESA-N 489.982 0.740 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccncc3=O)CC2)CC1 1833264307 CQHLXEIKYRPELA-HNNXBMFYSA-N 468.396 0.846 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c(C)c1F)CCO2 1833670079 GQVDESVRUVSZRR-NFCNUSAFSA-N 475.481 0.061 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CNCP(=O)(O)O)CC2)CC1 1834665525 JTDGTJOHBKPVSU-GFCCVEGCSA-N 469.317 0.066 50 20 JCGD Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)on1 1834799876 KNHVHTGPRLWRQA-UHFFFAOYSA-N 454.336 0.091 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccc3F)C2)C1 1835925913 AMAPKOVEXCWCSX-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836713269 AVKHAYZGTSWPPE-QZTJIDSGSA-N 492.013 0.860 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837456702 MDPFEFIHLQUVJC-HSZRJFAPSA-N 485.545 0.020 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C(F)(F)F)[nH]3)CCO2)C1 1837764908 RXBOSOKGXNRNSL-HXUWFJFHSA-N 496.446 0.416 50 20 JCGD O=C(CC12CCCN1CCC2)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921743 WPTXGFYKYWODBF-UHFFFAOYSA-N 483.418 0.997 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)nn1 1838346189 LZDHJZWIAXNSLB-ACJLOTCBSA-N 457.325 0.586 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838417997 SJCJIXWRYKQNQN-KZULUSFZSA-N 485.360 0.609 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CCO2 1839084469 DDWVSPHOBGGVAY-MXTNKPTQSA-N 457.955 0.098 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)C2)C1 1839141817 UPGOAMHCGNMOIH-NZQNYPKQSA-N 481.977 0.640 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)c(N(C)C)c(F)c1)CCO2 1839469663 ZIQMETQRAFLFIB-QHCPKHFHSA-N 497.543 0.474 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1 1840035546 VKVCROSZICLKEU-XNJGSVPQSA-N 451.314 0.788 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1840152444 IFLQBQIUAUNWNN-KSFYIVLOSA-N 480.949 0.201 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(C(F)F)c3)C2)C1 1840183625 PWPYXKNOVWFDQE-OAQYLSRUSA-N 469.489 0.462 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1 1840383929 CKKBXZGUFVEJBI-HXTHCWADSA-N 485.545 0.254 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840724184 KIPQCEYOBIDBPL-DEOSSOPVSA-N 496.524 0.027 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014508 RLTOMPXCQDFMNU-HSALFYBXSA-N 499.373 0.208 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](C)[C@H]2SC(=N)NC2=O)C1 1843405348 QTUKXRANZWCEMN-IXUKHDCHSA-N 459.532 0.126 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)c1cnoc1)C2 1843428703 LILIJLBJWMZCBW-IBGZPJMESA-N 498.345 0.307 50 20 JCGD C[C@H](C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1)n1cccn1 1845039513 WZDZHOAWIDWWKW-GOSISDBHSA-N 453.547 0.994 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]2F)C1 1845903234 DNDZURDJFXRZQE-FHWLQOOXSA-N 489.353 0.364 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1nc3ccc(C(F)(F)F)cn3n1)C2 1846384510 BBUWPWUUUINDQW-UHFFFAOYSA-N 467.452 0.938 50 20 JCGD CN(C)C(=O)[C@H]1CCCN1CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 726277290 LLSKGUJBHWXMBZ-LJQANCHMSA-N 494.618 0.358 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1nn(-c2ccccc2)cc1O 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Cn1c(CC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)nc2ccccc21 918549904 VTCMNRUGETUGTD-HNNXBMFYSA-N 497.533 0.901 50 20 JCGD COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919884330 HXTCNMNMBSKYLR-AWEZNQCLSA-N 486.506 0.623 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCC(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)CC1 1319919258 ZGSDJYPDSDJHOV-AWEZNQCLSA-N 472.951 0.718 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778057389 XZCVLFBZLPLCHP-MPBGBICISA-N 489.330 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(N4CCOCC4)c3)CCO2)C1 1779036813 GEEXDRULBBXPPM-VWLOTQADSA-N 494.552 0.279 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1 1779374648 AMXYCISQPHEZIK-ZDWFVDTJSA-N 469.546 0.579 50 20 JCGD Cc1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cn2[nH]cnc(=O)c12 1780016692 NGBTZFMLFJUHHW-BUXKBTBVSA-N 466.336 0.806 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc(C(F)(F)F)n1 1780084134 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JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@](C)(O)CN3C(=O)OC(C)(C)C)C2)C1 1783646193 RNTXIRAFKLRDRO-WWLNLUSPSA-N 489.997 0.831 50 20 JCGD CC(C)COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccn1 1783934706 KNIBCSZGSFBPRP-QHCPKHFHSA-N 461.563 0.933 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784094780 RMORPLJPIUFDAR-YSMZAPSNSA-N 471.982 0.965 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785076470 KJRDNHHIJFZXMQ-XAJHFOFHSA-N 486.997 0.789 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncnn3C)[C@H]2C1 1785851457 KQEUFWOSKXOIOQ-OWQGQXMQSA-N 472.458 0.556 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)c3ccccc3)C[C@@H]21 1788611599 LZIVBCQCWJDXLH-MVJPYGJCSA-N 455.490 0.989 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)CC1 1789118865 QBHNDIJXZTWCOU-UHFFFAOYSA-N 499.398 0.786 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cc(O)ccc4n3)C[C@@H]21 1791291508 XOODJRJTSJCLMD-MDKPJZGXSA-N 469.542 0.907 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)c1ccccc1F 1792980216 NYGQCHSEJVNANY-MPZKKPTJSA-N 455.914 0.366 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1cccc(S(=O)(=O)N2CCOCC2)c1 1793118157 YRHJZWDEXSSUAM-SFNKJDCFSA-N 485.990 0.559 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1CS(C)(=O)=O 1794405520 WFJAJSAHCKRWLG-NFFDBFGFSA-N 474.377 0.613 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1795586050 GTYLOVIJWZZQHE-XVIXHAIJSA-N 481.363 0.509 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1796391898 JRAWJNLYZKMFRA-HLPPOEQASA-N 478.384 0.901 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/N1CCCCC1)NC(=O)NCc1ccccc1 1797744358 FSLXCLNXOBZUHU-FFXORAGPSA-N 499.616 0.394 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nnc(-c2ccccc2)o1 1797820108 DJNSOJSIBWVESQ-JLVBRIDZSA-N 477.481 0.252 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C)noc1N)C2 1798522284 NJFHJLWPANZKHI-IVWMJMPLSA-N 473.442 0.916 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)c1 1799098855 JMZOALNZMUHBPJ-DXKRWKNPSA-N 497.600 0.688 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1799268741 IKJMAAQIUTXOQG-DMUMMCEESA-N 465.982 0.940 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCn1ccnn1)C2)NC(=O)NCc1ccccc1 1799869607 UHGNUVAPKFFIST-ACDBMABISA-N 468.562 0.653 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2 1800756245 JQQPIDYMVGZRPU-OEYIWLLWSA-N 474.377 0.613 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2 1800759701 CYGKSJAUTXTNJG-DIACKHNESA-N 450.330 0.203 50 20 JCGD 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O=C(NC[C@@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375996 ROCLNVBPRYMKHZ-MYOSFUKOSA-N 463.347 0.553 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)c2nc[nH]n2)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807455328 ZYMOCEZSJZOCTO-FPOVZHCZSA-N 491.556 0.866 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C2CCOCC2)[C@@H]1c1cccnc1 1810298332 HPCNUFGBKMZNJA-FXAWDEMLSA-N 452.515 0.826 50 20 JCGD COCCOCCOCCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812930766 BSDRAKQGNQCTNZ-QPPBQGQZSA-N 499.373 0.151 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813095888 PFLWKSKUJVCJJW-ABSDTBQOSA-N 451.593 0.574 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1 1814767734 HLYUKNKOWFYRFF-SNVBAGLBSA-N 450.530 0.631 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815229820 QOIGAXCCRWBBGH-SUMWQHHRSA-N 462.337 0.076 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)c2cccnc2)n[nH]1 1815784079 BVBPWBNHPWDHFJ-SFHVURJKSA-N 491.512 0.539 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2CCSCC2)[nH]n1)c1ccc(B(O)O)cc1 1817470425 QVBDTPZFRNFCFJ-GOSISDBHSA-N 457.365 0.444 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1)c1cccc(B(O)O)c1 1817479169 ILITZKJJUNGDJV-CQSZACIVSA-N 467.213 0.074 50 20 JCGD COCc1oncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1817800869 JEWJWFWEMXPPTK-SNVBAGLBSA-N 471.499 0.816 50 20 JCGD COC(=O)C1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CC1 1821999946 KRLULMANSMEIRR-OAHLLOKOSA-N 455.475 0.667 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3ncnn3c1)CC2 1826088179 UGONEXYKCTWOPE-ZDUSSCGKSA-N 456.532 0.785 50 20 JCGD O=C(c1nc2ccccn2n1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827054518 DGPWPCVQNGHLQG-FQEVSTJZSA-N 461.331 0.956 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426555 ZWPVVBMUAFRKLK-LJQANCHMSA-N 453.304 0.720 50 20 JCGD Cc1cccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)n1 1829728562 XSHGWBLJWVMWDT-WCYCAPIHSA-N 459.547 0.233 50 20 JCGD Cc1cccnc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1832781431 NAWWUAHRSHXQAQ-HSZRJFAPSA-N 461.563 0.152 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833025326 CEZYQRZGZSRACM-OYHNWAKOSA-N 494.621 0.301 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Cn1cccn1)CCO2 1833197329 YMAWCMNBMJBFDH-VUGUJGDZSA-N 485.545 0.110 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1 1833448311 BREHLKICOBBYBC-GJZGRUSLSA-N 495.484 0.917 50 20 JCGD Cc1ccc2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)sc2c1 1834568219 MHWXPKMDYKZJKN-DEOSSOPVSA-N 495.366 0.668 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1834797164 CNOAIIFBDUVWAQ-OAHLLOKOSA-N 494.394 0.776 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(CO)c(F)c3)CC2)CC1)c1ccc(B(O)O)cc1 1834800646 UTEFOWOCASMVFX-UHFFFAOYSA-N 483.349 0.497 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1 1834824787 MMNDIYJILZKLCI-WIYYLYMNSA-N 479.375 0.994 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc2c(n1)OCCO2 1835041687 GCHPGLGUMZHHJQ-UHFFFAOYSA-N 494.357 0.032 50 20 JCGD O=C(C#CC1(O)CCCCC1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835750186 JWMSWXJAWZEWPP-UHFFFAOYSA-N 481.402 0.250 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3csc4c3CCCC4)C2)C1 1835937390 SRFFQSHHLKMKLY-XMMPIXPASA-N 484.383 0.691 50 20 JCGD O=C(c1nc2ccccn2n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1836396797 CYPUBSIVFCLHFC-DYVFJYSZSA-N 456.272 0.490 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1 1836412639 ORLLZMDHNFAVRT-ZIAGYGMSSA-N 450.353 0.695 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CNC(=O)C(F)(F)F)CC2)CC1)[C@@H](F)Br 1836414642 VQGAKBHBABHRFA-CYBMUJFWSA-N 475.281 0.927 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1837883207 WGLAPGDTADLKSG-HZPDHXFCSA-N 461.401 0.751 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)cn2[nH]cnc(=O)c12 1838468619 KITHEZQKSJDDND-ZUOKHONESA-N 496.362 0.432 50 20 JCGD Cn1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc2c[nH]c3nccc-3c21 1838483667 RINGVQIYHTWJMP-JTSKRJEESA-N 475.933 0.676 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)nn1 1838831311 CSGYIQGJCYJBOP-YOEHRIQHSA-N 461.288 0.636 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049413 WIZJSNYVCCGSHV-WOJBJXKFSA-N 470.357 0.965 50 20 JCGD CN1CCN(C2(C(=O)N3CCO[C@]4(COCCN(C(=O)CCBr)C4)C3)CC2)CC1 1839107958 UANWBXSWGILOMU-IBGZPJMESA-N 473.412 0.008 50 20 JCGD COc1ccc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839360660 RWRMMKYSEWHFTK-HSZRJFAPSA-N 462.547 0.447 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OC)cn3)C2)C1 1839963405 JJIPUAOYMWIJGN-SCLBCKFNSA-N 457.325 0.729 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840085053 VOGKFXVHYBVWEY-QKYRPPLUSA-N 498.316 0.298 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1 1840153135 FPBOHLLQKAYYLC-VFNWGFHPSA-N 467.906 0.341 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(F)(F)F)n3C)C2)C1 1840184353 HTUSNZMJIPWAQB-FQEVSTJZSA-N 489.495 0.487 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3coc([Si](C)(C)C)c3)C2)C1 1840184793 AMMBZZDSULDZEB-QFIPXVFZSA-N 480.638 0.268 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1840381311 VNIWXZGJLGODHS-JKSUJKDBSA-N 452.364 0.590 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cccn1)CCO2 1840440700 JLGJDIPAYPBDAM-GYBNKOMZSA-N 471.518 0.035 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840945561 VATCIUKIIWJPMV-AUUYWEPGSA-N 479.933 0.002 50 20 JCGD O=C(Cc1ccc(Br)nc1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011978 QPQVUCVWFOKBBF-UHFFFAOYSA-N 458.121 0.584 50 20 JCGD Cc1ncc(Br)cc1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013623 QRQBUAMGKUTSKP-UHFFFAOYSA-N 458.121 0.963 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1845145347 DUECEBIKRCDBTA-KGLIPLIRSA-N 461.943 0.636 50 20 JCGD O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 9931441 OOJXORVPSHVOAC-CQSZACIVSA-N 469.516 0.751 50 20 JCGD O=C(Cn1cc(Br)c(=O)[nH]c1=O)NNC(=O)c1ccc(Br)s1 24308272 MRJQMNLGHONHIF-UHFFFAOYSA-N 452.084 0.584 50 20 JCGD COc1cc(C(=O)NNC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)cc(OC)c1OC 726281606 AIOISVVTIHNGMH-QFIPXVFZSA-N 471.470 0.911 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727062995 DTCFMWVQDFECAJ-UHFFFAOYSA-N 479.291 0.518 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(S(=O)(=O)N(C)C)c1 727610840 UTBKWNTYRVHNNL-CYBMUJFWSA-N 482.588 0.935 50 20 JCGD C[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1ccc2c(c1)CC(=O)N2C 728402083 XXRNKJPNFYVJTH-HNNXBMFYSA-N 487.586 0.924 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1nc(-c2ccccc2)n(-c2ccccc2)n1 728512940 ZGYQGIOPXLFOMK-IBGZPJMESA-N 475.509 0.822 50 20 JCGD CN(C(=O)CN1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1)C1CCCCC1 728596583 KOKDWNLNFYZPOV-UHFFFAOYSA-N 464.592 0.627 50 20 JCGD CCS(=O)(=O)NCCCNC(=O)NNC(=O)[C@H](C)Oc1cccc(Br)c1 728943005 BVIXYHULPFZFBZ-NSHDSACASA-N 451.343 0.876 50 20 JCGD COc1cc(C=NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc(OC)c1OCC(N)=O 730546055 SGFYQTHEVYNWOL-UHFFFAOYSA-N 464.500 0.582 50 20 JCGD CCc1ccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)cc1 733143690 ITXBYMPNRWYLJA-UHFFFAOYSA-N 494.595 0.758 50 20 JCGD COCCS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 749463321 FAIULDMPNCWGCX-UHFFFAOYSA-N 495.579 0.966 50 20 JCGD Cc1ncc([N+](=O)[O-])cc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 750558370 LZAPRLORPDVRCK-UHFFFAOYSA-N 477.499 0.713 50 20 JCGD COc1cc2ncn(CCCC(=O)NNC(=O)CNC(=O)c3cccs3)c(=O)c2cc1OC 751208518 FUILRFUJFLVFME-UHFFFAOYSA-N 473.511 0.833 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCN2C(=O)[C@H]3CCCC[C@@H]3C2=O)cc1OC 784375823 UHFHIJPJAPDZRY-GJZGRUSLSA-N 461.471 0.573 50 20 JCGD COc1ncccc1CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916399248 TWCFANACTHCKJW-UHFFFAOYSA-N 477.543 0.574 50 20 JCGD O=C(NNS(=O)(=O)c1cc(F)ccc1[N+](=O)[O-])c1cccc(S(=O)(=O)N2CCOCC2)c1 917717993 AQJVXKACWFPHJW-UHFFFAOYSA-N 488.475 0.378 50 20 JCGD O=C(CSc1nnc(-c2cccnc2)n1-c1ccccc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886412 WLYDCZAYOJRPRK-HNNXBMFYSA-N 487.567 0.939 50 20 JCGD CCNC(=O)NNC(=O)[C@@H](CCSC)NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl 920858594 LWURUIBTOCCBBB-CQSZACIVSA-N 480.012 0.792 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029197 NTTQWPAWCAVZCJ-KZULUSFZSA-N 454.325 0.160 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCOc3ccccc3)CCO2)C1 1779030620 DLZZHNCIXVQAGN-HSZRJFAPSA-N 453.499 0.598 50 20 JCGD Cc1noc(C)c1CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371547 YPEFPVHSCWYGPP-AUSIDOKSSA-N 470.530 0.660 50 20 JCGD Cn1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1Cl 1779372647 RRSMWGYXMIREJD-IIBYNOLFSA-N 475.937 0.513 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1779901224 LHSXBACVMQLJPJ-UTKZUKDTSA-N 453.923 0.683 50 20 JCGD COc1cc(OC)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1780386138 RCHXSFSFRCRLDZ-RCZVLFRGSA-N 482.342 0.825 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)c1ccco1)CCO2)NC(=O)NCc1ccccc1 1780969472 MOGJUJLQTMQRQI-QPPBQGQZSA-N 485.541 0.489 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781326445 XSDAXPGIEPVAEG-NVGCLXPQSA-N 468.320 0.392 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c2ccccc21 1781329616 IBRMTSATLBJWCH-LPHOPBHVSA-N 469.311 0.860 50 20 JCGD Cc1ccc(OCCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1783761399 UHALGHABOWYHGH-VJBMBRPKSA-N 466.343 0.737 50 20 JCGD CCc1nn(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1Br 1783933916 MPCRURFCLSYNMQ-HXUWFJFHSA-N 499.410 0.562 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cc3cnc[nH]3)NC(=O)OC(C)(C)C)C2)C1 1784313534 CQIZDWNJFKWLGJ-PNLZDCPESA-N 499.996 0.929 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C[C@@H]21 1791255569 VGLSZKGLISSKJY-QHXHSKPESA-N 451.907 0.955 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1793299007 HVEMVQJGAMNLMP-MHYJACLRSA-N 464.327 0.382 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1COc3ccccc3O1)C2 1796439733 ZHESZQAAYBCLOD-IKTBHQNVSA-N 495.536 0.940 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(F)CCCCC1(F)F)C2 1797750454 ACCWXRCMKQGLGT-KNLUSZGBSA-N 469.464 0.806 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc(C(F)(F)F)n1 1798513398 AKAZYBSEHBNZJT-CCWDJLKJSA-N 493.247 0.306 50 20 JCGD COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(OC)c1 1800416934 MUKINKORFNKJBO-GPVSGQMNSA-N 497.552 0.538 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1800801593 OGVVBYODHJLUTM-OGMFBOKVSA-N 465.906 0.567 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3sccc3c1=O)C2 1801010730 SLXGWUCFUREVQH-USGNIVHTSA-N 475.571 0.026 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1802139714 DZYSMPLQUDWBOD-ZTDQHOIESA-N 499.373 0.039 50 20 JCGD O=C(Cc1cnc2ccccn12)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1803099204 NHXBFTUKAZWZLN-CJFMBICVSA-N 483.337 0.971 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360558 LHWTUXSCKZBZGM-CRAIPNDOSA-N 479.220 0.187 50 20 JCGD C[C@H](O)C(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1807454036 RMXRWIGIRUKCCV-RBDMOPTHSA-N 468.558 0.814 50 20 JCGD CC[C@H](NC(N)=O)C(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808228801 HTHNVAHKYSWPAM-SRFIUDINSA-N 482.545 0.668 50 20 JCGD COCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808820766 GSKZPXHZYPJAPW-UWJYYQICSA-N 464.287 0.529 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1cc2n(n1)CCCNC2=O 1809676652 FUDHOQGUTOZODF-JCGIZDLHSA-N 460.922 0.331 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(C(=O)C(O)O)[C@@H]1c1cccnc1 1811357766 AQVSZAQBLIDVRS-KBXCAEBGSA-N 458.427 0.545 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3[nH]nc4ccncc34)sc2C1 1816861740 KELKSSAQOCPRIU-SNVBAGLBSA-N 477.510 0.953 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nc2ncccn2n1 1818617599 GCNNXDNUXJWYKH-MRXNPFEDSA-N 460.263 0.147 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=C\C(=O)NC1CC1)CC2 1819797345 AMDXZZRSKAUMMP-FJOGCWAESA-N 469.527 0.202 50 20 JCGD COc1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)nn1 1820041385 BQJYJARUBKLQQS-MRXNPFEDSA-N 465.474 0.827 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(CCO)CCO)n[nH]1 1822023495 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JCGD CC(C)(C)NCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1807098780 TUANUDKELCXGPS-OXQOHEQNSA-N 453.547 0.788 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1nccc2nc[nH]c12 1808133011 ZXOCMUUCRRFODO-VGSWGCGISA-N 470.298 0.666 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ncn(-c2ccccc2)n1 1808547856 FPBKKOROXSIWBE-NFBKMPQASA-N 496.336 0.976 50 20 JCGD CN1CCC(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1810293467 DXGGZSDPDFWNRF-NQIIRXRSSA-N 465.558 0.742 50 20 JCGD CN1N=C(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCC1=O 1810295797 XUVRKWUMMBYCNK-YWZLYKJASA-N 478.513 0.008 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@@H]2[C@H]3COC[C@H]32)[C@H]1c1cccnc1 1810309592 SEQNFKAHFYGDCN-NSYSGPAISA-N 450.499 0.292 50 20 JCGD CCNC(=S)NCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1812330380 DEKMTVYMUXLECQ-SSZMOEMMSA-N 498.613 0.705 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1 1813029938 BKFIBAAEWYGPQD-ZQIUZPCESA-N 459.894 0.386 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@@H]1c1cccnc1 1813071471 UCZVVGAFFLJUAQ-HRAATJIYSA-N 473.509 0.870 50 20 JCGD CN1CC(C(=O)NC[C@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2c2cccnc2)C1 1813608347 RTQAINIRZQJFHM-QPPBQGQZSA-N 493.612 0.995 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCS(=O)(=O)CC2)n[nH]1 1815672806 GFPFGAIJTRHCHP-UKRRQHHQSA-N 461.972 0.386 50 20 JCGD COCCn1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n1 1817471121 APIRBJVXQSSIIZ-IBGZPJMESA-N 466.307 0.552 50 20 JCGD Cn1cc(CCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1 1817474207 ARZRYEGVYDHMIE-LJQANCHMSA-N 450.308 0.762 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2[nH]nc3ccncc23)[nH]n1)c1cccc(B(O)O)c1 1817475033 JOLYNIOKYUMFSH-GOSISDBHSA-N 459.275 0.981 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ccc(F)cn3n2)[nH]n1)c1cccc(B(O)O)c1 1817476994 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COc1ccccc1OCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833184736 DGCLGAKDHCZSSD-UHFFFAOYSA-N 495.385 0.639 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833400809 BMCPJMRHHQBBIK-UGSOOPFHSA-N 490.376 0.339 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn(C(C)(C)C)c1Cl)CCO2 1833604922 PUAIHBXLNYRZHO-JOCHJYFZSA-N 499.012 0.735 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cccc4ccnn34)CC2)CC1 1836481169 OPRPUKGIOZSBTQ-UHFFFAOYSA-N 469.590 0.893 50 20 JCGD O=C(Cc1cnc2ccccn12)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836700771 HUNXMYYHPPZXHO-UHFFFAOYSA-N 490.369 0.869 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H]3CNc4ccccc4O3)CCO2)C1 1837356003 ITFRUXLICYCXHJ-HYFFOGBASA-N 467.950 0.960 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1 1837460156 WOELLTBRSTWSAZ-JOCHJYFZSA-N 475.452 0.347 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)C(C)(C)C 1837710466 ZLDNMZAPVGIULH-GHTZIAJQSA-N 457.644 0.845 50 20 JCGD Cn1nc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c2c1CCC2 1837919413 OBSJFTKRPZJMFK-UHFFFAOYSA-N 480.374 0.515 50 20 JCGD Cn1nc2c(c1C(=O)N1CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC1)CCC2 1837920240 SIKAROYRBWDFSO-UHFFFAOYSA-N 480.374 0.515 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cccn4nccc34)CC2)CC1 1837920340 ZWRSHABREDSUSR-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD CCN1CCC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)CC1 1839203722 UGQPKPBZTOMZJM-YJBOKZPZSA-N 450.349 0.865 50 20 JCGD Cc1cc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)ccc2[nH]1 1839615974 UUOUXZHGMKPUHK-VWLOTQADSA-N 492.536 0.859 50 20 JCGD O=C(c1nc2ccc(F)cn2n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839624480 JUUDCKRTJJKYIJ-CXAGYDPISA-N 474.262 0.629 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS(=O)(=O)CC)C2)C1 1839962391 CSAKNDZFGCJYEL-CZUORRHYSA-N 455.371 0.051 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnc4nc3O)C2)C1 1840155142 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CC(C)(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)CC2)cc1 9930744 CUJCMJTWLDUVCE-MRXNPFEDSA-N 485.628 0.967 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 12268104 BFFHFYRSJBSDEJ-UHFFFAOYSA-N 467.887 0.825 50 20 JCGD Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)CNC(=O)c2cccs2)c(C)c1 725740703 GOMJKHUZLBCTED-UHFFFAOYSA-N 452.558 0.919 50 20 JCGD C[C@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)N1C(=O)NC2(CCCC2)C1=O 726522497 MZRKRWZWMKBYQZ-SECBINFHSA-N 457.896 0.002 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCC1 744447431 KWIONHFGDSSHLP-UHFFFAOYSA-N 465.576 0.747 50 20 JCGD O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cccc2cccnc12 747460177 IDASAULXRXLTIE-UHFFFAOYSA-N 483.554 0.726 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)cc1OC 787987821 BEXWUEKGGVIIAG-UHFFFAOYSA-N 483.474 0.711 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cn(-c2ccccc2)nn1 914711302 UQTKOVZKLJCDHH-UHFFFAOYSA-N 484.538 0.682 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)N2CCOCC2)c1 915894230 IUPPAWLTRYOINQ-UHFFFAOYSA-N 455.581 0.772 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)N[C@@H](C)Cn1cccn1)N(S(C)(=O)=O)CC2 916462528 CSWINQUTOYMGOE-WMLDXEAASA-N 494.574 0.568 50 20 JCGD Cc1nc(-c2cccnc2)nc(O)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 918203396 UKTCZXWNTDZDOG-UHFFFAOYSA-N 470.511 0.807 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCc1nccs1)N(S(C)(=O)=O)CC2 918219563 QPWHHCVLTXIMPL-AWEZNQCLSA-N 483.572 0.940 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)C2)n1 919809758 FCXORIBFVFAQOX-HNNXBMFYSA-N 464.504 0.656 50 20 JCGD C[C@@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1)c1ccccc1 919885405 OYSXEYOJAHRSIM-PBHICJAKSA-N 480.568 0.857 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)CCO)cc1 1340282265 BDGBMEOZGSXKDE-UHFFFAOYSA-N 459.528 0.673 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)C1=O 1778711251 GAGVIHWMEICISR-RDTXWAMCSA-N 454.252 0.955 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779029114 LMQVWAXZENPTOC-DFIYOIEZSA-N 479.537 0.941 50 20 JCGD Cc1ccn2ncc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c2c1 1779030265 NBESZWKXTUEMDK-QHCPKHFHSA-N 463.498 0.399 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2)[C@@H](F)Br 1780771592 MRBCQMWYYRKXAQ-CJBNDPTMSA-N 471.287 0.236 50 20 JCGD CO[C@H](C)[C@@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)N(C)C(=O)OC(C)(C)C 1781079971 XSOIVYHOAAVTJX-FAPUVCABSA-N 477.986 0.686 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1782206914 YPWRTIOUXLSXPM-RNCIANSQSA-N 453.305 0.807 50 20 JCGD COc1cccnc1CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782209470 RWWFLNFPEFILCJ-HYBUGGRVSA-N 475.590 0.910 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccccc1-n1nccn1)C2 1782213476 VDQAVIBWQOBCFK-HYBUGGRVSA-N 483.573 0.768 50 20 JCGD 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Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](NC(=O)c2cc(Cl)ccc2F)[C@@H](C)O)n1 728729999 YDHOCFPTSNQRLP-QGHHPUGFSA-N 486.909 0.657 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)OC)o2)c1 730766689 SDTMTPIRIVULKJ-UHFFFAOYSA-N 459.502 0.720 50 20 JCGD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)C1 731220324 CESSUQDYHRUMIU-HZPDHXFCSA-N 464.592 0.531 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)c2ccccc2c1=O 751292972 DPPCJWQXBKPIJW-UHFFFAOYSA-N 459.459 0.588 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)CCNS(=O)(=O)c1ccc(NC(C)=O)cc1 825614947 CKEAQCOJEMBAOX-UHFFFAOYSA-N 463.516 0.582 50 20 JCGD COc1ccnc(NNC(=O)CCn2c(=O)oc3cc(S(=O)(=O)N4CCCC4)ccc32)n1 914762843 QNWKWIATKZBMOZ-UHFFFAOYSA-N 462.488 0.711 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccs2)c1 915188182 HQBXOJCNIWZVAF-UHFFFAOYSA-N 474.586 0.518 50 20 JCGD CNS(=O)(=O)c1cccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)c1 916486059 VHOGCHVAVHFTNA-UHFFFAOYSA-N 456.550 0.503 50 20 JCGD CCN1CCN(CCCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1 916503995 PIBWASBLRKKUBN-UHFFFAOYSA-N 454.597 0.299 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cccc(C(=O)NC3CC3)c2)c1 917719713 NCSUDWGHHBPQJV-UHFFFAOYSA-N 466.541 0.452 50 20 JCGD CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1 1322817505 HSPCDESQDCAUSQ-UHFFFAOYSA-N 490.357 0.836 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1778324676 OSZIMJIIDADGOD-VHKYSDTDSA-N 463.934 0.765 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)CCO2 1779033746 CSFQMTZHMPYQJT-BKMJKUGQSA-N 492.580 0.793 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(F)cc1F)C2 1779371149 JACZRYJANQNGOB-VGOFRKELSA-N 474.468 0.800 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4cccs4)on3)C2)C1 1779565593 NKFKFTSJRLRGCY-JOCHJYFZSA-N 467.312 0.840 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3cncnc3)CCO2)C1 1780095175 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CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CN(CCO)CCO)sc2C1 1825329323 RJNXJSOONIUKPB-RYUDHWBXSA-N 463.398 0.515 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOC1=O)CC2 1826086219 NHLQOZVVAIJHGU-GFCCVEGCSA-N 452.537 0.270 50 20 JCGD CCOC(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)OCC 1826378390 VIYXESAPOSCQST-OAHLLOKOSA-N 461.349 0.838 50 20 JCGD O=C(c1ccc2nncn2c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051919 KAPXSEFUXWIEIB-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD O=C([C@@H]1CCCS1(=O)=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060638 WAIZUCWWGBEORG-UXHICEINSA-N 462.377 0.177 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cc(C)c(O)nc3=O)sc2C1 1827994119 HRYWMVSYSNGHLZ-MNOVXSKESA-N 455.924 0.580 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1 1828924258 MYWOKFSWXHZGFO-QFIPXVFZSA-N 499.616 0.083 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(=O)n3C)C2)C1 1830538150 XFYDKBOMNZUUIV-KUHUBIRLSA-N 456.337 0.486 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1830570284 CBSQNRHUGBSSPH-LIRRHRJNSA-N 494.383 0.113 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830725504 PAENNPMHWWAHGK-UGKGYDQZSA-N 468.934 0.714 50 20 JCGD Cn1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc2c[nH]c3nccc-3c21 1830730916 GFTBBQUHDVZDFE-JTSKRJEESA-N 475.933 0.676 50 20 JCGD O=C(c1cncc(C(F)(F)F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732579 SZBFYFSTLIBOEF-PBHICJAKSA-N 451.829 0.770 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830738630 RAMYQLYUWXDQDI-JLHGSKIFSA-N 489.997 0.736 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1 1832135516 QXFXLUWAMRXXPE-QYZOEREBSA-N 453.971 0.676 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(O)cc3F)CC2)CC1)c1ccc(B(O)O)cc1 1834798380 NQWOGYIUCFKINI-UHFFFAOYSA-N 469.322 0.710 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1835938108 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3C[C@H]3F)C2)C1 1838528129 GSLYMDNUQNLOPJ-LUQKVYGDSA-N 465.434 0.948 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccoc1Cl)CCO2 1838843703 JJXQTHQWKKGZIH-FQEVSTJZSA-N 463.878 0.315 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1839155459 UQCCFAOEONJNTL-MOPGFXCFSA-N 491.328 0.449 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(OC)c1 1839794070 CQGXOVARHCFFRC-AVRDEDQJSA-N 470.950 0.693 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1839964077 FQOLCTFZLHHZKS-BDJLRTHQSA-N 460.285 0.561 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)C1 1840031667 YXZZONMXSBNGNR-IIBYNOLFSA-N 497.390 0.772 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1840035355 OCZARHGVCCNYFG-FOIQADDNSA-N 484.395 0.572 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSCc3[nH]cnc3C)C2)C1 1840153290 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CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC[C@@H]2C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847562987 LRBLPPHWMSPUFH-LTIDMASMSA-N 499.008 0.551 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl)C(C)C 1847565440 QZRRMTSSVFGLHV-WOYTXXSLSA-N 472.970 0.160 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1848330886 VRHKYJFRVQNNAJ-PMACEKPBSA-N 460.299 0.695 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(=O)n1O)NC(=O)NCc1ccccc1 1848348095 IZASUJBVTPDKFB-ROUUACIJSA-N 468.514 0.247 50 20 JCGD COc1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)cc1S(=O)(=O)N1CCOCC1 10473820 HHOSZWWQSAAOQW-UHFFFAOYSA-N 491.522 0.643 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N(C)CCS(C)(=O)=O)cc1 728024086 RZESTWHTBZMTIV-FOWTUZBSSA-N 459.528 0.844 50 20 JCGD CCCS(=O)(=O)c1ccccc1S[C@@H](C)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 730532891 BTYIKXHAXPEAIH-QWHCGFSZSA-N 463.603 0.868 50 20 JCGD COc1cc(N2C[C@H](C(=O)NNC(=O)COc3ccccc3O)CC2=O)cc(OC)c1OC 730781367 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CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3C=CS[C@H]31)C2)NC(=O)NCc1ccccc1 1799098054 ZEDJNAOKTWVFEU-RSBIIAMVSA-N 485.610 0.797 50 20 JCGD COc1ccc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1 1801012164 JRBGOIDEGXVLLB-VTEUUUEMSA-N 452.939 0.925 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801014384 OCRBZFVNGIXNIN-YYAJDYIMSA-N 469.583 0.252 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)C[C@@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1804354471 OSIMWHNYTBMWDS-IZSNYMMISA-N 456.330 0.922 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)/C=N/O[C@H]2CCCCO2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362953 XHJRUGBWBJDIBE-PNYYAQIVSA-N 480.330 0.610 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374679 HFVGCNPFNWFULX-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)no1 1808388767 NLPVDCKYFQUUJI-WZONZLPQSA-N 491.313 0.406 50 20 JCGD Cc1nnsc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1808645945 DLWXHSUESNRGIY-WMZOPIPTSA-N 451.317 0.555 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809978556 XJJNTDCCLZDFRM-IBGZPJMESA-N 489.378 0.097 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1 1810293284 BGNZQTCLOBQQAB-XMSQKQJNSA-N 476.298 0.946 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[nH]n1)[C@@H](O)CCl 1814869842 CYZUVZLEQFBLPY-STQMWFEESA-N 456.912 0.467 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819452331 KBGXDJPDBNVANF-WEEQGOHXSA-N 469.307 0.924 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1cc(O)cc([N+](=O)[O-])c1 1823643494 HVQWLAXBMBWDRX-AWEZNQCLSA-N 482.283 0.976 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)CC2 1825998940 KHLIMEMJNWOJBX-DTWKUNHWSA-N 451.896 0.354 50 20 JCGD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)[C@@H]1SC(=N)NC1=O 1826086547 XQWQUCMRGZMKEM-YHAQOWFVSA-N 481.604 0.231 50 20 JCGD COC(=O)C12CC(C(=O)N[C@@H]3CCc4nc(NC(=O)CCC(=O)NN(C)C)sc4C3)(C1)C2 1826089387 BLQYSFFQCONSQU-BQXHSLBWSA-N 463.560 0.771 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1C(=O)CSC1=S)CC2 1826092115 MOCXEBQIPSRDMK-SNVBAGLBSA-N 484.629 0.288 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)cc21 1828500535 VQWVTWYVXWDLSE-OAQYLSRUSA-N 493.373 0.244 50 20 JCGD NC[C@H](N)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCN2C(=O)OCc2ccccc2)C1 1828833856 YGPJAUCADHJPRW-LAUBAEHRSA-N 496.406 0.510 50 20 JCGD CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCN2C(=O)OCc1ccccc1 1829001364 UWKXTGBDPGPXGW-VWLOTQADSA-N 479.342 0.842 50 20 JCGD CN1CCC(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC1 1830005618 XRSCQVPMALIMPL-FUHWJXTLSA-N 450.349 0.865 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1830454817 HGJZXKOZQLYKST-MHECFPHRSA-N 476.574 0.628 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1830543231 NCNIVEZJBMFMNZ-PJIJBLCYSA-N 494.383 0.317 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1830886062 ATBIMBLINQDZGO-VBKZILBWSA-N 494.372 0.825 50 20 JCGD C#CCO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1831396284 DBRFYDFTMPHARS-WAIKUNEKSA-N 489.481 0.628 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CNC(=O)C2)CC1 1831416084 ASKDIRCXVIVNAR-GLATVHSFSA-N 456.547 0.876 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)CBr)CC2)CC1 1833448309 BREHLKICOBBYBC-CABCVRRESA-N 495.484 0.917 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc2nccnc2c1 1835401992 RTJFPKQLICMXMV-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)CC2)CC1 1835738219 MOZJCQQRVCRYKN-RLLQIKCJSA-N 470.599 0.745 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)n1ccccc1=O 1835825748 ZPWVXFSLHZEUAR-SFHVURJKSA-N 474.606 0.354 50 20 JCGD CC[C@@H](NC)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1835912983 SBAREXDIALDDIV-XMSQKQJNSA-N 478.502 0.588 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nccnc3C(N)=O)CC2)CC1 1836051869 ZQUDYGFSVMLFDW-HNNXBMFYSA-N 452.943 0.015 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2 1836472617 OXTQFBXHCLYNOR-CKJXQJPGSA-N 477.986 0.736 50 20 JCGD C[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)Oc1ccccc1 1837459402 FDIPEGQTHHFKOJ-IQGLISFBSA-N 497.552 0.613 50 20 JCGD CC[C@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1 1837460368 DOECCDCYIOPGMD-XFAGBWLFSA-N 473.574 0.972 50 20 JCGD Cc1nnc(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1837920766 CSCOHGJPJJZBET-UHFFFAOYSA-N 472.376 0.381 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1NC(C)=O 1838606959 FUBMOGCJTUKQBC-UTKZUKDTSA-N 469.922 0.323 50 20 JCGD Cc1nc[nH]c1C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054030 CPLZNEQWSAMKDM-DEOSSOPVSA-N 499.572 0.134 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839152842 MDGZNGXGJCXARB-MOPGFXCFSA-N 463.362 0.836 50 20 JCGD COC(=O)C12CC(C(=O)N3CCOC[C@]4(CN(C(=O)[C@@H](F)Br)CCO4)C3)(C1)C2 1839202414 FCKGWTUMWWYYJU-GGKIJQQKSA-N 463.300 0.477 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839464103 STTUEGGAUFFZIW-VWLOTQADSA-N 482.342 0.376 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1840059534 GLYSMJFTXAWJDU-ODCFSMADSA-N 479.933 0.348 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2c1 1840184467 PBBQGMRGXLIYQY-DEOSSOPVSA-N 487.557 0.620 50 20 JCGD CCOc1ccccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185319 KKTUMTQYIVGBEN-HSZRJFAPSA-N 462.547 0.528 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1 1840758986 JNZHLTSDDJVAQD-YWZLYKJASA-N 471.894 0.927 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2ccc(Cl)cc2[N+](=O)[O-])C1 1841330348 IZVWOQLZRDSDTA-UHFFFAOYSA-N 457.679 0.988 50 20 JCGD CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC[C@@H]2C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841353954 ZQTUMGOZSGITCU-CVEARBPZSA-N 499.008 0.553 50 20 JCGD Cc1cc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)n(-c2cccc(=O)n2C)n1 1843132132 JXXDKFTUZRXUND-UHFFFAOYSA-N 490.524 0.009 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1843415934 FMVDBDYBEPVWAG-AEIQVQRHSA-N 490.561 0.864 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1nn[nH]c1C(F)(F)F)C2)NC(=O)NCc1ccccc1 1845039123 GRHPLFIIQLEFFU-UHFFFAOYSA-N 494.478 0.987 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846484802 OCAQEUYRBJKNTL-MRXNPFEDSA-N 486.529 0.428 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CCC(=O)N2C(=O)OC(C)(C)C)C1 1846485656 KPEHBASADWBWTA-OAHLLOKOSA-N 465.551 0.489 50 20 JCGD C[C@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1cncn1 1846600479 DGRYQXSTMMRQBY-QGZVFWFLSA-N 454.535 0.389 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)C[C@@H]2C[C@@H]21 1847573203 PIRDMNCIJWOMHB-JBDAPHQKSA-N 469.347 0.580 50 20 JCGD Cc1ccccc1C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 15021649 DZPIPWJRXKNGGP-QGZVFWFLSA-N 453.542 0.538 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNC(=O)c2cccc(Cl)c2)cc1 15902032 DJOLXOGVWYIZBV-UHFFFAOYSA-N 452.920 0.846 50 20 JCGD CN(CC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)C1=NS(=O)(=O)c2ccccc21 17340065 XAXUCZPTZVTCOP-UHFFFAOYSA-N 484.582 0.427 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N(C)C3(CCCCC3)C2=O)cc1OC 104812224 HLBHNSOHHYACEK-UHFFFAOYSA-N 476.486 0.605 50 20 JCGD O=C(CCC1CCCC1)NCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 726521702 NVBSNBVRUGPHCF-UHFFFAOYSA-N 466.560 0.555 50 20 JCGD CCc1nc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cs1 726717520 YRIWLBLYEDREIA-UHFFFAOYSA-N 467.573 0.913 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(OCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)c([N+](=O)[O-])c1 728179144 OYJJGKSHKPQTKD-CQSZACIVSA-N 492.576 0.496 50 20 JCGD CS(=O)(=O)Nc1ccc(F)cc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728323428 FXTBVPJLYPNCRH-INIZCTEOSA-N 467.431 0.341 50 20 JCGD CC(C)(C)OC(=O)[C@H]1CC(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)=NN1c1ccccc1 728803671 AHYAEIOIIZEGHC-CZUORRHYSA-N 450.517 0.545 50 20 JCGD COc1ccc(N2C[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)c(OC)c1 728845148 HJSLYAXQFSETSD-INIZCTEOSA-N 468.514 0.911 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)c1 729229712 DUMYRTWDSZTERT-UHFFFAOYSA-N 456.503 0.945 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)nc1 729615247 WGQNCPOCVKSGQR-UHFFFAOYSA-N 491.622 0.787 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)NCCN=c2ncnc3n(C)[nH]c(Br)c2-3)c1 729625550 YABKXPWQGZYRSU-UHFFFAOYSA-N 493.322 0.573 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Br)C(=O)N1CCCC1 748246537 CITPQYFAJARTKE-UHFFFAOYSA-N 473.349 0.617 50 20 JCGD O=C(NNC(=O)[C@H]1Cc2ccccc2O1)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12 748276559 MQUJBWXYNGQKNE-HXUWFJFHSA-N 498.517 0.726 50 20 JCGD COc1cc(C(=O)NNC(=O)CCNS(=O)(=O)c2cn(C)c(C)n2)ccc1OC(C)C 750662161 AQVDNWBTNNYSPP-UHFFFAOYSA-N 453.521 0.654 50 20 JCGD CS(=O)(=O)c1cc(Br)cc(C(=O)NNC(=O)CNC(=O)c2ccco2)c1F 751200665 XMBPVLWFTDAVBY-UHFFFAOYSA-N 462.253 0.776 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NN=C(C)c1cc(C(N)=O)n(C)c1)N(S(C)(=O)=O)CC2 767167093 WIVBOAIABBARKG-QGZVFWFLSA-N 491.570 0.931 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1 818581012 SOUNLJUKFDVVGS-UHFFFAOYSA-N 454.530 0.651 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1c(C)nn(C)c1Cl)c(=O)n2Cc1ccccc1 822238086 RZPSGIMTNUCTQP-UHFFFAOYSA-N 498.931 0.584 50 20 JCGD Cc1cc(C)nc(NNC(=O)C2CCN(S(=O)(=O)c3ccc(S(N)(=O)=O)cc3)CC2)n1 837302385 PGNGLMOYGVQGOH-UHFFFAOYSA-N 468.561 0.285 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCN2CCOCC2)c1 912851783 FQPROSABJQDXHZ-UHFFFAOYSA-N 462.528 0.979 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1 912920157 WOMSDMWQQFYPRD-JZXOWHBKSA-N 472.633 0.733 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 913155984 NHOVEBDQSNMIHO-HRCADAONSA-N 457.516 0.330 50 20 JCGD COc1ccc(N2C[C@@H](C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1 913320285 UTLJVABXRVOQPY-AWEZNQCLSA-N 456.411 0.961 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1 917108276 BOSYMXLDIPWCSU-UHFFFAOYSA-N 453.498 0.032 50 20 JCGD C[C@@H](C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)S(=O)(=O)c1ccc(F)cc1 917918799 GKYMIPBINUZPFV-VIFPVBQESA-N 463.896 0.750 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919885826 RXINDEQKRYXGSV-CABCVRRESA-N 472.589 0.689 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)C1CCOCC1)N(S(C)(=O)=O)CC2 920275388 BKKLEZZPVUYUHP-MRXNPFEDSA-N 455.533 0.527 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc4cccnc4s3)C2)C1 1777752397 KOTYJBFXLOJZGX-QFIPXVFZSA-N 451.313 0.733 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1779321162 YQAFJEYZVADADR-SNDXAZSDSA-N 476.480 0.853 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC(F)F)cc3F)C2)C1 1780140069 IWXUDFBZTZQDJG-JOCHJYFZSA-N 478.232 0.864 50 20 JCGD CC[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)NC(=O)OC(C)(C)C 1781357116 HRIIMFRSGFUFPL-DVECYGJZSA-N 489.378 0.503 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCS1(=O)=O)C2 1782002482 QIQIDAWJNDKOLS-ZOMKSWQUSA-N 451.383 0.861 50 20 JCGD Cc1cnc2c(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)CCC(=O)NN(C)C)C3)cnn2c1 1782214137 FMAAGFIDNSMMOE-WZONZLPQSA-N 471.562 0.538 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(Cl)nc3)[C@H]2C1 1783379532 HPXDDICIOGAAQW-JKYBXLBGSA-N 473.921 0.857 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)[C@@H](O)C1 1783478386 IBWWPPRMODOYOK-QQCJEOGWSA-N 489.997 0.184 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788140168 KVBBBEBDDPSGOY-HNNXBMFYSA-N 473.360 0.442 50 20 JCGD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)[C@@H]1SC(=N)NC1=O 1788143961 ZOBQIEZISDRODL-UGSOOPFHSA-N 480.355 0.917 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609816 LRPQGWNPWZUUEU-DDWPSWQVSA-N 468.352 0.452 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610465 UCAKAHDBCITXDR-XERREHJYSA-N 481.509 0.577 50 20 JCGD COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1OC 1791290995 VIKWRIBLRBMZLB-ZOBUZTSGSA-N 463.535 0.065 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(Cl)c1 1792016988 JEJYIGVFUPHPBM-ZRCAFCQKSA-N 472.734 0.936 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(F)CCCCC1(F)F)C2)c1cccc(B(O)O)c1 1795738975 KOKCWYKWBMTERR-DOHHPOSVSA-N 454.254 0.487 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1 1796187167 OEUQWRQBVOFGRM-ACDBMABISA-N 470.356 0.264 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)C1 1796191364 CRNALNWDKDDBFX-RSPOEFSDSA-N 471.363 0.875 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1COc3ccccc3O1)C2 1796439734 ZHESZQAAYBCLOD-ZHKJIPFASA-N 495.536 0.940 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1797363488 RTGQEUWWTQJVNC-OPMZPASUSA-N 460.299 0.135 50 20 JCGD Cc1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097109 BRXQPRQMYRPPEF-JHDGKUDLSA-N 480.569 0.939 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)n(-c2cccc(=O)n2C)n1 1799346084 ARMLBAWMDXIOMA-GGNLRSJOSA-N 496.337 0.773 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c(F)c(OC)c1F 1799739118 NAAQJIUVQFVIBM-NXCRSVRDSA-N 484.500 0.558 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cccn1)C2)NC(=O)NCc1ccccc1 1799871616 QQTOOMHOBNTRBP-ACDBMABISA-N 453.547 0.868 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(C)c1C(F)(F)F)C2 1801011149 IOFIDEQUZXFWPI-JJLQDPRZSA-N 460.457 0.015 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801011902 RNQISCWQVMNIQX-USGNIVHTSA-N 491.501 0.096 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1c(F)ccc(Cl)c1F 1801824771 QKBNKLAVEVOIPY-DBWKPXFBSA-N 464.661 0.815 50 20 JCGD CCc1[nH]nc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1805175429 NLIPZTVDRCZFNO-KKSFZXQISA-N 465.294 0.819 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1807029394 RWKKWHDAYWLGDN-IJEWVQPXSA-N 477.296 0.986 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)COc2ccc(O)cc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361065 UYPIBKSKMVIXPQ-DVECYGJZSA-N 475.310 0.866 50 20 JCGD CC(C)(CCl)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1807944215 NZQRGBIWPYNDBE-XJKSGUPXSA-N 458.910 0.792 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCN2CCOC2=O)[C@H]1c1cccnc1 1809531158 COOUGKXJBSMTGF-DYESRHJHSA-N 460.535 0.303 50 20 JCGD COCCOCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810298216 GXFLGVZKEGGHJL-OXJNMPFZSA-N 456.503 0.063 50 20 JCGD Cc1cc(C)n(CCC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1813304858 GKKSABBROUGIGQ-XUZZJYLKSA-N 475.358 0.985 50 20 JCGD CCOc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1 1816133244 MNRAEWOIQLVDBT-SFHVURJKSA-N 464.291 0.898 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCNC4=O)sc2C1 1818916190 OBOMEEQLWIQKBL-LBPRGKRZSA-N 488.574 0.072 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnn2cccnc12 1819019312 XCFUXJIIPOJFLM-GOSISDBHSA-N 459.275 0.752 50 20 JCGD O=C1Nc2c(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3cccc(B(O)O)c3)CC4)cccc2C1=O 1819344900 SBKAUYQTFZGMRR-ZDUSSCGKSA-N 490.306 0.497 50 20 JCGD Cc1ccn(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n1 1819401910 WZMHQCCXHZGUSH-QGZVFWFLSA-N 451.491 0.919 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cc(C)c(O)nc3=O)sc2C1 1827994118 HRYWMVSYSNGHLZ-GHMZBOCLSA-N 455.924 0.580 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)C1 1830358419 VGDMDVNZGRUMQR-LJQANCHMSA-N 474.967 0.173 50 20 JCGD CC(C)[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830737401 HHEPPKOACOLLHV-HOIFWPIMSA-N 492.013 0.982 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1831236458 ILDZPOACKBEDGU-XQBPLPMBSA-N 452.935 0.747 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832080223 IRUCDPMAQRBEDJ-DRSNIGMVSA-N 489.997 0.832 50 20 JCGD COc1ccc([C@@H](O)C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cc1 1833182983 FWSYLDWEAFCTBP-XMMPIXPASA-N 489.617 0.673 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1OCC1CC1)CCO2 1833629242 SNSCCKDOFHCKPU-XMMPIXPASA-N 489.573 0.313 50 20 JCGD Cc1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)cn1 1833808029 BNAPVYUSUFTMNL-JTSKRJEESA-N 497.980 0.987 50 20 JCGD Cc1nc(N)sc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797945 OAKQNDWYLUAOKX-UHFFFAOYSA-N 471.392 0.213 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](N)c1cccc(Cl)c1)CCO2 1835732783 BWOLEDRKXQLMCJ-IRLDBZIGSA-N 481.981 0.169 50 20 JCGD O=C(c1ccc(C(F)(F)F)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931137 GEELXSPRWMQNET-QFIPXVFZSA-N 492.259 0.769 50 20 JCGD O=C(Cc1c(F)cccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934345 WWNUECLWWMGPLY-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CS(=O)(=O)N3CCCC3)CC2)CC1)[C@@H](F)Br 1836412317 DHJLQXNAOZLXLL-QGZVFWFLSA-N 497.431 0.674 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncccc4c3)C2)C1 1837459191 LVKLZPCUBQWBLR-VWLOTQADSA-N 490.520 0.617 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837461160 PRIRAVWAJCSDDK-CJAUYULYSA-N 481.553 0.634 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1837921097 ZIDXWIGYPPULMI-UHFFFAOYSA-N 479.342 0.391 50 20 JCGD Cn1nc2c(c1C(=O)N1CCO[C@]3(COCCN(C(=O)CCBr)C3)C1)CCC2 1839582118 JYZVBFQDGGSVAL-IBGZPJMESA-N 455.353 0.764 50 20 JCGD CN1CCCn2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Br)C4)C3)cc2C1 1839622476 HBXCAQRFDKKITF-VQIMIIECSA-N 488.358 0.479 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)[S@@](=O)c1ccccc1)CCO2 1839673870 DQTGTGDJKQDNGG-FTNJWBBFSA-N 472.991 0.893 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1 1840077725 ICIBLJWVMUGCGM-QFBILLFUSA-N 481.384 0.296 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1840154637 ASIWGVPFENAMBA-VLIAUNLRSA-N 484.962 0.450 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3COc4ccccc4O3)C2)C1 1840182854 WNQGCMUYWYDKDT-UUOWRZLLSA-N 490.557 0.046 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3c[nH]c4ccccc34)C2)C1 1840183854 DUFIVGOZDNQDOQ-RUZDIDTESA-N 485.585 0.930 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014876 LEQWJJUTOOENQF-LJQANCHMSA-N 471.363 0.973 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039473 SCBNTEZSTLPKKN-SFQUDFHCSA-N 456.547 0.576 50 20 JCGD O=C(NNS(=O)(=O)c1ccc2c(c1)OCCO2)c1cccc(S(=O)(=O)N2CCCC2)c1 16128561 MOWNYUWZXFEZHM-UHFFFAOYSA-N 467.525 0.866 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCNS(=O)(=O)c2cc(C)ccc2C)cc1 17406065 VWAOEUIXLWAPRP-UHFFFAOYSA-N 496.611 0.748 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)cc1OC 116817807 VSNPMJNYQDMBDT-UHFFFAOYSA-N 455.471 0.895 50 20 JCGD C[C@@H](C(=O)Nc1cccc(F)c1)N1CCN(C(=O)NNC(=O)CNC(=O)c2ccco2)CC1 725873190 WHRKJOGEVLRZCN-AWEZNQCLSA-N 460.466 0.534 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(N2CCN(c3ncccn3)CC2)c(F)c1 726235430 AQSBKTXQRAQZTO-UHFFFAOYSA-N 496.503 0.796 50 20 JCGD CCn1c(NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)nc2ccccc2c1=O 727100248 LGSLRHJTGXVINZ-UHFFFAOYSA-N 473.291 0.766 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3c[nH]c(C(=O)N4CCCC4)c3)cc2)CC1 728216053 ORRVHTYDFKQCQR-UHFFFAOYSA-N 460.560 0.944 50 20 JCGD CCCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728330617 OJXJFJCGXFQBLT-SFHVURJKSA-N 477.495 0.983 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CC(=O)N(CCN3CCOCC3)C2)c1 728609149 PFWHMCSWLYXQSG-CYBMUJFWSA-N 469.336 0.399 50 20 JCGD O=C(CN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)C1CCN(c2ncccn2)CC1 728847526 ISIZWZLOJHONIV-UHFFFAOYSA-N 487.314 0.899 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@H]2CCN(CC(F)(F)F)C2)cc1 747308537 RHASKTBJUARQJG-ZDUSSCGKSA-N 451.471 0.583 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C[C@@H](C)O1 912919318 LXPVHAGONDISDR-BETUJISGSA-N 482.481 0.510 50 20 JCGD CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 913156103 SDIUBNDMGYVDNO-KRWDZBQOSA-N 482.526 0.577 50 20 JCGD CC(=NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1 915052112 DXVRHXHGVGRXLS-UHFFFAOYSA-N 467.525 0.997 50 20 JCGD CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1 916306500 WLPYJGBVJBXKKT-UHFFFAOYSA-N 496.567 0.844 50 20 JCGD COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1 917717981 QQLPVEYHDCWGRI-UHFFFAOYSA-N 454.457 0.888 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 919883642 FJRBICDBHHTWGK-OAHLLOKOSA-N 460.578 0.167 50 20 JCGD O=C(CCCN1C(=O)c2cccc3cccc(c23)C1=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919883849 DFDBDSHEZYHPFJ-AWEZNQCLSA-N 458.496 0.734 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc3c(Cl)cccn13)CCO2 1779030368 PBVAEGLIUQHWON-QFIPXVFZSA-N 483.916 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COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CO)NC(=O)OC(C)(C)C)[C@H]2C1 1787395383 KTZMHIJKYXZRTP-QMHWVQJVSA-N 463.959 0.106 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3F)[C@H]2C1 1787754349 GHCCNEJGONSKSR-VOSSUDFCSA-N 456.478 0.948 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)ccn3C)[C@H]2C1 1789224347 ZQAXAPADWQDWTB-AYOAJRLASA-N 468.514 0.113 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccc(N(C)C)c3)C[C@@H]21 1791288080 VPQQSGLLUJPMMF-YYWHXJBOSA-N 475.590 0.484 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)cc2C1 1792981057 DONHRKZRMPHRMA-DACLVMHWSA-N 497.980 0.437 50 20 JCGD Cn1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)cccc1=O 1793878188 CCOUPNDNTSQKHK-KRXQYRFLSA-N 482.965 0.721 50 20 JCGD Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)cn1 1793878262 KQTFLNDFCPMFFZ-FZKCQIBNSA-N 455.943 0.755 50 20 JCGD 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O=C(Cc1cccc(C(F)(F)F)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725547 JLWOWOWPQHCYNI-RDTXWAMCSA-N 465.856 0.699 50 20 JCGD COc1ccc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)[nH]c2c1 1830727788 FGZSBKIRWJDNTH-RXVVDRJESA-N 451.907 0.846 50 20 JCGD O=C(Cc1cccc2ncccc12)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831350069 KLKCXGLOLDUKMT-AREMUKBSSA-N 489.337 0.227 50 20 JCGD C[C@@H](CC(N)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831598892 WUDFFPNCOPKDAV-GXZWQRSESA-N 490.985 0.086 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#CC3CC3)C2)C1 1832549806 SMMLUSUOOHHPKS-HTAPYJJXSA-N 469.966 0.988 50 20 JCGD C=CCCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(O)n1 1833695599 CGLBCQHDBNSXJQ-UWJYYQICSA-N 453.923 0.576 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCCc3ccncc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797229 ADLNDHJQXNUHCA-UHFFFAOYSA-N 478.402 0.970 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3sccc3Cl)C2)C1 1835938055 HSBXGJUQTWYQEQ-FQEVSTJZSA-N 464.736 0.465 50 20 JCGD CCSc1cccnc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835938179 OSFFXBPDCOECDA-HSZRJFAPSA-N 485.371 0.257 50 20 JCGD O=C(c1ccc2c(c1)CCCO2)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835941469 LDIANWUWNGLNGA-VWLOTQADSA-N 480.326 0.075 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C)cc(C)n1)CCO2 1836308828 MFAZDWQRIDSJQD-BYEYKRMRSA-N 482.541 0.902 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1 1836790829 HWVVEYCANVUNKL-IERDGZPVSA-N 451.907 0.505 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4sccc4[nH]3)C2)C1 1837460031 ZOABKZSUXDINGZ-JOCHJYFZSA-N 484.538 0.612 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1ccccc1=O)CCO2 1837691406 PCERBHXRBIQAFO-DOXZYTNZSA-N 456.337 0.649 50 20 JCGD O=C(c1cccc(C(F)(F)F)n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837928692 RFIWCOPZRBGDAJ-SUMWQHHRSA-N 451.829 0.770 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)c2n1 1838485849 BEDZWZADQHSTJP-QRWLVFNGSA-N 452.895 0.241 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203295 HQTCEECEKOZSCN-GRDNDAEWSA-N 452.321 0.438 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3sccc3c1O)CCO2 1839567285 MBLJSQBPLXBVLZ-DEOSSOPVSA-N 496.350 0.671 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)Cc1ccccc1)CCO2 1839959661 RBNXICBZOCJMFA-UGKGYDQZSA-N 450.608 0.898 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840030733 VFOKAQBKTFOQST-BLLLJJGKSA-N 453.355 0.132 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccsc3)C2)C1 1840182447 JLJKDPKDOITWNU-LAEWNIMASA-N 450.561 0.591 50 20 JCGD CO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1840209838 AGXIZJUDRXZQSL-SZNDQCEHSA-N 465.459 0.625 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCCC12CN(C(=O)CNCP(=O)(O)O)C2 1845870885 PARUBHDCHOVLJM-MKMNVTDBSA-N 454.370 0.800 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C(F)(F)C(F)(F)C(=O)O 1848011601 LWMVXVCYJSVRDW-UAGKAUTFSA-N 461.372 0.677 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCNC2=NS(=O)(=O)c3ccccc32)cc1OC 9551055 GEGDZJYOWWMWPK-UHFFFAOYSA-N 490.494 0.137 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)NC2CC2)cc1S(=O)(=O)N1CCCc2ccccc21 9889560 INNDFOFPRKQQIC-UHFFFAOYSA-N 472.523 0.876 50 20 JCGD CC1(C)COCCN1CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 728399449 FOQSRQSXTGVPSM-UHFFFAOYSA-N 497.618 0.081 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1cccc(C#N)c1 728872975 SKBGPAQNFCYUKA-QHSLDKKCSA-N 490.563 0.713 50 20 JCGD CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728945802 JZDYKGBDDYYIQX-UHFFFAOYSA-N 455.519 0.691 50 20 JCGD C[C@H](CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)S(=O)(=O)c1ccc(F)cc1 729129556 BJOIFFHGIGQHLK-ACJLOTCBSA-N 480.470 0.909 50 20 JCGD CS(=O)(=O)CCNC(=S)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 729158362 XCMDZOCMLMZDHU-UHFFFAOYSA-N 462.600 0.702 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)ccc1Cl 743845400 NQALSQSVBHNLKD-UHFFFAOYSA-N 489.897 0.386 50 20 JCGD COc1cc(C(=O)NNS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)cc(OC)c1OC 747698845 YLIFCSKRRRNGFB-UHFFFAOYSA-N 450.473 0.526 50 20 JCGD COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(C(=O)C(=O)N3CCOCC3)CC2)c1C 798120743 YPOJSBLPPIGWHJ-HKWRFOASSA-N 457.531 0.188 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 914829832 YTUNIHPIVWYAAT-DGCLKSJQSA-N 474.333 0.011 50 20 JCGD Cc1nn(C)c2[nH]c(=O)c(CCC(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c(C)c12 914846496 MBUNKLWNJSWECQ-UHFFFAOYSA-N 480.934 0.573 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2cnn(C)c2)c2ccccc2c1=O 915058854 YNFJXKMMOUOHTG-UHFFFAOYSA-N 475.531 0.060 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC3(N(C)C)CCCCC3)nc2)CC1 915891329 YPBXLQGYLPLFGE-UHFFFAOYSA-N 453.613 0.908 50 20 JCGD CC(C)CN1CCO[C@@H](CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1 915922786 FOUQKNNNXLGPNI-SFHVURJKSA-N 467.592 0.772 50 20 JCGD CCOC(=O)N1CCC(NC(=O)CCCNC(=O)NNC(=O)Cn2nc(C)cc2C)CC1 916638649 ADRFCQQYFXVIAP-UHFFFAOYSA-N 451.528 0.348 50 20 JCGD CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1 918548551 GEAMXSUFNAIADQ-INIZCTEOSA-N 472.589 0.294 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1)N[C@@H]1CCS(=O)(=O)C1 919887937 IPDHJXDOFRMMNT-HZPDHXFCSA-N 452.533 0.212 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@@H](C)OCC1CC1)N(S(C)(=O)=O)CC2 920805167 JBFYTVRDGWLIPA-CXAGYDPISA-N 469.560 0.915 50 20 JCGD CN1CCN(c2ccccc2CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 1326471329 UCXMSHAZGARSFK-UHFFFAOYSA-N 459.576 0.876 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)ncc1[N+](=O)[O-] 1778250674 YEIHECLKCQVUIT-XMSQKQJNSA-N 476.534 0.799 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nncn3c1)C2 1779372711 YXQGBUMYVBGZEY-WZONZLPQSA-N 478.513 0.169 50 20 JCGD C[C@@]1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)CC1(F)F 1779375558 PQJAOAKNEVTXTB-UIAACRFSSA-N 451.474 0.858 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCSC1)C2 1779376191 ZSOXYQWIAOCPPY-YBOAYWMSSA-N 461.588 0.956 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc(F)n2)C1 1779672715 MJWJYDFNYYUEBN-VGOFRKELSA-N 456.478 0.661 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CS(=O)(=O)N1CCCC1)C2 1781999108 PZMVGBOHOQHZNQ-IIDMSEBBSA-N 480.425 0.709 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@@](C)(O)CC(=O)O)C2)C1 1783928644 LXPZMWFFESCGKS-DLPLYFIVSA-N 491.969 0.564 50 20 JCGD CC(C)COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccn1 1783934703 KNIBCSZGSFBPRP-HSZRJFAPSA-N 461.563 0.933 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)C3CC3)[C@H]2C1)NC(=O)NCc1ccccc1 1784008917 WDDLDJIMPQHLMM-UFYCRDLUSA-N 471.558 0.291 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784091309 ZUZMIEGZXKESEA-QXKUPLGCSA-N 463.959 0.106 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)n1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785285058 UCCYNUCTGFDGAT-SNRMKQJTSA-N 491.275 0.616 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C[C@H]2C[C@H]21 1785590615 SNXPZULWVBYXLW-WKVINZIJSA-N 499.373 0.208 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCOC3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726688 MYWLRRQIKGBANO-TUFLPTIASA-N 473.574 0.349 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21)[C@@H](F)Br 1789922450 GTKVQVGQRFRDHU-XYDQJSOLSA-N 479.328 0.122 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3OCCC4)[C@H]2C1 1790370618 BFYMOOWQXGYXMQ-YKNBRYRPSA-N 483.529 0.393 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C[C@@H]21 1791291090 LEVIJIIOMVXLOM-DWKCODDLSA-N 473.530 0.074 50 20 JCGD COC(=O)CCCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791293368 ZSQILYBDQMGNTR-BZSNNMDCSA-N 454.568 0.463 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792241986 OPFDBEJNZUWDDB-BJDJZHNGSA-N 464.407 0.610 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@@H](c3ccccc3)C1)C2)c1ccc(B(O)O)cc1 1795734208 JNYNBNNLTHDKDN-GMQQQROESA-N 463.299 0.087 50 20 JCGD O=C(/C=C/C(=O)c1cccs1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1796444948 XRPSRPHPDMXJJQ-PCNMXGFKSA-N 454.313 0.070 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(C)nn(C)c1C)C2 1796445694 HVUOGCPXMWNUEX-QCIWSRGXSA-N 469.546 0.303 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)c2C1 1797315645 NQNUGYIHZNZYOM-LMWOUKEDSA-N 486.932 0.766 50 20 JCGD CC(=O)N[C@@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)c1ccc(F)cc1 1798441670 CKNGWEDNLOYRCS-BMQTXXJKSA-N 482.516 0.953 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(=O)n1O)C2 1798522679 LQPFVOPYPFEPAM-VTEUUUEMSA-N 486.437 0.436 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COC(C)(C)C)C2)NC(=O)NCc1ccccc1 1799094844 CGWSEKMSCUYJDE-HATOLVCRSA-N 475.590 0.737 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1799683975 VFUBIXIVELEVLQ-VGDATSSVSA-N 454.293 0.110 50 20 JCGD COCCOCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Br 1800762900 JTLVBRZIEUPUSM-XLMAVXFVSA-N 481.384 0.056 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(C)CCN(C(=O)OC(C)(C)C)C1)C2 1801011221 BBWCNRXUSWMOLB-NPGKMWDHSA-N 495.621 0.596 50 20 JCGD CC(=O)NCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1803718707 XUTTUSILBIJLGT-FPOVZHCZSA-N 466.347 0.243 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)CNC(=O)N(C)C)C2)CC1 1805033842 OVPNKFYJLSUBID-PCLIKHOPSA-N 459.551 0.623 50 20 JCGD NC(=O)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1 1807363823 BUVGXWSWJMOLBO-UNMCSNQZSA-N 472.310 0.494 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807367268 XYTBFDIIRGVBKU-ZBFHGGJFSA-N 453.201 0.981 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377153 YQCMZXRCKBDSDK-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1 1807539743 ZDHAJISXLKVCPJ-IIBYNOLFSA-N 459.576 0.863 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc2c(n1)OCCO2 1808187236 KEOJFTBPEDGCJO-XMSQKQJNSA-N 488.309 0.561 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]1c1cccnc1)C(=O)C(=O)O 1808316847 HWPBNCLFWRRDNZ-ZXYWRSMDSA-N 459.330 0.867 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1 1808417508 ZTHVIIIGCSRURY-POLSPUNTSA-N 477.529 0.903 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)C[C@@H](N)c3cccnc3)sc2C1 1815184588 NAWROQBIGVWRON-LSDHHAIUSA-N 459.576 0.913 50 20 JCGD CC(=O)NCC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815339541 RMLRLQPAPGFUCU-GOSISDBHSA-N 455.324 0.558 50 20 JCGD COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n(C)n1 1816136715 YVQWSPJHAJWTPX-OAHLLOKOSA-N 467.490 0.770 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3[nH]nc4ccncc34)sc2C1 1816861739 KELKSSAQOCPRIU-JTQLQIEISA-N 477.510 0.953 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1820110410 BRNJOECJFGDATR-VXGBXAGGSA-N 473.559 0.672 50 20 JCGD O=C(CCN1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050757 FPOIEVRWSYFOPH-QFIPXVFZSA-N 457.380 0.322 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN(CCO)CCO)CC1 1827679801 VTXPIBUWAWFNBG-MSPRMREJSA-N 490.605 0.027 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1830538919 VNHIXJFQQXWZOZ-KNBMTAEXSA-N 469.380 0.439 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1830543961 JOLJUJOKZARDPA-LIRRHRJNSA-N 471.352 0.602 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)NC(=O)OC(C)(C)C)CC1 1830668408 CTSCWQNKBZKAFD-PXNSSMCTSA-N 483.610 0.822 50 20 JCGD CCc1nn(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1Br 1830723443 NUKMRRCJXKGHBQ-ACJLOTCBSA-N 493.786 0.415 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c([N+](=O)[O-])c1 1830733650 QQCBOMLQCUBLQQ-XLIONFOSSA-N 471.894 0.202 50 20 JCGD Cc1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)[nH]1 1831848608 RLSWHUJGRQHHFJ-YCRPNKLZSA-N 485.969 0.920 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832872522 CSXMTYOEWSOLHC-IIBYNOLFSA-N 454.955 0.999 50 20 JCGD Cc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1833360376 LFZKAAMUIODTTM-UHFFFAOYSA-N 479.585 0.816 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CSCC(=O)OC)CC2)CC1 1833480134 FXBPKZYNAJNXAD-INIZCTEOSA-N 450.001 0.718 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3ncn(C)n3)CC2)CC1 1834089577 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1835072510 WUMGZWQYZZUOSH-CYBMUJFWSA-N 460.304 0.764 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1 1835082607 AZCBNCQJFGGZBR-RDJZCZTQSA-N 491.992 0.861 50 20 JCGD O=C1CC[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)N1 1835128231 VIEUPAHTPYINOU-FGSXEWAUSA-N 494.386 0.728 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccn2ccnc2c1 1835573200 MAZPMXXRKUOTGC-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1C 1835931378 PPNFLJVEOAIDRC-XMMPIXPASA-N 452.316 0.367 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4ccsc4[nH]3)C2)C1 1835932198 SRQGTRNRZGDUEA-JOCHJYFZSA-N 469.328 0.293 50 20 JCGD COc1ccc2oc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc2c1 1836819126 SMWDJGFMAFOGER-VWLOTQADSA-N 494.309 0.505 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3scnc3c1)CCO2 1837063132 JODDLGHBMVSSFS-QHCPKHFHSA-N 481.339 0.360 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)cc2s1 1837459603 LMRKEZMNVJKUJS-HSZRJFAPSA-N 498.565 0.920 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(=O)oc3)CC2)CC1 1837588288 ANGAZZAFLXWZJP-UHFFFAOYSA-N 469.498 0.564 50 20 JCGD O=C(CCN1CCCCC1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837740447 JXWQEHNWPRJQGQ-UHFFFAOYSA-N 471.407 0.855 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C)nc3C(F)(F)F)CCO2)C1 1837963180 QJOFWAJDJMNIJT-GUYCJALGSA-N 468.860 0.763 50 20 JCGD C[C@]1(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)CCCN1 1838394505 DPYQFPVHQAAUSW-HSZRJFAPSA-N 458.563 0.439 50 20 JCGD CN(CC(=O)N1CCC(OC2CCN(C(=O)C#CC(=O)O)CC2)CC1)NC(=O)NCc1ccccc1 1838616266 MRBZHFQYCMZKRD-UHFFFAOYSA-N 499.568 0.419 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)Cn3cc(C)c(O)nc3=O)CC2)CC1 1838786623 PXLJRBIAHXWAMY-KRWDZBQOSA-N 470.954 0.510 50 20 JCGD Cc1ccc(O)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1838893099 RQZFRDFYJKMPLT-QHCPKHFHSA-N 469.498 0.083 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1839151143 JHJNHLZZXLYDJU-RTBURBONSA-N 494.397 0.791 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1839155572 XUVZXMAVRVZUIG-QZTJIDSGSA-N 463.318 0.254 50 20 JCGD Cc1cc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)ccc2[nH]1 1839615973 UUOUXZHGMKPUHK-RUZDIDTESA-N 492.536 0.859 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840039281 MYHCBOHERZXVRC-ZXJYCPGTSA-N 487.981 0.442 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1 1840153070 CAYYWXCWJDZOBL-LAUBAEHRSA-N 451.907 0.254 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(F)CN(C(=O)OC(C)(C)C)C3)C2)C1 1840156702 STANUVSUAIZPRF-MGPUTAFESA-N 493.960 0.656 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 1840187170 KVUBJQSFGLJAIX-JOCHJYFZSA-N 495.508 0.106 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1840715245 VDLSBAZCOBSCPP-GKVSMKOHSA-N 492.536 0.696 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1841749331 MBWFOHRLKUHSAI-QAPCUYQASA-N 475.351 0.112 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CN2CCS(=O)(=O)CC2)C1 1841893528 WQVPQVSEPLKELC-HNNXBMFYSA-N 493.026 0.052 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844265271 MONMLZCZZDPTSI-QGZVFWFLSA-N 484.557 0.759 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1847025835 UEJNSVWTIDSKRX-UHFFFAOYSA-N 457.336 0.440 50 20 JCGD CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1847072685 BPQKYMRKLHBESC-GOSISDBHSA-N 459.352 0.877 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c2)cc1 9931157 KEZJYRKHZRSTCI-HNNXBMFYSA-N 451.526 0.992 50 20 JCGD COc1cc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc(OC)c1OCC(N)=O 15722113 ANQJWQGZZCDEER-UHFFFAOYSA-N 483.481 0.934 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)[C@H](CCC(N)=O)NC(=O)OCc1ccccc1 28698308 SLQNPANCDHCHCW-INIZCTEOSA-N 452.471 0.964 50 20 JCGD CCn1c(O)nc2cc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)ccc2c1=O 728329756 GHALUOWWACGWLG-QGZVFWFLSA-N 468.422 0.266 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728329810 IEKFTPHNFHLTSW-YOEHRIQHSA-N 469.516 0.111 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 729274904 HCYVGYZIHHCGRM-NOZJJQNGSA-N 451.332 0.683 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C(=O)O)sc2C)cc1 729662749 RKHQNEDIKJFKBR-UHFFFAOYSA-N 461.543 0.693 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1C 751206476 HPMDNYMIAXFJCP-UHFFFAOYSA-N 462.528 0.875 50 20 JCGD Cc1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1S(=O)(=O)N1CCOCC1 751211824 VUWMYNSQSZZWOX-UHFFFAOYSA-N 466.541 0.268 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNS(=O)(=O)c2cnn(Cc3ccccc3)c2)ccc1Cl 751263827 POYZHOUGMIIXCM-UHFFFAOYSA-N 469.932 0.856 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2c(C)noc2C)c2ccccc2c1=O 771835824 GIVWTKCZKIAQID-UHFFFAOYSA-N 462.488 0.151 50 20 JCGD COc1cc(C(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)cc(OC)c1OC 786054340 JHVJYYCGXFARSB-AWEZNQCLSA-N 478.889 0.801 50 20 JCGD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)/C(C#N)=C\c1cc(C)n(CCOC)c1C 790088086 ADMJKQFRZHUZDZ-LOHYDARVSA-N 450.561 0.810 50 20 JCGD CN(C)c1cccc(C(=O)NNC(=O)COCC(=O)NNC(=O)c2cccc(N(C)C)c2)c1 823479105 CIQDUASEYGJVCB-UHFFFAOYSA-N 456.503 0.057 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(NS(C)(=O)=O)cc2)cc1OC 842150603 HQRUDAFEPKCEIE-UHFFFAOYSA-N 451.457 0.693 50 20 JCGD O=C(Cc1ccc(F)cc1)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916516100 DJCCEMSOPQLVEW-UHFFFAOYSA-N 464.523 0.246 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC[C@@H]1C[C@@H]1C)N(S(C)(=O)=O)CC2 916640831 TTYHCAJCGPMCIY-NOLJZWGESA-N 454.549 0.939 50 20 JCGD COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 919954984 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C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(O)nn1)C2 1782001238 CJBFLXMXWNNKAR-VEVIJQCQSA-N 457.325 0.858 50 20 JCGD COc1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1F 1782676511 GHMODGYPFKJMEG-RCZVLFRGSA-N 484.333 0.884 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1OC 1783934281 CIXXDRMWSKFUOR-JOCHJYFZSA-N 466.510 0.659 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cnccc1C(F)(F)F 1786001964 ASASBITVLGSKIQ-FNHZYXHNSA-N 477.248 0.687 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccccc3)[C@H]2C1 1786667235 RCGUCROIRHKUSJ-KNTRFNDTSA-N 453.499 0.012 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1786847802 FISFGUOBGZWEPW-RMEBNNNOSA-N 495.390 0.899 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(Cl)nc1Cl 1788828651 CHSXUIJRMOYWLS-JQFCIGGWSA-N 478.141 0.975 50 20 JCGD COc1ccc(COCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1791383611 GRMRHDRVPVVTHF-HSQYWUDLSA-N 497.552 0.504 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)[C@H]2C1 1791543698 LMWKWEDYFOXYNR-FUJDEKNSSA-N 484.395 0.610 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1793865008 OFRKYJXQTSSXET-FCGDIQPGSA-N 457.336 0.628 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)cn1)NC(=O)NCc1ccccc1 1794990373 QVVOHPQOIJQDKT-OPMZPASUSA-N 482.541 0.337 50 20 JCGD Cc1ccc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)ccc2n1 1795739006 MADVALQGRJAYFN-JHDGKUDLSA-N 459.311 0.740 50 20 JCGD Cc1nc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)ccc2s1 1795739223 RYKDXUBLTFXIAG-UPHUGPLXSA-N 465.340 0.802 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)ccn1 1796441416 HMUQUUHJTSUJBT-WVNFENISSA-N 454.487 0.427 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@@H]2Sc3ccccc3[C@H]21 1797762663 AIHROSWFHBXNBW-ONRLFPQESA-N 479.562 0.776 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1[C@H]2Sc3ccccc3[C@H]21 1797762975 HYHCACHCKXDHOF-IEOOEQHGSA-N 464.352 0.458 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(=O)oc1)C2)NC(=O)NCc1ccccc1 1799094780 KMXNAYRKMNWOGU-HATOLVCRSA-N 483.525 0.189 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2 1799276949 MYFPEIXWQFNNLO-ZFHGCVPZSA-N 464.371 0.925 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)C(=O)C(=O)O 1800263347 TWUPQMSTVHBDET-DFGXFYAUSA-N 496.358 0.125 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)(C1)C2 1800699494 OETZBDZNGDRUIG-BJEBVQOXSA-N 457.955 0.623 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1CCCN1C(=O)OC(C)(C)C)C2 1801010634 NSTUCHJYDVROHI-WYADAEROSA-N 495.621 0.739 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(N(C)C)cc1 1801194628 GVYPJANFFDWFPN-NHKMSHSESA-N 459.591 0.648 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1 1804152810 JIGRJIYDZFPKNG-CYFREDJKSA-N 472.590 0.863 50 20 JCGD Cc1cnc2c(C(=O)N3CC[C@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)cnn2c1 1807362390 LPIVTEZCZSOLEJ-DENIHFKCSA-N 484.325 0.746 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374039 WPQSHNPWVSBUIO-JXKFMYIUSA-N 490.369 0.482 50 20 JCGD CC(C)CNC(=O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303703 VAWKCIRQABKLLL-LPHOPBHVSA-N 467.530 0.172 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1 1810305589 MBNZPVRPSWONPW-VGOFRKELSA-N 479.541 0.412 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813020444 CKUPTAWXWXXOMP-SNJCGAMXSA-N 491.353 0.836 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCc2nc(NC(=O)CNC(=N)N)sc2C1 1814826544 NHPCJUYZRWYZEO-JTQLQIEISA-N 475.487 0.685 50 20 JCGD COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1C 1815343666 ILOPHVWHLSXEMF-CYBMUJFWSA-N 455.305 0.105 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccnc(Cl)n1)CC2)c1cccc(B(O)O)c1 1815360542 ITJKESBPNRQGEJ-GFCCVEGCSA-N 457.708 0.806 50 20 JCGD O=C(CNC(=O)c1ccco1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1815649402 LFCYBFDLYHXLKK-AWEZNQCLSA-N 468.300 0.072 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4ccncc34)sc2C1 1818504675 HNSRFZFOBBXOOR-LLVKDONJSA-N 477.510 0.724 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3c(c1)n(C)c(=O)n3C)CC2 1826086004 JZFHSXQFGRJAOY-CQSZACIVSA-N 499.597 0.932 50 20 JCGD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)N1CCN(C)CC1 1827052610 RLAZGMRHDKWOQD-WMZHIEFXSA-N 470.423 0.236 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1828873497 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O=C(NC1CCN(C2CCN(C(=O)/C=C/c3cccnc3)CC2)CC1)c1cccc(B(O)O)c1 1834799853 IEVDTFDUOYVTPA-VOTSOKGWSA-N 462.359 0.660 50 20 JCGD N[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccc(Cl)c1 1834800911 ANNYZSGRKRTBLZ-HSZRJFAPSA-N 498.820 0.905 50 20 JCGD CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1834884510 ZJLUEYQQWAPJLF-QHCPKHFHSA-N 461.563 0.589 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)F)CCO2)NC(=O)NCc1ccccc1 1834917199 AGMKFDUVIJZTGP-OAQYLSRUSA-N 469.489 0.054 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4c(c3)OCO4)CCO2)C1 1835171819 COQVPHZCQOFZGO-HRAATJIYSA-N 454.907 0.668 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1)CCO2 1835297205 CXDNCLUTRLYAGJ-GSLOIJSKSA-N 483.525 0.310 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccc2c1OCCO2 1835353619 AFKFEFDFLOQLLD-UHFFFAOYSA-N 493.369 0.637 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Nc1cccnc1)CCO2 1835686502 DGZLCIJBOOLIHB-HYSQFFRZSA-N 497.556 0.472 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCOC3)CC2)CC1 1835737352 LAGNOVUGDWLSSM-INIZCTEOSA-N 458.563 0.297 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cc(F)cc(F)c1)CCO2 1836122429 BUGVJPWKKXZBFS-JOCHJYFZSA-N 468.501 0.337 50 20 JCGD COc1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1F 1837285608 KIBYFXJMKSVGGZ-UHFFFAOYSA-N 485.321 0.835 50 20 JCGD COc1nn(C)cc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837376993 HBWDFABHINVTBO-UHFFFAOYSA-N 470.335 0.035 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(C)o1 1837457057 UNYQQVAAJWTPNL-JOCHJYFZSA-N 457.487 0.279 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(F)c1 1837460204 XMMHEKBZJCUPLD-HSZRJFAPSA-N 487.488 0.217 50 20 JCGD O=C(Cc1ccc2c(c1)OCO2)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837748300 OVSFSQKJPIEYHF-UHFFFAOYSA-N 494.353 0.950 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)cc(Cl)n1)CCO2 1838240172 PXFVLCUHXPFBKL-NRFANRHFSA-N 494.140 0.452 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)c(O)c1 1838887973 GZQWVZHJBIQWQD-NHVVDLMHSA-N 499.524 0.605 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839108448 JKPIYWMYALXATF-YLJYHZDGSA-N 487.439 0.396 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839153860 TYVJEFCJIPUZJD-SNRMKQJTSA-N 483.345 0.174 50 20 JCGD O=C(c1cccn2c(O)nnc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199281 LRZSOOBPMFWUNL-SJCJKPOMSA-N 472.271 0.195 50 20 JCGD CN(C)[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccccc1Cl 1839731752 POEXMAMTWGXBAI-WFXMLNOXSA-N 474.385 0.999 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H](C)NC(=O)OC(C)(C)C)C2)C1 1840152808 UKZAGWCMEPLOHG-ZOCZFRKYSA-N 477.986 1.000 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS[C@H]3CCCCO3)C2)C1 1840153697 YEAPSHCPVDMBPZ-IEZWGBDMSA-N 450.985 0.956 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ncsc34)C2)C1 1840184229 DVUQKLJIENXUCC-JOCHJYFZSA-N 475.571 0.739 50 20 JCGD COc1cc(C#N)cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185297 JSTYQJSLDXURFR-QHCPKHFHSA-N 473.530 0.010 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1840187062 UEFFNXXUEJBLMR-VBKZILBWSA-N 496.388 0.882 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840650248 FFJIMEKPBBIFBB-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1 1842744961 SFRUSGVRMNVJSD-UHFFFAOYSA-N 450.561 0.427 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2)CC1 15794934 LMDRXRXJYVMVSN-HXUWFJFHSA-N 488.522 0.140 50 20 JCGD CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)ccc21 728212752 CEGIMODASRWHKH-UHFFFAOYSA-N 486.554 0.403 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNC(=O)c3cc(F)cc(F)c3)cc2)CC1 728214618 CGENEVOYXKUZFH-UHFFFAOYSA-N 467.498 0.774 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCn1ccnc1C)N(S(C)(=O)=O)CC2 749215743 REVAVUSMUDPBPL-QGZVFWFLSA-N 494.574 0.488 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CSCC(=O)N1CCOCC1 912884180 KFWUWWXVJDVJNW-LBPRGKRZSA-N 460.350 0.956 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCc2ccc(S(N)(=O)=O)cc2)nc1 915884018 OLOHJLPASRKPQF-UHFFFAOYSA-N 470.577 0.628 50 20 JCGD CCS(=O)(=O)NCCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 916516288 JOPMNGPIMAGDPJ-UHFFFAOYSA-N 472.527 0.328 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=S)NC1CCN(C)CC1)N(S(C)(=O)=O)CC2 920307826 PLAPBALMMZEZOX-KRWDZBQOSA-N 499.659 0.542 50 20 JCGD CC(C)CCn1nc(C(=O)NN=Cc2nc3c(c(O)nc(=O)n3C)n2C)c2ccccc2c1=O 920369800 ZSBUSYKNVYZHET-UHFFFAOYSA-N 464.486 0.893 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1778074034 QYUWFYRJCSIFJK-WHSLLNHNSA-N 466.608 0.830 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n(-c2ccccc2)n1 1779030434 QMETWJHDJNLVKP-VWLOTQADSA-N 489.536 0.937 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)OCCO3)C2 1779373116 BZLTWXDZAZXWPZ-PXDATVDWSA-N 495.536 0.898 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N3CC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c21 1779975468 BZESHCFUQODXQN-HSZRJFAPSA-N 479.497 0.035 50 20 JCGD CC(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)on1 1780198939 UTPIOBBCAKSRLC-NFBKMPQASA-N 455.320 0.919 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3c(F)cccc3F)C2)C1 1780798464 HJYUBJYWZJTLOJ-JOCHJYFZSA-N 459.453 0.650 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1782093848 KDEWGOQKLOXUJV-DEOSSOPVSA-N 452.316 0.749 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1783032652 UQBCVWJCVPQDGG-AVRDEDQJSA-N 465.934 0.685 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1783531912 FUYJEBZAOFCSPA-YVEFUNNKSA-N 460.350 0.712 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1783538553 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JCGD CC[C@H](NC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787507344 PYYPKCXYUQSDEH-GTFGDZFJSA-N 460.535 0.015 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)ccc2c1OCCO2 1788610358 NIRQETUWOLZDRU-ZRCAFCQKSA-N 495.536 0.672 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(O)[nH]3)[C@H]2C1)NC(=O)NCc1ccccc1 1788956550 UVWXUEYHGOTLOY-LNLFQRSKSA-N 485.545 0.055 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1789934317 SRBYVLGBQUIAJM-HCZIRCDUSA-N 496.374 0.932 50 20 JCGD O=C(COc1cccc(Cl)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1792745911 IVASGPVEGSPYDN-VPTLXERWSA-N 458.707 0.302 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C[C@H]1CCOC1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792978304 POLSCGMWXGGHMZ-LVZMMCSGSA-N 489.997 0.496 50 20 JCGD Cc1cc[nH]c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1794390113 BUTGMRFSAXCBQE-HATOLVCRSA-N 468.558 0.873 50 20 JCGD O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796190184 YSDSJZIAKNRBDU-ACDBMABISA-N 489.337 0.695 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796370299 GKCVFTHZFALNAD-ZUWCUPBKSA-N 465.906 0.567 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)n(-c2ccccc2)n1 1796472237 ABODDNBIZMQYDX-BBIADKPPSA-N 474.326 0.378 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cccnc2n1 1797358086 FPIZJIMPWJPVKU-PTFAKJKNSA-N 475.509 0.967 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(Cl)ccc1F)C2 1797749756 ODGNVKAQFHFZOD-CULMDFNYSA-N 462.869 0.390 50 20 JCGD Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc2c[nH]c3nccc-3c21 1798482628 WKJBCSLTQIFXPY-UPHUGPLXSA-N 487.325 0.203 50 20 JCGD Cc1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)cn1 1799095040 ROLIMCKTHKZHPI-VTYHHJSWSA-N 481.557 0.334 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1799683972 VFUBIXIVELEVLQ-TUTUZKQUSA-N 454.293 0.110 50 20 JCGD CC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1800069531 FJSGMWRJZWTKKD-XJFOESAGSA-N 450.927 0.089 50 20 JCGD CN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1801468368 VQJXRKYVCNDWMD-ZHCJQAHYSA-N 489.013 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CN(C(=O)OC(C)(C)C)C1)C2 1802336771 XTVDVKKVXPTUGX-BJWYYQGGSA-N 451.568 0.865 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CC[C@H](N)C(N)=O)[C@H]1c1cccnc1 1807192751 YGOQQOQLYNMBLR-JJAZEVLHSA-N 454.369 0.711 50 20 JCGD CCc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1C 1807360240 IKDUXWWFFBHDMK-XMSQKQJNSA-N 461.331 0.691 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc2n(n1)CCCO2 1809858386 WHOVXIVQQBPPCV-PGRDOPGGSA-N 475.314 0.374 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810295338 SGQWAXKOXKGONR-PWIZWCRZSA-N 467.530 0.314 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)/C=N/O[C@H]2CCCCO2)[C@H]1c1cccnc1 1810359838 BXDGUECDZDDWJG-STEQSTDUSA-N 495.540 0.929 50 20 JCGD CCOC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1812464661 GEMXZYLSVXIGNV-AZUAARDMSA-N 465.315 0.424 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CNC(=O)OC(C)(C)C)[C@@H]1c1cccnc1 1813074348 PSYXZFUUXIJTML-DYESRHJHSA-N 476.578 0.985 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnnc(Cl)c1)CC2)c1ccc(B(O)O)cc1 1815337111 MYKHQHZNIOAHDO-CYBMUJFWSA-N 457.708 0.806 50 20 JCGD O=C(Cn1cc(Cl)cn1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1815409211 VKFXBLHNXKPKAT-CQSZACIVSA-N 459.724 0.599 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2 1817271284 XLGMEBFEASEZOZ-ZYHUDNBSSA-N 450.970 0.080 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)N1C[C@H]2C[C@H]2C1 1817472566 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Cc1nc2ccc(F)cn2c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830734917 AFEBAAYOGWNIHR-YWZLYKJASA-N 454.886 0.452 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)C(=O)c1ccccc1 1831147532 JXEICJDDTSGVDH-XLIONFOSSA-N 486.338 0.906 50 20 JCGD CSCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831534128 NNZTZHVUXSSNDG-OLCUMFGGSA-N 479.603 0.966 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1831610039 UHAMIZAMSXCIJP-NRJQMVOHSA-N 496.402 0.961 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1831639793 DVNJRRNAMFXOPZ-DDVAMESESA-N 482.965 0.857 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3C[C@@H]3F)CCO2)C1 1832116396 UIMDCKIBCLXLBV-XGKMFUNXSA-N 463.934 0.933 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1832208202 IKLVHTQWAADELW-SJLPKXTDSA-N 470.299 0.578 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1832545264 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CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2ccc3ccccc3n2)c1 21007922 JHEXDWRHAGHYIW-UHFFFAOYSA-N 457.512 0.888 50 20 JCGD C[C@H]1Cc2cc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)ccc2N1S(C)(=O)=O 21967472 ALNVUOSFEOFGKU-LBPRGKRZSA-N 465.557 0.765 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cn2nc(-c3ccccc3)oc2=O)cc1 726069338 TXIVMLWWDFVSEC-UHFFFAOYSA-N 459.484 0.280 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(OC)c(OC)c2)c(C(=O)OC)s1 726519865 PWXIMEFUMBXAMN-UHFFFAOYSA-N 458.470 0.962 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1 729221006 GWGANGUYTJMLQN-UHFFFAOYSA-N 451.535 0.979 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1Br 745992552 DBQSDMXXIHUSFN-LBPRGKRZSA-N 491.364 0.593 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cccc(CS(N)(=O)=O)c1 748970368 PSJJNDXTQFKNEQ-UHFFFAOYSA-N 455.876 0.755 50 20 JCGD Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cn1 750864746 CSPQUHZQSNZDHQ-UHFFFAOYSA-N 497.584 0.650 50 20 JCGD 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CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4ncccc34)C[C@@H]21 1791293958 RIEKKNSQKIADOF-SNRMKQJTSA-N 454.531 0.596 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(Br)ccn3n1)C2)[C@H](O)CCl 1792981146 FUEWCEBCZZDBIF-OXUXUCFPSA-N 471.739 0.900 50 20 JCGD COCCn1nccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793880405 ZCMXSGFFNBBKIS-DFGXFYAUSA-N 499.996 0.865 50 20 JCGD CC[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C 1795736307 XRQMMRFWIYQWIJ-SHJAMOMRSA-N 489.378 0.263 50 20 JCGD Cn1ncc(Br)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796191102 ZKRSTDBKRDHNJE-QDMKHBRRSA-N 461.125 0.428 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1[C@H]2c3ccccc3S[C@H]21 1797769997 HPAKUMKUDBKWJS-CFJVWTNZSA-N 458.584 0.837 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(Br)cn1 1798031527 VTRZWHUIKGBXPZ-ZSBFGKGUSA-N 474.120 0.041 50 20 JCGD CC(C)(C)OC(=O)N1CCn2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)cnc2C1 1798410608 FMGLZLISEMBMMX-CXHZTBPHSA-N 497.980 0.437 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccc(C(F)(F)F)cc2n1 1799874287 AYADLJQFITVRIC-VTEUUUEMSA-N 496.490 0.929 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@](C)(O)CN1C(=O)OC(C)(C)C 1800824569 QASFFZQZWREDLH-GAMODTGLSA-N 489.997 0.590 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(n1C)-c1ncccc1OC3)C2 1801012964 HWJWBDQQCGDDQR-FAQVEIGNSA-N 496.568 0.556 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc3c(c1)OCO3)C2 1801013443 YCPWFBKPZJHHDG-GPVSGQMNSA-N 460.531 0.311 50 20 JCGD COCCOCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801017271 GYNKPAIEERMMRA-SCAQPMJSSA-N 471.378 0.466 50 20 JCGD N=C(N)SCCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1807127820 QJCOHMPJBGZWEK-KSSFIOAISA-N 470.559 0.416 50 20 JCGD Cc1nc(N)sc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807364185 PICKBGUPQRRROP-FUHWJXTLSA-N 465.344 0.742 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CC[C@H]2CCOC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373372 CSDZRQMQSHXJBW-NYDSKATKSA-N 451.332 0.898 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1 1808414364 IBAHBTRGHZTCSU-OKQVUBCTSA-N 465.514 0.500 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810121479 LAOVDHPQIWIKGC-AKZDSRSJSA-N 457.361 0.240 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)o1 1810303322 QNJSAKWHKYFUHG-MGPUTAFESA-N 464.486 0.334 50 20 JCGD CC(=O)O[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2)C(C)C 1819486129 TXYYKMJQOKXNSD-SJKOYZFVSA-N 474.543 0.955 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055631 ANVLFWWWLNOIGR-HXUWFJFHSA-N 469.307 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1 1827536787 ZNXPLEUDWWPZCV-IBGZPJMESA-N 492.540 0.981 50 20 JCGD CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1828894968 LECNSJLBHLJIHE-QHCPKHFHSA-N 459.547 0.831 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1 1828966496 ADYRHEDWJDKTOI-CECAUBDESA-N 497.955 0.566 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(F)(F)C(=O)O)C2)C1 1830538413 FFIWRIAOZWZBFY-NHYWBVRUSA-N 457.268 0.584 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](C)CBr)CCO3)C2)n1 1830539191 FDMUHCFBPLFQBW-YCRPNKLZSA-N 499.406 0.774 50 20 JCGD COc1ccc(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1OC 1830732790 ARGNTYGKBMBACP-VLIAUNLRSA-N 460.886 0.513 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnsn3)CCO2)C1 1833522995 LBENQGFJSJVJME-DJJJIMSYSA-N 489.982 0.740 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3coc(Cl)n3)CC2)CC1 1833987265 JHWXRNGBRPCHNP-UHFFFAOYSA-N 475.937 0.826 50 20 JCGD Cn1cccc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834099238 RBOGZUOPFQGVCY-UHFFFAOYSA-N 453.547 0.523 50 20 JCGD CC(C)(C)c1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1834798571 LYIKQESDDSUIBZ-UHFFFAOYSA-N 493.417 0.953 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc4ccnn4c3)CC2)CC1 1835738364 ZHSNULFEWRQPOL-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD CCOc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nn1 1836199186 ZWYZJVQWEKPCEC-UHFFFAOYSA-N 481.362 0.054 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCCO3)CCO2 1836971560 XBPGTBZFOLODQL-HXUWFJFHSA-N 452.584 0.587 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)C3CCC(CO)CC3)CC2)CC1 1837084692 CBDVRDBTSNUIHP-UHFFFAOYSA-N 472.391 0.777 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837171319 JIYNBPHYAFSPPK-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD O=C(c1nc(O)n2c1CCCC2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837759076 OOIFMDUMVYRYQF-KBXCAEBGSA-N 475.315 0.686 50 20 JCGD N[C@H](CC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccnc1 1837896053 AIGFHVSLOLBXTJ-HSZRJFAPSA-N 480.374 0.464 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccn3C)C2)C1 1838528036 BCSRHTCHSCHUJV-JOCHJYFZSA-N 487.469 0.637 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1Cl)CCO2 1838865902 UTIWXKXVAZYRND-JOCHJYFZSA-N 458.707 0.404 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1839153236 WUGAQYGZUWPEEI-ROUUACIJSA-N 452.335 0.521 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201392 WGWVLGNEABXAOV-WMLDXEAASA-N 463.304 0.290 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)nc2nccn12 1839549246 VRVCMUIITJYABG-NRFANRHFSA-N 461.595 0.959 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(C)=O)[nH]n3)C2)C1 1839963271 GHGMTPUDVFVWSS-SCLBCKFNSA-N 457.325 0.856 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1839965066 MCWCUKPJUSLRKD-DNVCBOLYSA-N 469.336 0.650 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1839967408 LPWXNFSCFZNBKJ-SJCJKPOMSA-N 494.433 0.477 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccc(C)cc3)CCO2)C1 1840098008 BAOCXSHLKMTWQX-QTPRHWQCSA-N 495.536 0.768 50 20 JCGD C=CCCc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(O)n1 1840183518 JCFZKMDOWLJDMX-DEOSSOPVSA-N 489.573 0.349 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(OCC3CC3)cc1)CCO2 1840749531 FJTIXIKXMUJQRO-VWLOTQADSA-N 488.585 0.918 50 20 JCGD C#CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1840840652 ZCVCHKIAIROLKZ-KKSFZXQISA-N 457.955 0.988 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1 1841028849 GZHLNFVBCHOVEL-AUSJPIAWSA-N 459.971 0.798 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2ccc(Br)cn2)C1 1842090763 MNGPEHGTEJNYKZ-UHFFFAOYSA-N 458.121 0.584 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCCC12CN(C(=O)[C@H](Cl)COC)C2 1845246170 NWEBCFLBBSHYPE-QGZVFWFLSA-N 450.960 0.530 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)C1 1846383950 MDKLJNHTBPPOMW-UHFFFAOYSA-N 471.558 0.344 50 20 JCGD O=C(COC(=O)CCc1nc2ccccc2c(=O)[nH]1)NNC(=O)[C@@H]1COc2ccccc2O1 8953401 ITPJESBIMRLZJL-KRWDZBQOSA-N 452.423 0.386 50 20 JCGD Cc1cccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)c1 16005464 AGSRQRVDIHIDRL-UHFFFAOYSA-N 476.555 0.922 50 20 JCGD CC(C)CCn1nc(C(=O)NNS(=O)(=O)c2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 18995626 QOUDLGJZIUKDRD-UHFFFAOYSA-N 493.567 0.713 50 20 JCGD COc1ccc(CC(=O)NNC(=S)NCC2CCC2)cc1S(=O)(=O)N1CCOCC1 727867276 ZNOUSAFKCBCJGP-UHFFFAOYSA-N 456.590 0.554 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1 728203657 ZRKXDPXBYLTSOS-HNNXBMFYSA-N 463.516 0.660 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)C1 728203786 OAWFYVGKFPSLCA-CQSZACIVSA-N 450.477 0.797 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(S(=O)(=O)N(C)C)cc3)cc2)CC1 728213555 NXLOSPICQLTNIC-UHFFFAOYSA-N 481.600 0.630 50 20 JCGD O=C(COC(=O)c1cccnc1S(=O)(=O)C(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1 728340970 UJBZIYHNENCLPT-CYBMUJFWSA-N 489.384 0.519 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 729273929 BFMNETLFRQIHKE-ZYHUDNBSSA-N 450.439 0.139 50 20 JCGD CCOc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1 729275716 QQIKEXBNSGLLMO-NSHDSACASA-N 456.550 0.108 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(C#N)cc2)o1 747171912 SVDZYGSUUDONFD-OAHLLOKOSA-N 460.468 0.942 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CCc1ccco1 748267689 YSNJXAZZLBPQID-INIZCTEOSA-N 457.530 0.141 50 20 JCGD COc1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1S(=O)(=O)NC1CC1 762295020 WBKRXQPERLDHLN-UHFFFAOYSA-N 482.540 0.448 50 20 JCGD COc1cc(Cl)ccc1C(=O)NNC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 789910387 GXDHEAXWJZZSCR-UHFFFAOYSA-N 468.919 0.790 50 20 JCGD CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CCN1C[C@H](C)O[C@@H](C)C1 819931663 QXNLCRBARAJFJU-BQFCYCMXSA-N 479.603 0.931 50 20 JCGD O=C(COC(=O)[C@H]1CCCN(C(=O)Cc2ccccc2)C1)NNC(=O)[C@@H]1COc2ccccc2O1 914803789 IJAGQJALJXFHOW-RXVVDRJESA-N 481.505 0.998 50 20 JCGD O=C(NCc1ccnc(N2CCCC2)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916254324 AIGGWXILOUNQKN-UHFFFAOYSA-N 488.570 0.847 50 20 JCGD C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 919885805 RMCURLXQVIMJDH-ZFWWWQNUSA-N 458.562 0.381 50 20 JCGD Cc1c(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nnn1-c1ccccc1 919963140 FZHHLAJOTHKVOR-UHFFFAOYSA-N 484.538 0.600 50 20 JCGD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2)cc1 920254836 QJDRCLQESDHITQ-ZJVMWOEPSA-N 466.494 0.887 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCO3)C2)C1 1778282826 YNTRBVIDIXXRBV-MZKRTTBSSA-N 465.978 0.971 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnncc3C(=O)O)C2)C1 1779525159 HVDIKZQCSNLSMB-QFIPXVFZSA-N 499.436 0.766 50 20 JCGD O=C(O)c1cnncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1779698854 YYGUDQMZPCCVPG-IIYDPXPESA-N 459.272 0.993 50 20 JCGD Cc1nccnc1C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779779869 NZQRVYLTLDDKES-DEOSSOPVSA-N 481.557 0.575 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)c(O)c1OC 1781825523 KQFHVZQIISUDJF-AQPAOHHBSA-N 499.524 0.987 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C2 1782175351 IJTIEFLAKFLEQB-TVKQPGBESA-N 462.927 0.249 50 20 JCGD C[C@]1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)CC1(F)F 1783142487 CTKSERSCEDBFHP-CDHQVMDDSA-N 451.474 0.858 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1 1783880797 GWRBKHIVRSHNIU-BEFAXECRSA-N 462.927 0.927 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1783934697 GIYSYHIEHKVVRK-NRFANRHFSA-N 466.560 0.280 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@H]3CCC(=O)NC3)cc2)CCC1 1785897268 LEPFPEFIBRWUON-AWEZNQCLSA-N 450.499 0.959 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS(C)(=O)=O)[C@H]2C1 1786644825 SFUHBHRMZGRCMG-AJNGGQMLSA-N 481.999 0.143 50 20 JCGD CSc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981016 LXPXJAFBOXPGGT-SNRMKQJTSA-N 455.345 0.390 50 20 JCGD Cc1cccnc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982788 HUCMVJBUNAIBTH-VCOUNFBDSA-N 451.332 0.296 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn[nH]c3)[C@H]2C1)NC(=O)NCc1ccccc1 1787614365 FUYDNVUNIUNFHK-IHPCNDPISA-N 469.546 0.349 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(O)nc2ccccc12 1787902351 QKZPJYBOHWSQJT-BUKVSMQUSA-N 475.310 0.527 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cn2ccc(Cl)cc2n1 1788080204 RNOBVHGQHMZLDR-QSFXBCCZSA-N 482.733 0.575 50 20 JCGD Cc1cc(C(=O)NCC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)no1 1789568455 IUKHHCSYGPKFIL-UHFFFAOYSA-N 476.298 0.841 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789843649 IFFHJKDQOJTWCX-XZOYJPPVSA-N 491.328 0.890 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)[C@H]2C1 1790176731 DNEFLLCHJHMVCE-SMSYFYOWSA-N 478.384 0.983 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccc4o3)[C@H]2C1 1790349010 XUFKLZCTFBWYEJ-AXHNFQJDSA-N 464.482 0.733 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21 1791107757 KKZCNTYWMXFVCF-PLZKBRGSSA-N 463.934 0.871 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCCO4)C[C@@H]21 1791293045 GUEOEUDLZYRZQB-ZJOUEHCJSA-N 458.559 0.978 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1F 1791742690 QRWJZWVYZZNTHG-JLMWRMLUSA-N 470.306 0.350 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3[C@H]4COC[C@H]43)[C@H]2C1 1791837122 CLVGATQCXZHQIN-PSKKIHNDSA-N 471.982 0.991 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3c(O)nnc3O)cc1)C2 1792872393 DADPBLYSROWMGK-OEYIWLLWSA-N 494.346 0.913 50 20 JCGD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792975397 QBCXMLYNUHQNKV-CVWVJMLGSA-N 475.970 0.200 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CS(C)(=O)=O 1793370326 JTWUWVSPGRSWHV-NFWAQSGPSA-N 497.526 0.404 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1794251896 ZORWDBRNYHEGCN-CRWXNKLISA-N 495.378 0.245 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)C2)c1ccc(B(O)O)cc1 1795732874 OIOIASNNUREKMK-UVNIEQTBSA-N 470.281 0.652 50 20 JCGD COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1C 1795737762 QOQXLKFNNYKGET-BBIADKPPSA-N 452.316 0.129 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1796316401 GHYJDUYNOLRUIU-QKGCVVFFSA-N 475.974 0.155 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=N/O[C@H]1CCCCO1)C2 1796441970 KUWVKCAZBGEVCD-AMLCSUFCSA-N 474.518 0.239 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2c(F)cc(F)cc2[nH]1 1796935154 NFKZWCOXBYCODS-GFENJXEQSA-N 469.253 0.643 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1797730018 SOUUYOOWJUQBOY-UPHUGPLXSA-N 471.634 0.939 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3C1)C2 1797754035 PXSQGGUTFCJJTI-NXWNEQKCSA-N 463.538 0.693 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799347540 PQHMRVPEQAZLMD-ZUWCUPBKSA-N 482.347 0.806 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(CO)on1)NC(=O)NCc1ccccc1 1799465406 MAUKVQRSAHXRPQ-BCDXTJNWSA-N 470.530 0.765 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799758892 ARULSEZCZVKNBT-YVWYUNDQSA-N 471.250 0.239 50 20 JCGD CCn1c(-n2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](Cl)COC)cc2C)cccc1=O 1800974919 HMSQMKZHNHKGPJ-KYFSNAEOSA-N 491.976 0.819 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cc1cccc(F)c1)NC(C)=O 1802042527 ZLOMYJKQTIVQFZ-QQXMDYFESA-N 469.941 0.716 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1802148807 OISPBFRHRRJRCF-WTNWGCMGSA-N 495.346 0.035 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CSc1nc[nH]n1)NC(=O)NCc1ccccc1 1802865378 SKIUGSZSKDFXCF-BCDXTJNWSA-N 486.602 0.881 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n(C)n1 1805641687 SWABCYKWCLORBX-OXJNMPFZSA-N 462.514 0.755 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)c2ccccc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362720 HWFGPKCYVHSWCC-ACIOBRDBSA-N 459.311 0.815 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373952 VKRZUBGSATUWMG-PGRDOPGGSA-N 472.310 0.494 50 20 JCGD COc1nccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1807710478 CJNBEEMXRIIJSJ-UWJYYQICSA-N 478.289 0.938 50 20 JCGD Cc1cc2nnc(C(=O)NC[C@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@H]3c3cccnc3)c(C)n2n1 1809193038 ZZYIZDLEBWDDDD-JPYJTQIMSA-N 493.572 0.829 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)nn1 1809978102 YEQNKVWJEPTKHC-UHFFFAOYSA-N 453.352 0.872 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCc2cn[nH]c2)[C@@H]1c1cccnc1 1810293169 APHKLJNZXRKVFW-DYESRHJHSA-N 462.514 0.756 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1 1812119854 KDINGIDNMRPMBU-UTKZUKDTSA-N 469.546 0.753 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)Cn2cc(C)c(O)nc2=O)[C@@H]1c1cccnc1 1813038375 YNGVKUFQVOQGRF-XYJFISCASA-N 463.922 0.612 50 20 JCGD Cc1cc(C)n(CCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)n1 1826577137 JARAMQKGUUMHAB-KRWDZBQOSA-N 467.360 0.952 50 20 JCGD O=C(COc1cccnn1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827055200 RVOHOCWITPZVQM-HXUWFJFHSA-N 452.320 0.469 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1828128810 XABLXUPQMBKMPF-NVXWUHKLSA-N 458.349 0.354 50 20 JCGD COCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828549032 UKDKQSGLDGYQME-DYESRHJHSA-N 453.923 0.685 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1Cl)CCO2 1829498485 VBYMMWSPFIQKTK-NRFANRHFSA-N 474.905 0.117 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(S(C)(=O)=O)c3)CCO2)C1 1830182707 PRPNZHZPKRWQAX-KUHUBIRLSA-N 489.388 0.944 50 20 JCGD CCOc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cn1 1830534495 AKYKNDBFOHYVPY-LIRRHRJNSA-N 471.352 0.976 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731514 KKCNYXDTIGRFSE-YWZLYKJASA-N 465.894 0.110 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)c1ccc(F)cc1 1830733484 NFSJKGTXIYEDKH-WAOWUJCRSA-N 471.913 0.059 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830737996 JNTZZQUTEYJLQA-VQIMIIECSA-N 495.381 0.413 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1833765369 VQGDZIAEBMLIKR-CABCVRRESA-N 472.384 0.330 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3CCC(CO)CC3)CC2)CC1)c1ccc(B(O)O)cc1 1834797501 PXPVTYITQHAFJP-UHFFFAOYSA-N 471.407 0.350 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(CO)c(F)c3)CC2)CC1)c1cccc(B(O)O)c1 1834801532 UDTODFGISLXXEJ-UHFFFAOYSA-N 483.349 0.497 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cccc(F)c1)CCO2 1835028775 UIMFVIQYGZKXMF-JOCHJYFZSA-N 450.511 0.198 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)C(C)(C)CCl)CC3)CC2)CC1 1835510237 JIBIUZSCFGNMIK-UHFFFAOYSA-N 470.058 0.987 50 20 JCGD Cn1cc(CCC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1835736801 IJQLWPIGLKPCMV-UHFFFAOYSA-N 482.589 0.237 50 20 JCGD CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)CN3CCN(C)CC3)CC2)CC1 1836541861 KBXXXCZJDUMFBJ-LJQANCHMSA-N 472.472 0.979 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456397 LXXXJBPVYQCZSQ-BXKMTCNYSA-N 499.593 0.936 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4F)CC3)C2)C1 1837460455 GIODUAVYGDERDC-DEOSSOPVSA-N 497.527 0.626 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1837498994 BZECCUOMKWZRHD-SNRMKQJTSA-N 483.345 0.174 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)nn1 1838831026 NOPJVUOZHFBDOP-AJPHYDNBSA-N 499.528 0.079 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1839964052 DLUSQPDMCSJYOH-LIRRHRJNSA-N 466.336 0.973 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1840032577 CMNFWSOURFUETI-XCLFUZPHSA-N 481.347 0.909 50 20 JCGD CCc1nn(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)c1Cl 1840150406 KDCBGSSRLAIIMU-YJYMSZOUSA-N 463.362 0.960 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1 1840152269 CWLSQNJFHDHUQJ-WOIUINJBSA-N 451.951 0.411 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(=O)Nc3cc(C)on3)C2)C1 1840152855 WXGSYXKZMVDAAT-KUHUBIRLSA-N 458.899 0.022 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3c3ccccc3)C2)C1 1840185264 NIEKHIFSMVGIGH-MZLICYQSSA-N 458.559 0.620 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C[C@H]2C[C@H]21 1840912464 FZSYNBASZHZHRU-DBPMHTNYSA-N 487.981 0.440 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2 1843416257 POZIJTZUESEBEV-WGOQTCKBSA-N 477.525 0.677 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCO3)C1)NC(=O)NCc1ccccc1 1844072838 NSKPNQXWCIUVFW-UHFFFAOYSA-N 481.557 0.829 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc(Br)nc1)C2 1844264746 CNNFWPYAGUXSSQ-UHFFFAOYSA-N 473.331 0.902 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846472601 KXABBHBHJHIOEA-KRWDZBQOSA-N 471.363 0.831 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(S(C)(=O)=O)CC1 1847500520 BUDKDRMLFQKQFW-SNPRPXQTSA-N 450.399 0.891 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 15524851 MBJBMTYOGDHHRW-UHFFFAOYSA-N 467.525 0.186 50 20 JCGD CCc1ccccc1OCC(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727162411 CLYHRNRYSLIKNT-UHFFFAOYSA-N 463.292 0.681 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O)NNC(=O)[C@@H]1COc2ccccc2O1 728325062 JMEKQDCUFIQGGB-KXBFYZLASA-N 469.450 0.527 50 20 JCGD Cc1c(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnn1-c1ccccc1 728331262 HNYZXACOUQKUCJ-IBGZPJMESA-N 451.439 0.649 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2C[C@@H](O)CN2C(=O)c2ccc3c(c2)CCC3)n1 728730839 XVIZRGNCUVDPJL-QZTJIDSGSA-N 486.550 0.449 50 20 JCGD O=C(NCc1nnnn1-c1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 730672807 NRZISYQSNHCQEJ-UHFFFAOYSA-N 470.515 0.591 50 20 JCGD CC(=O)NC1(c2noc(CCC(=O)NNC(=O)CNC(=O)c3ccco3)n2)CCCCCC1 751203785 SAKADABZXOTMQP-UHFFFAOYSA-N 460.491 0.858 50 20 JCGD Cn1cc(S(=O)(=O)N2CCCCC2)cc1C(=O)OCC(=O)NNC(=O)c1cccs1 915024821 KYUZXQNYPQHEAL-UHFFFAOYSA-N 454.530 0.879 50 20 JCGD C[C@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1cccc(S(N)(=O)=O)c1 916197051 LUVDAISLWMLOKN-KRWDZBQOSA-N 474.587 0.938 50 20 JCGD CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)C2=O 919889568 OJHVLWGAYFOMHG-MLZJXEJWSA-N 457.553 0.031 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ccccc3n2)C1 1778478698 RFJCLWQVROANHJ-WZONZLPQSA-N 456.547 0.835 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1779029620 VTLACOXPHPVKPI-XMMPIXPASA-N 467.526 0.688 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@@H]4Sc5ccccc5[C@H]43)C2)C1 1779044656 BCLJTOUDFDYYCF-JCUDRXCFSA-N 464.352 0.698 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ccc1F)C2 1779374566 OVWICYTXHISFAC-AUSIDOKSSA-N 471.489 0.971 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1 1780052925 ZEWAXJAAQZCDFC-HSZRJFAPSA-N 476.497 0.228 50 20 JCGD COc1cc(OC)cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1780656865 KQEPZRALUMEXAI-HSZRJFAPSA-N 454.288 0.141 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(O)c(O)c(Cl)c1 1781122793 OZNDWOXOBFLQHJ-AUSIDOKSSA-N 488.733 0.872 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1781382971 DVPJNWZVNNORJN-MJGOQNOKSA-N 499.374 0.593 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CNC(=O)C2)C1 1781775517 XBBZBDWBJFCSQN-JEZSTIGHSA-N 486.997 0.769 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCNC3=O)C2 1781999341 WHWJBXRXXBQSBY-GQWAEJPESA-N 482.379 0.928 50 20 JCGD Cc1ccc(C(=O)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1782094399 USYZFOXOEWBOLX-PXDATVDWSA-N 464.327 0.685 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782543449 HQFHTYOLUKZJPV-XTQVGHSUSA-N 454.336 0.027 50 20 JCGD C[C@H](N[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)C1CC1)c1ccccc1 1782887611 LDCJCMQJPUNGBL-SZJUTTIESA-N 491.397 0.939 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cccc(F)c3F)C2)C1 1783386997 YWXHAHGYYFOCHK-JOCHJYFZSA-N 459.453 0.650 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCO3)C2)C1)NC(=O)NCc1ccccc1 1783489012 XHDBUZRLWQHUOJ-WMZHIEFXSA-N 459.547 0.342 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C[C@@H]1CNc3ccccc3O1)CCO2 1783936208 SBYYUEZKIOTKOD-HXOBKFHXSA-N 459.547 0.453 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCNC(=O)C3)C2)C1 1784037337 DOJLTBJYZBPDRK-OYHNWAKOSA-N 474.470 0.490 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4ccccc4[C@@H]3O)[C@H]2C1 1784151850 KPUVWWIXPBLYHD-HCKMINRYSA-N 472.586 0.635 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Oc3ccccn3)C2)C1 1784488842 KXPWGOHWARYTAV-DANYPQMUSA-N 468.514 0.813 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)C3=COCC3)C2)C1)NC(=O)NCc1ccccc1 1784767244 WVJUKAJIUVRPIV-QHCPKHFHSA-N 457.531 0.467 50 20 JCGD CC(C)N(C)CC(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1784774293 GCYWNMIODBQOCW-DEOSSOPVSA-N 474.606 0.503 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C[C@@H]21)c1ccc(B(O)O)cc1 1786979599 BSJKUWZDPQYXKY-JLMWRMLUSA-N 466.299 0.045 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Cl)c(F)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786982733 GGPKIUAWVRVKGG-MDKPJZGXSA-N 474.725 0.995 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)c2c1 1786983866 CEMVIUOGYZQURC-YROCYRMSSA-N 477.326 0.763 50 20 JCGD Cc1nc2sccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1788438913 JNWWECVAVIWBSC-SZMVWBNQSA-N 468.344 0.291 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794111373 MQHJVEIVANLTAW-XRHZXQNYSA-N 469.336 0.366 50 20 JCGD 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O=C(NC[C@@H]1CCN(C(=O)c2cnc3snnc3c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360683 LSWLUIXKARCGGQ-OXJNMPFZSA-N 488.338 0.795 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CNC(=O)c2ccco2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361455 AOJPYILFEDPPKT-AVRDEDQJSA-N 476.298 0.104 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807367540 SJAAWMIEQFRWAJ-XFQXTVEOSA-N 469.303 0.643 50 20 JCGD C[C@](O)(C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(F)(F)F 1807367544 ZVKUVPUNZLADQR-SYNHAJSKSA-N 465.237 0.394 50 20 JCGD COCCOCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808413919 CLBIVWRZKCAYHS-BFZLZUEVSA-N 470.530 0.884 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)n1ccccc1=O 1810518838 SUWZPGORGUAEFI-LYHRCORUSA-N 468.558 0.883 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1n[nH]cc1[N+](=O)[O-] 1810632896 LBDUJVLWTHZSSH-BEFAXECRSA-N 464.247 0.026 50 20 JCGD Cc1nc2ncccn2c1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 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CN(C)C(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828931735 IDKDHWQWUKVLLY-HTAPYJJXSA-N 480.949 0.126 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(-c3ccccc3)on1)CCO2 1829590519 KRVUHSPHSOIITF-RUZDIDTESA-N 491.309 0.405 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1830570276 CBSQNRHUGBSSPH-AUUYWEPGSA-N 494.383 0.113 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1 1831286513 XZWMBUXJQQNZGN-MSOLQXFVSA-N 456.609 0.556 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873283 GFNFFVFABMOIGA-VQIMIIECSA-N 455.556 0.044 50 20 JCGD Cc1nn2cc(CC(=O)N3CCO[C@@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)nc2s1 1832109720 BHVJUKUAHIAWRJ-KRWDZBQOSA-N 462.359 0.902 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCCO3)CC2)CC1 1833112993 YOLBVFBZKCZZLR-HXUWFJFHSA-N 458.563 0.439 50 20 JCGD CC(C)c1csc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)n1 1833282085 UYWOCROICUMYNV-JOCHJYFZSA-N 473.360 0.330 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)c(=O)[nH]c1C 1833386319 VQSZBIWUVRUNTQ-HXPMCKFVSA-N 471.352 0.488 50 20 JCGD CN[C@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1)C(=O)O 1834741655 BQCSDSLXTVVLFF-DNVCBOLYSA-N 451.395 0.857 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(Cl)cnc3O)CC2)CC1)c1cccc(B(O)O)c1 1834800670 XEJPBBAQXKXCQJ-UHFFFAOYSA-N 486.765 0.619 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCC3)CC2)CC1 1835116720 YLJSWFHUMUQMSY-OVVQPSECSA-N 471.606 0.788 50 20 JCGD COCCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835180084 YUKBJPXSYQAGLD-UHFFFAOYSA-N 477.610 0.088 50 20 JCGD CCOc1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1835737213 WXIRPNNRQFXKPI-UHFFFAOYSA-N 496.572 0.373 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3nccnc3C(N)=O)CC2)CC1 1835836183 RYAKHNBTSKNBMP-UHFFFAOYSA-N 462.627 0.612 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n(C)n1 1835954083 CLLFVSMDAFVWHF-UHFFFAOYSA-N 467.379 0.161 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1836473546 ISXDXAYUJAGULY-KPZWWZAWSA-N 470.350 0.132 50 20 JCGD O=C(c1cc(-c2cc[nH]n2)n2ccccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836774514 ACARURQMOWMVPK-OFNKIYASSA-N 487.944 0.999 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1oncc1C)CCO2 1838394397 NYIOCPRVMJIEIH-SGSZHJQISA-N 458.475 0.187 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1839156126 BWNXEQRYHZTURL-SJORKVTESA-N 484.427 0.539 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1840151373 ZXOGYYOZGSQLOE-QMTHXVAHSA-N 464.796 0.052 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1840153504 PYMZIIUFYKZEJV-YCRPNKLZSA-N 465.890 0.145 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1 1840184837 GAMNWJMTTUWDRF-SQJMNOBHSA-N 472.586 0.621 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccccc3F)C2)C1 1840185007 IQJPIUADVMBFTF-QFIPXVFZSA-N 466.510 0.034 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)C[C@](C)(O)CC(=O)O)C1 1846379319 SPRGMEWYXNPARI-DJJJIMSYSA-N 461.943 0.938 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H](C[C@H]1CCOC1)NC(=O)OC(C)(C)C)C2 1846384900 WXKKNURXCOAWRO-QZTJIDSGSA-N 495.621 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H](F)CN2C(=O)OC(C)(C)C)C1 1847136883 RDRYJEWUIVMFAA-HOTGVXAUSA-N 469.558 0.910 50 20 JCGD CCn1nc(C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)c2ccccc2c1=O 107910042 PCECFJCUPYIAPD-UHFFFAOYSA-N 453.480 0.664 50 20 JCGD CCS(=O)(=O)N1CCC[C@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1 728216265 WDBFXXPVBYIEOX-INIZCTEOSA-N 473.621 0.128 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)C(=O)NC(C)C)c1 728260980 MUKTXTPWTLWPRU-UHFFFAOYSA-N 454.958 0.205 50 20 JCGD O=C(O)c1cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc2c1OCCO2 728854367 TZWWHTVCHWOUGK-UHFFFAOYSA-N 463.472 0.172 50 20 JCGD COc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1S(=O)(=O)NC1CC1 728889346 DLEKJZQXPINAQP-UHFFFAOYSA-N 474.543 0.604 50 20 JCGD Cc1nn(-c2ccc(Br)cc2)c(C)c1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 729276390 DNPSONLIKWQAQJ-SNVBAGLBSA-N 458.338 0.950 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 730781361 KZNTXSPOHONNRU-UHFFFAOYSA-N 455.514 0.244 50 20 JCGD Cc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1S(=O)(=O)NCC#N 731193733 NNDWVUHICXTVTD-UHFFFAOYSA-N 457.516 0.265 50 20 JCGD COc1cc(C(=O)NNC(=O)NCCc2ccc(S(N)(=O)=O)cc2)cc(OC)c1OC 806966826 RMYIDPABEWAYOO-UHFFFAOYSA-N 452.489 0.547 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)Cn2cccc(C(F)(F)F)c2=O)ccc1Cl 889834485 LKMDEPZKUNKSSZ-UHFFFAOYSA-N 452.798 0.629 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)Cc2ccc(F)cc2)c1OC 913156195 RQPYZDOZUDYJHZ-UHFFFAOYSA-N 481.502 0.868 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](Cc1ccc(F)cc1)n1nnnc1C 916134701 XCHYXCVRPVNZHB-MRXNPFEDSA-N 474.522 0.967 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC2CCN(C(=O)C3CC3)CC2)cc1 916261064 RVANQFHOYUXEFP-UHFFFAOYSA-N 451.549 0.347 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)N[C@H](C)Cn1cccn1)N(S(C)(=O)=O)CC2 916462526 CSWINQUTOYMGOE-PBHICJAKSA-N 494.574 0.568 50 20 JCGD C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916516285 JLNCRWFNMUEYSC-MRXNPFEDSA-N 494.549 0.470 50 20 JCGD O=C(NCCN1CCc2sccc2C1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 919784515 KAXLQZKRRMXQAV-UHFFFAOYSA-N 493.611 0.771 50 20 JCGD COc1cccc(OC)c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032450 KHAQQIWOVIVKJL-HSZRJFAPSA-N 469.498 0.460 50 20 JCGD O=C(COCCO)N1CC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1781319382 WQBCZSDIBZBQCM-PXNSSMCTSA-N 455.349 0.831 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781334397 NHQCVNMAMBEYTH-DNVCBOLYSA-N 473.295 0.970 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(N(C)C)nc1)C2 1782212334 UDCUQLUAYNPBDP-WZONZLPQSA-N 460.579 0.648 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nn(C)c3c1CCC3)C2 1782214958 NUXMGCMGNYWGSR-WZONZLPQSA-N 460.579 0.409 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2s1 1782297637 OHKVBEQSNWUNIB-JOCHJYFZSA-N 453.329 0.975 50 20 JCGD C=CCCc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(O)n1 1783936588 PQSODJWQNGPUNF-QHCPKHFHSA-N 459.547 0.722 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783939384 DOORFUYLHOISQZ-SBUREZEXSA-N 479.578 0.106 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(F)c1F 1786986686 YLHISBBJUMPGIH-SNRMKQJTSA-N 458.270 0.860 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C[C@@H]21 1787508370 HFLALZUVPFSFOW-BGSSOVSISA-N 492.536 0.909 50 20 JCGD Cc1nc2sccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788439069 UIHAAZSLYWCGRH-SZMVWBNQSA-N 468.344 0.291 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NNC(=O)C3)[C@H]2C1 1788557794 VDAYYOFYPUPPJO-NCRFIVEOSA-N 457.437 0.727 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H](O)C3)C[C@@H]21 1789222359 VBKMXBBUIQBTHE-SOGVWKPYSA-N 461.471 0.884 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1cccc(N2CCOCC2)c1 1790117541 WLAIMDOZPQMYIH-LEAZDLGRSA-N 451.951 0.716 50 20 JCGD COc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)ccc(F)c1F 1790171707 LHQWDPUODYZBBO-IWEFOYFVSA-N 489.479 0.879 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1 1790783104 RBWNCQOVYIABDK-KANFNMMFSA-N 472.991 0.602 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)ccn1 1791290680 KJPKOBACNHZJAC-LNLFQRSKSA-N 475.546 0.225 50 20 JCGD Cc1cn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)c(=O)nc1O 1792130176 DSUGMMIEGIXMEF-UNQGMJICSA-N 471.352 0.268 50 20 JCGD COCCOCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr 1792872223 SGLGDNURUIFQRU-VXIBKDFQSA-N 495.411 0.303 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)[C@@H](O)C1 1795114999 WJNYMYFHZDQWDD-PFFSRIRZSA-N 490.395 0.589 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)CC1 1795741085 IXACPSYZJQLJFG-CEQLMSFQSA-N 499.373 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c[nH]c2nccc-2c1Cl 1796221035 GPEIJPNAZXGWKB-KSPBDQMDSA-N 483.916 0.683 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS(=O)(=O)N1CCCC1 1796441442 OZYJNWDHSMUVFH-IARIHHJXSA-N 456.392 0.238 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1csc(Br)n1 1796688885 JKVQSVJRSPXNFL-JJLQDPRZSA-N 480.149 0.102 50 20 JCGD Cc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)n[nH]1 1799097202 ILUYADUYKAJFPD-BBIADKPPSA-N 483.573 0.196 50 20 JCGD CCOc1ccc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799616156 HAQHBWDTDRZLHY-VPTLXERWSA-N 472.734 0.936 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1nc(N)n[nH]1)C2 1800333469 WVJQNKGOLJHRLR-YACYFGNPSA-N 471.468 0.794 50 20 JCGD CCOc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1OC 1800861231 DQGLLILHJCQZKC-MRSFGVLCSA-N 476.574 0.599 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C(=O)C(=O)O 1801326945 LOAWQMOASRNZBG-CRWXNKLISA-N 474.942 0.300 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)C1 1805506298 LZKOTMHXZPOKRU-RBUKOAKNSA-N 456.348 0.801 50 20 JCGD CCn1nc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1C 1807362198 UZQHOPZZPZSJIP-DENIHFKCSA-N 461.331 0.920 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc1 1807365907 PSSFLYGABMXSPL-ZTCOLXNVSA-N 489.337 0.823 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807372388 DWSWHNFTWGOVKN-KNQAVFIVSA-N 465.315 0.590 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809980884 ZABIROLRYZQRHD-SFHVURJKSA-N 475.351 0.054 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1 1810302041 FCONBUWZDILZMS-GUYCJALGSA-N 450.459 0.142 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)N1CCN(C)CC1 1810306118 UPNHGMDDNQUBSC-JUXOCIIHSA-N 494.600 0.036 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1812408989 PYXNZGSWMJWEAL-QILLFSRXSA-N 463.878 0.457 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812715631 UVQJRIVYOJXWAL-RXVVDRJESA-N 452.628 0.226 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1 1813101525 QNZFKBKQKZEVQT-RDTXWAMCSA-N 472.468 0.139 50 20 JCGD CNc1nsnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470122 JJMYCGBKYNJNRB-CQSZACIVSA-N 455.309 0.602 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)[nH]n1)c1cccc(B(O)O)c1 1817474128 NAFUWJHQBNRZOF-KRWDZBQOSA-N 467.251 0.200 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2nccn2)[nH]n1 1818113442 LOLQXQKSKAVFBS-IXBOPPFXSA-N 452.479 0.828 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3nc4ncccn4n3)sc2C1 1818310378 MXQWDKHBKVPARI-NSHDSACASA-N 457.520 0.180 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)[nH]n1 1822371834 ZZDXPUFSFYGHFU-WBVHZDCISA-N 454.959 0.820 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2)C(=O)C(=O)O 1824673208 BYXQNBUXAIKCMF-WKEGUHRASA-N 451.274 0.289 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCNC(=O)c1ccc[nH]1)CC2 1826080493 NKUXHQPSYGHJHV-ZDUSSCGKSA-N 475.575 0.576 50 20 JCGD Cn1cccc1C(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826995275 CODARGBFFDMKJN-AWEZNQCLSA-N 452.301 0.270 50 20 JCGD O=C(c1cc(O)nc(O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055411 YYNMMZLGBQZBGA-LJQANCHMSA-N 453.304 0.720 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1 1827536660 OBYCMBMPQBYMIP-HXUWFJFHSA-N 477.330 0.662 50 20 JCGD C/C(=C\c1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1829701214 SXUVFVYZGGGMDL-LVJXIGIWSA-N 470.356 0.601 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1 1830539860 JRZAYQMQIPSCPX-CLCXKQKWSA-N 470.368 0.764 50 20 JCGD O=C([C@@H]1CCCN1C(=O)c1ccc(F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830720418 ZLOALQUGHGCHBG-SFYKDHMMSA-N 497.951 0.486 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1830735648 KHJOFYUJVNLKAG-WIYYLYMNSA-N 488.990 0.079 50 20 JCGD CSCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831535111 QYDHOULYFMLZEM-NRFANRHFSA-N 465.576 0.144 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CCS(C)(=O)=O)CC2)CC1 1835118011 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Cn1c(=O)n(C)c2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc21 1839200071 BJSXYIDQVZJQQH-OXQOHEQNSA-N 499.337 0.638 50 20 JCGD O=C(Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1)C1CC1 1839249458 PQRIZFSCNMNLSQ-GCJKJVERSA-N 465.934 0.705 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H](N)c3cccnc3)C2)C1 1840031721 AHDNJVYXCNSLAC-GMBSWORKSA-N 455.353 0.711 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1 1840484113 ZCSIGQWMKYTLEO-LIRRHRJNSA-N 456.337 0.838 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2 1840858579 FKNDNBZAZYJTIX-DEOSSOPVSA-N 482.317 0.307 50 20 JCGD O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)CN2C(=O)CNC2=O)C1 1841848933 VZFFWIVLRJOUGU-OAHLLOKOSA-N 463.332 0.748 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014941 SKZOPUNKQOVFKW-GOSISDBHSA-N 471.363 0.831 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 1847639916 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NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccccc2O)cc1 730780268 SFOVMVJDNMENBN-QJWNTBNXSA-N 452.467 0.722 50 20 JCGD CC(C)(C)c1ccc(C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)CN2CCCC2=O)cc1 751616819 HCHADGSKTMLRSZ-KRWDZBQOSA-N 480.587 0.287 50 20 JCGD CC(C)C(=O)N1CCC(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 887036737 MXMSLORGXQTXPT-UHFFFAOYSA-N 494.614 0.682 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)s1 893135011 ILURAJBOKOVOBE-HNNXBMFYSA-N 475.552 0.918 50 20 JCGD C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1 906487691 BDNHPTZSUGFXSR-CYBMUJFWSA-N 464.475 0.175 50 20 JCGD O=C(NC[C@@]1(N2CCOCC2)CCSC1)NNC(=O)c1csc(N2CCOCC2)n1 915257718 HCFPURXWPSOBPP-SFHVURJKSA-N 456.594 0.132 50 20 JCGD CC(=O)Nc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1 916247807 DOKOTESRZCESIC-UHFFFAOYSA-N 461.548 0.802 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1C 916516335 KNWCQJKBHWNNDO-UHFFFAOYSA-N 490.586 0.560 50 20 JCGD C[C@H](Sc1nncn1C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 917902261 TVNZRJBEHCEPJN-ZDUSSCGKSA-N 452.562 0.932 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778114279 BFUSVRKTBSZXED-QZTJIDSGSA-N 470.419 0.724 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c(C3CC3)c1F)CCO2 1779028187 GTRCSDUUBRUHHT-NRFANRHFSA-N 457.466 0.182 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1779073556 QEOLXFREEAOQEH-ZENOOKHLSA-N 453.261 0.002 50 20 JCGD O=C(/C=C/C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)NCc1ccco1 1779208055 DUGMZPDJYPRVPK-SCQSPADBSA-N 458.284 0.972 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779375597 QBRBFLZBFRKFMK-JXXFODFXSA-N 482.379 0.986 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Cl)nn3)C2)C1 1779429724 QRUZRSBSIQSYSS-IYHCKTHZSA-N 459.894 0.708 50 20 JCGD C[C@H]1Oc2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)cc2NC1=O 1780175294 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O=C(NC[C@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376043 RPBAROYHMLJTPU-DYESRHJHSA-N 470.298 0.666 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1808410303 UTVVVJJSBMKSCF-WPPMJBLNSA-N 460.922 0.821 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1 1809767893 IGDILRUFMICHCC-HTAPYJJXSA-N 464.530 0.817 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810304996 IGRNDHFICYWMMM-JLSDUUJJSA-N 460.922 0.654 50 20 JCGD CCOc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1 1811620342 CLGIOGMZXJBWPX-XMSQKQJNSA-N 475.314 0.584 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H](CNC(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1 1813185924 HTDXTHAPMQFYGI-JCXROGDPSA-N 451.332 0.632 50 20 JCGD COc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cn1 1816611457 ZWBNUZWZWFEEEY-INIZCTEOSA-N 465.474 0.827 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)CN)sc2C1 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Cn1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cccc1=O 1827050664 CEZJJZDNWFTGPY-HXUWFJFHSA-N 451.332 0.612 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2nc[nH]n2)CC1 1828925847 PSHBHINJGMTLES-QGZVFWFLSA-N 472.575 0.829 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ncc(Cl)cc1Cl)CCO2 1829606690 HENNHQCYBFUBML-OAQYLSRUSA-N 494.140 0.452 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)N1CCN(C)CC1 1830243072 XCHLMDIRMZDSRF-TZIWHRDSSA-N 464.655 0.615 50 20 JCGD O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830730893 FPIDYHWKJRHZDF-JPYJTQIMSA-N 475.929 0.313 50 20 JCGD Cc1cc(C)c(OCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(C)c1 1831167624 XLIHVNXPXNBVOK-AREMUKBSSA-N 496.369 0.441 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)COc3ccc(O)cc3)CC2)CC1 1833212461 GHWZMJZFLAGNDI-UHFFFAOYSA-N 475.590 0.716 50 20 JCGD CN(C)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1833665206 GARVNSXPCPOPJA-YJBOKZPZSA-N 459.316 0.908 50 20 JCGD CC[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1834749541 YHRMHNVPRHLJFX-RCZVLFRGSA-N 466.343 0.630 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C[C@@H](N)c3cccnc3)CC2)CC1 1834765008 RRYWRHRERYTMEZ-OAQYLSRUSA-N 473.622 0.416 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccn4cncc4c3)CC2)CC1)c1cccc(B(O)O)c1 1834800215 YNWSHHXCKHXSJN-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3F)CCO2)C1 1835003874 POCXGPYDTGJUET-FXZATJRASA-N 485.516 0.959 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CCN(C)C)CC2)CC1 1835118241 JXFIKEFQDNEBPF-YZSQISJMSA-N 459.595 0.644 50 20 JCGD Cc1nnsc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737033 SHJMMJZCAVEXTM-UHFFFAOYSA-N 472.575 0.344 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)N1C[C@H]2C[C@H]2C1 1835737958 OTBZLPHNRZGSJJ-KURKYZTESA-N 483.617 0.211 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1OC 1835939542 RXOKLBXHRKAGQY-RUZDIDTESA-N 498.341 0.076 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cncnc3)CCO2)C1 1836048395 HIWMMKAGUGYOEB-BEFAXECRSA-N 455.353 0.897 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc(O)cc1 1836299384 GAMXISCCUKTOEW-UHFFFAOYSA-N 451.332 0.571 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1 1837020310 VQNWTBAVHNTEIA-DNVCBOLYSA-N 466.336 0.973 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1 1837460198 XEXHNRBCSREYLQ-QFIPXVFZSA-N 475.452 0.347 50 20 JCGD CC[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838527387 PZHYJWQNICIUCI-UTKZUKDTSA-N 465.459 0.361 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])CCO2)C1 1838601779 UCVTUARHZHUBCE-XOBRGWDASA-N 487.893 0.633 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(-n2nccn2)c1 1838629115 FTIGKOPESSRAGU-NQIIRXRSSA-N 463.922 0.245 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1 1839197831 JIQNOFRFPDNRKQ-YJBOKZPZSA-N 473.299 0.801 50 20 JCGD O=C([C@@H]1COc2ccccc2O1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199328 UIDXMVQXCCFSFI-BXWFABGCSA-N 473.295 0.973 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1 1840033932 VCYDPTYNOYDUIL-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(c4ccccc4)(C1)C3)CCO2 1840954292 GKKBKHWIJVFTGR-NRUKRLKBSA-N 484.597 0.938 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc1 1843013296 DIBADXNPQGAPNO-UHFFFAOYSA-N 450.300 0.855 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1846166508 ICNXVANXRWXAHO-QGZVFWFLSA-N 459.547 0.878 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1848099679 XUDCKLBRGWAAMF-XUXIUFHCSA-N 462.931 0.385 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cn2cnc3sc(C)c(C)c3c2=O)cc1 17406252 CRUZRLXDLNNJFK-UHFFFAOYSA-N 477.568 0.851 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNc1ccc(S(=O)(=O)NC2CC2)cc1 728210254 LAVWBJMMZMYSHO-UHFFFAOYSA-N 496.567 0.710 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCn2nc3n(c2=O)CCCC3)nc1 916649538 GSEFOSLMJYCHJC-UHFFFAOYSA-N 452.541 0.179 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCc1nc2c(O)nc(=O)n(C)c2[nH]1 920275528 ZGMFQPNTPCAAJF-SECBINFHSA-N 479.291 0.672 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1n[nH]c2ccccc12 1779017008 QPIFAYKWHLUSGO-HYBUGGRVSA-N 462.315 0.684 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C#CC2(O)CCCCC2)C1 1779397395 IXKPXPBENDTLHW-HYBUGGRVSA-N 483.569 0.511 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(O)nc3)C2)C1)NC(=O)NCc1ccccc1 1780259557 OAQUGMFLYAWQHV-DEOSSOPVSA-N 482.541 0.577 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C2)C1 1780923485 LEPZJJMKWCPNKE-HSZRJFAPSA-N 470.281 0.820 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)C/N=C/c3ccco3)CCO2)C1)NC(=O)NCc1ccccc1 1780969355 YHKCZKICKOTDEI-IAWFGPOKSA-N 496.568 0.875 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2ncccc2[nH]1 1781211782 UAULQUOPEAZVTO-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1781432543 ZVQQEXGDTIJXRI-RUZDIDTESA-N 497.600 0.745 50 20 JCGD Cc1cnn([C@H](C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1782512069 AOUURTLLZCULJX-HCLVMJGWSA-N 454.336 0.260 50 20 JCGD CN(C)CC[C@](Cc1ccccc1)(C(=O)O)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1782802232 FIRPCLTWXXVRQQ-WDJPJFJCSA-N 496.004 0.681 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc(-c3ccccn3)nc1)CCO2 1783936702 RSXZWSJYKJXLDY-HSZRJFAPSA-N 467.530 0.355 50 20 JCGD COc1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1784264898 YBUVTMOVSSFAPD-XJABCFGWSA-N 481.553 0.920 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4ncccc34)C[C@@H]21 1787508842 MBKMQUFIQGNYGM-PGMBAZLQSA-N 478.513 0.457 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)c1cc2n(n1)CCCNC2=O 1788255265 MRHYFJDZWLSPRS-LWWSYDQCSA-N 472.315 0.300 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611004 IBNIXRHXAOJPOJ-PDWMJMLSSA-N 468.514 0.141 50 20 JCGD Cc1noc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)n1 1789726711 OWOMVTSOVKOLDF-UFYCRDLUSA-N 499.572 0.246 50 20 JCGD COc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)ccc1[N+](=O)[O-] 1789850258 XOFOWXMXHYWPIY-DNUAJFIVSA-N 455.895 0.725 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21 1791057817 HYBQZPXCGPCWLN-ZHPDPMBESA-N 475.365 0.215 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(F)cc1F 1793680469 HGBPQJISNKDATO-GAKFLWOGSA-N 471.464 0.880 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCCC1=O 1795449953 QFEQLSFDKIWMEB-USGNIVHTSA-N 474.470 0.346 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)c2c1 1795734722 XFSIMOTZNJQBKE-MFKICJERSA-N 463.299 0.373 50 20 JCGD COc1c(C)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1C 1795735966 MDOSVESBQHINNG-CEQLMSFQSA-N 452.316 0.509 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)C2)c1cccc(B(O)O)c1 1795737756 QFIWQGQLXXEATP-MPMRWZLSSA-N 452.291 0.512 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1OCC1CC1 1795739715 FJZIOKGYZXDNKW-IRJINJETSA-N 494.353 0.681 50 20 JCGD Cc1cn2c(=O)c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)cnc2s1 1796188962 GOTANWHEYDRBHW-BJWYYQGGSA-N 466.328 0.310 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c([N+](=O)[O-])c1 1796192973 GBBQVWJDEGUNJF-BCDXTJNWSA-N 481.270 0.627 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3c1)C2 1796444160 YRENSRJYFNNXGZ-KEMUROEHSA-N 463.498 0.672 50 20 JCGD Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc2ccccc21 1796768298 WNESUPOWDVTBMX-VPTLXERWSA-N 462.510 0.694 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)C2 1796891001 UWYSKLJNJQJOGJ-NGYDUSEUSA-N 456.463 0.564 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)C1=NO[C@H](c2ccccc2)C1 1797175174 CBWVOBCFGLCQGZ-UDKICSLYSA-N 463.299 0.087 50 20 JCGD COc1ccc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)ccc2c1 1797750556 IAXZHJKYDBJTON-MFKICJERSA-N 490.520 0.759 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1800853720 KCVZYUQEBFDMJO-NIJWHBBBSA-N 468.290 0.431 50 20 JCGD O=C(COc1cccnc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804332309 FCXGXWNLVAFQRN-XXBNENTESA-N 460.299 0.555 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807359910 MSIKBZXOPOOTOE-NNWRFLSQSA-N 450.348 0.565 50 20 JCGD CC(C)c1nc(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)no1 1807360591 CPDKNUGVQNWVKK-AVRDEDQJSA-N 477.330 0.830 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(-n3ccnc3)ccn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361628 SGMYDJFLDOPOKU-HYBUGGRVSA-N 496.336 0.976 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807372095 AKTICLRODGYDFG-DJBLJDHKSA-N 450.304 0.121 50 20 JCGD C[C@H](O)C(=O)N1CC[C@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1807454039 RMXRWIGIRUKCCV-UCNVEGJOSA-N 468.558 0.814 50 20 JCGD CN1CCC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)C1 1807552010 QUFIMHJPGOPLME-WFXMLNOXSA-N 465.558 0.742 50 20 JCGD CC(=O)N(C)CCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810293331 CQZAAVMGNJNXFU-UWJYYQICSA-N 467.530 0.268 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810309568 SCANXAMOCNZOBE-APWZRJJASA-N 482.541 0.989 50 20 JCGD O=C(C#CC1(O)CCCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810326799 IZDYKDUXJRFLOM-URXFXBBRSA-N 475.354 0.780 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)C(=O)C(=O)O 1812392948 WERVAIBRNWVZQN-QAPCUYQASA-N 450.568 0.482 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1813093921 KTPZVYQMHJJWBX-ZYSHUDEJSA-N 472.571 0.514 50 20 JCGD Cc1cc(C)n(CCC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1813304837 FWYIDCFTYACLHE-URXFXBBRSA-N 475.358 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(=O)n2O)n[nH]1 1816148130 SLGZYCZCAXIECT-HNNXBMFYSA-N 466.458 0.427 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819404577 PODWRAMUOVSHNY-MRXNPFEDSA-N 464.486 0.936 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccccc1C(N)=O)CC2 1819800418 OPQFXOQPSFKFIH-LLVKDONJSA-N 479.522 0.780 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1822575021 UFWDOEZXOVSVBH-HNNXBMFYSA-N 488.375 0.962 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1O 1830735666 LIHRFAWHDICVCC-XLIONFOSSA-N 455.895 0.020 50 20 JCGD CC1CCN(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC1 1831107637 PJKALGPKMWQIEX-FUHWJXTLSA-N 450.349 0.865 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1831645950 FIXDFHIYKIBLQI-LPHOPBHVSA-N 466.000 0.276 50 20 JCGD O=C(/C=C/c1cccnc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833856544 WORIJRHOUUGPFD-FPYGCLRLSA-N 462.359 0.660 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)nc3)CC2)CC1)c1ccc(B(O)O)cc1 1834798467 ZAJZQDJPIRDAFA-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc4nccn34)CC2)CC1)c1ccc(B(O)O)cc1 1834799063 MZLWAVFFCRXCOV-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD Cc1nc(N)sc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801067 MSWJWAIPZQRJLA-UHFFFAOYSA-N 471.392 0.213 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1834972749 JTMMJCDVQOQRLE-HNNXBMFYSA-N 464.958 0.405 50 20 JCGD Cn1ncc2cc(C(=O)NC3CCN(C4CCN(C(=O)c5ccc(B(O)O)cc5)CC4)CC3)ccc21 1835415773 AEJWTEAJXNXVPT-UHFFFAOYSA-N 489.385 0.752 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1835642701 VFVCURQRXLFEHJ-LPMFXHHGSA-N 466.938 0.219 50 20 JCGD O=C(CCc1ccccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935739 PCSAYZHFVGMQHL-DEOSSOPVSA-N 486.761 0.723 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccccn4n3)CCO2)C1 1836392264 JGYSWYZLBZRXDC-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD COCCOCCOCCOCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836719403 RIGKVGRHSKZAIZ-FQEVSTJZSA-N 495.013 0.281 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836837818 VVZMCWXAFTZFTA-RUZDIDTESA-N 490.325 0.002 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccn3cncc13)CCO2 1837110651 FWHUUBQMUCOAGD-FXZATJRASA-N 493.524 0.538 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1837714572 KTZQZBYOORKZPW-NPPFBWRTSA-N 467.639 0.695 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc(CO)c(F)c3)CC2)CC1 1837921035 UGHRIPWRAAMEGO-UHFFFAOYSA-N 484.333 0.924 50 20 JCGD N#Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1Cl 1838598718 YYCPSJWEHGPUJU-HSZRJFAPSA-N 498.927 0.594 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049183 BWBPSOXCMBSQFE-JXFKEZNVSA-N 480.363 0.902 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1839153452 IHAVSDGUYIEVEZ-QZTJIDSGSA-N 461.302 0.481 50 20 JCGD C/C=C/C=C\C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839836340 NVTAGJQAWMQGFC-IVZGGDASSA-N 485.585 0.921 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1839933865 ARNAKZXABFVUAJ-VWLOTQADSA-N 466.343 0.296 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2)C1 1840149486 QVKYAAHZZNAXLC-MDOVXXIYSA-N 463.959 0.610 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncc(Cl)cc3Cl)C2)C1 1840183314 XUIFNHJPZSJPCS-FQEVSTJZSA-N 488.372 0.831 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840183645 QYCFFFHHJLKJIQ-QHCPKHFHSA-N 462.547 0.067 50 20 JCGD CSCC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1840194778 FEJXCKAESYVVRS-JKIFEVAISA-N 453.399 0.588 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCn2c(=O)n(C)c3ccccc32)cc1 14329289 RPLLIIJPKZOJMF-UHFFFAOYSA-N 459.528 0.507 50 20 JCGD O=C(CN1CCN(S(=O)(=O)c2ccc(F)cc2F)CC1)NNC(=O)c1ccc(F)cc1 15486930 LJBISPYJSPZGAK-UHFFFAOYSA-N 456.446 0.871 50 20 JCGD Cc1cc(=O)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nn1-c1cccc(C(F)(F)F)c1 16786267 MFELVEGVBNYWMY-NSHDSACASA-N 458.418 0.755 50 20 JCGD CN(C)N(C(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)[C@@H]1CCS(=O)(=O)C1 728178213 FIFZODXZXOOPMG-OAHLLOKOSA-N 454.574 0.340 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)C1CCN(c2ncccn2)CC1 728890363 NTYUOGOKQLRPDF-UHFFFAOYSA-N 458.953 0.534 50 20 JCGD C[C@@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)C1 731219044 QNVLWIXTFTZBFN-SJLPKXTDSA-N 469.550 0.329 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN(C(=O)C2CC2)C1)c1cccc(S(=O)(=O)N2CCOCC2)c1 749464441 WHPAPNICMGHYON-KRWDZBQOSA-N 464.544 0.117 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccc(Cl)n1)c(=O)n2Cc1ccccc1 749567757 ZZLKUHBBDWZBOR-UHFFFAOYSA-N 481.900 0.938 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cc(C)no1)N(S(C)(=O)=O)CC2 753136033 NNULNFBZFGIRCV-AWEZNQCLSA-N 452.489 0.710 50 20 JCGD O=C(COC(=O)CSc1nnc(-c2ccco2)o1)NNC(=O)[C@H]1COc2ccccc2O1 783145209 KYPJKIBHLGKHSS-CQSZACIVSA-N 460.424 0.952 50 20 JCGD COc1ccc([C@@H](CNC(=O)NN[C@@]2(C)CCS(=O)(=O)C2)N2CCOCC2)cc1OC 915894527 CFBVZDZBXJKQFG-UZLBHIALSA-N 456.565 0.458 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccccn1)c(=O)n2Cc1ccccc1 916333363 KKWAPWXVJCUEHQ-UHFFFAOYSA-N 461.482 0.600 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc(N4CCCC4)nc3)nc2)CC1 916389322 XAJFVLJXPJNUIY-UHFFFAOYSA-N 474.591 0.839 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c1 916513951 WOFVJBUKBUFTPF-UHFFFAOYSA-N 492.577 0.842 50 20 JCGD CCN(Cc1ccccc1)C(=O)CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 920051104 JDGSPEBNLVNBEU-UHFFFAOYSA-N 489.602 0.693 50 20 JCGD CSCC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)CN1CCCC1=O 920827928 ZSMONZMLLKOKLN-IVOILVROSA-N 454.574 0.468 50 20 JCGD CCCn1nc(C(=O)NNC(=O)C2CCN(c3ccc4nncn4n3)CC2)c2ccccc2c1=O 934075777 DYQYOVQHVKZNQZ-UHFFFAOYSA-N 475.513 0.922 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1S(=O)(=O)N1CCOCC1 1115819730 WCIYMYSRQVJOKG-GOSISDBHSA-N 477.495 0.317 50 20 JCGD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)[C@H]1COc2ccccc2O1 1317699952 ZEOBFHDJCUCRKJ-MRXNPFEDSA-N 467.525 0.299 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C2CCN(S(C)(=O)=O)CC2)cc1 1321497232 DFDBMUZIXNTBAD-UHFFFAOYSA-N 452.562 0.540 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)CCc3nc(N)n[nH]3)C2)C1 1778849346 FPZLITVMUIBNIO-NRFANRHFSA-N 487.473 0.297 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034198 OTSGXFLNZZPWJL-QMHKHESXSA-N 452.515 0.402 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)nc(O)n3)CCO2)C1 1780097664 DGUOLHAVHIYLPQ-NRFANRHFSA-N 487.425 0.479 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)c1cccc(Cl)c1 1780929461 NOQNYBDGIXKCTG-SQGPQFPESA-N 458.342 0.947 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780937099 DSFPMBSXOMETAP-OALUTQOASA-N 475.398 0.958 50 20 JCGD CC[S@@](=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968899 QVRPSRHHMBDGFY-GRMGDBHTSA-N 493.630 0.321 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc2nccn12 1781315665 PBXHFLBCRCDVAN-HYBUGGRVSA-N 462.315 0.455 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1 1782171745 CWDXZZWCFKEFHJ-BASYENTBSA-N 453.989 0.082 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1783176739 AQMISSWTCJYINB-YEJXKQKISA-N 462.459 0.488 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)CCO2)C1 1783533791 JFMPJWDGWYUXDU-MPBGBICISA-N 489.330 0.798 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1ccc3ncccc3c1)CCO2 1783933154 CONRMZNKILYUHV-XMMPIXPASA-N 453.543 0.980 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CC(O)C3)C[C@@H]21 1785075542 ORTGPFUCAGIFIV-OEFHRGAISA-N 459.971 0.869 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1785102903 HXRZKSRVAAVLKV-QHCPKHFHSA-N 451.288 0.082 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4c(c3)NC(=O)CS4)[C@H]2C1 1790454694 GTQMUGSLVYUPNM-QRTARXTBSA-N 490.586 0.092 50 20 JCGD CC(C)Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)n(C)n1 1791289102 KLFCCFKSHPZLRN-QRFRQXIXSA-N 462.595 0.585 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncncc4c3)C[C@@H]21 1791291547 XXWAFYXULKOUME-QRFRQXIXSA-N 454.531 0.596 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1793053142 OYFFMSDRUWUPGI-FTUNRGFVSA-N 496.333 0.882 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)ccc(F)c1F 1793644172 OGXLBPVWAPTEOT-OYHTYJOISA-N 477.443 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn(-c2ccccc2)c2c1COC2 1796099192 DIVZOZOJBLHOIG-GPVSGQMNSA-N 496.568 0.479 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C)cc(C(N)=O)cc1C)C2 1796442172 UPTABAVKDWQCMJ-MXXHGQMLSA-N 494.552 0.740 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2cncc12 1797521660 XZLLRAQHXYJBSN-IHBLFXCCSA-N 463.498 0.672 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797752954 NUZOFGQSIWWCDC-VTEUUUEMSA-N 497.512 0.176 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1n[nH]c2cc(Cl)ccc12 1799079188 FJPPDVZAKOLKKL-NGVSDPCNSA-N 497.943 0.661 50 20 JCGD Cc1n[nH]cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097533 OGLSMIPJIJLUOA-RMFSNUHRSA-N 469.546 0.268 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)CCOC1 1799349293 SKJANKFKEVKKIU-IMDDZUEWSA-N 494.358 0.950 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1c[nH]c(=O)cn1)NC(=O)NCc1ccccc1 1799354383 DJZWZMXDJDYCJA-BCDXTJNWSA-N 467.530 0.368 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CSC(=N)N)C2)NC(=O)NCc1ccccc1 1799864771 NPOWNSCPQMXITH-BJWYYQGGSA-N 461.592 0.597 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2 1800979044 PJJMAFXIKITUAB-NDPMZMCLSA-N 455.851 0.781 50 20 JCGD CN(C)c1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1801195959 XWOAGUQIALDKMO-FEJSZKPUSA-N 480.569 0.587 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1801880394 HKGWSKRHTIRDJS-YRPNKDGESA-N 483.374 0.875 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN2CCSCC2)[C@H]1c1cccnc1 1802445699 DFQPFMVYCLSWTN-LAUBAEHRSA-N 483.598 0.449 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc(O)nc(O)c3C2)[C@H]1c1cccnc1)[C@@H](O)CCl 1803141128 LOTKEXBUZUXQOX-GLFJAGTFSA-N 475.933 0.693 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1 1804042759 KFUKNZDDSWAZOI-HOCLYGCPSA-N 497.210 0.436 50 20 JCGD O=C(COc1cccnc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804332897 HQCKFQYCPVCYDC-CVDCTZTESA-N 460.299 0.555 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C1)C(=O)NC[C@H]2C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1804462429 KYQQSGGMNFZRMX-IAUVJCGVSA-N 499.008 0.598 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)CC1 1806536150 VWUZSKUAUPOXKU-UHFFFAOYSA-N 474.216 0.566 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCCC3(CCN(C(=O)[C@@H](F)Cl)CC3)C2)n(C)c1=O 1806897466 DQZCMLLTGBNCFB-OAHLLOKOSA-N 468.917 0.199 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1nc[nH]c1[N+](=O)[O-] 1808368116 NEWWXBVXFJKCFJ-CRAIPNDOSA-N 464.247 0.026 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(C)C 1810100334 ITINAGHLMQQLNF-BVSLBCMMSA-N 467.331 0.669 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1 1810302567 LSVHDAFZSJEXAN-CXAGYDPISA-N 476.440 0.510 50 20 JCGD Cc1cnn([C@H](C)C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1813380319 STJMOZGXMAKHHP-AGHHOFFYSA-N 461.331 0.847 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813411350 KDPKQWSJFKGNPX-PIPMEXSNSA-N 461.331 0.614 50 20 JCGD COC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1 1819610061 WRSLFJTWOBTLIV-KBRXJYTESA-N 486.533 0.687 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)N1CCN(C)CC1 1820789656 IMEOHDAKJGWRFT-AEFFLSMTSA-N 462.599 0.411 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCCCC2=O)n[nH]1 1822302198 IVDNWFVXEUZQOF-KRWDZBQOSA-N 468.518 0.727 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057406 DPRVDFSVRADRPY-UWJYYQICSA-N 465.363 0.890 50 20 JCGD Cn1cnc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCN3C(=O)OCc2ccccc2)n1 1828548622 MBDLTANATRZWJB-VGSWGCGISA-N 490.948 0.481 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])CC1 1828926667 NKJWOOCSOXYKQS-MRXNPFEDSA-N 470.490 0.864 50 20 JCGD O=C(c1nc[nH]n1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829034002 PWCCIWFWXQQPQW-KKSFZXQISA-N 476.921 0.470 50 20 JCGD O=C(CCOc1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830254304 JDGOMRGGSSCPMV-DEOSSOPVSA-N 486.305 0.045 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)CCO2 1830885283 ABEJFYSPUVWUTB-GCKMJXCFSA-N 477.986 0.736 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1831647102 QLDUSDOGXOYUCC-PXNSSMCTSA-N 480.027 0.522 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831874511 JVFBNTJJVVDNLG-GOSISDBHSA-N 452.600 0.352 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1 1832147566 BYKAVVDXZANYOQ-GOSISDBHSA-N 457.365 0.510 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1 1833902529 QJGXEAHPGXWPBV-UGSOOPFHSA-N 459.341 0.984 50 20 JCGD CC(C)c1nc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)co1 1833926353 CONKXZWOGBVUQK-UHFFFAOYSA-N 468.363 0.977 50 20 JCGD O=C(CCN1CCCCC1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834529278 CJDVDCZOVVCENY-UHFFFAOYSA-N 470.423 0.428 50 20 JCGD Cc1ccc(O)c(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834798329 IRFJQFWMCBUMGL-UHFFFAOYSA-N 465.359 0.879 50 20 JCGD CSc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798350 KSFBMYXFCNAOCU-UHFFFAOYSA-N 482.415 0.982 50 20 JCGD CN1CCN(C2(C(=O)N3CCOC[C@]4(CN(C(=O)CCBr)CCO4)C3)CC2)CC1 1834824182 VIHDIRANKZASJY-IBGZPJMESA-N 473.412 0.008 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C3CC(O)C3)CC2)CC1 1835116448 OPCCISMENCEIEJ-CVKSISIWSA-N 458.563 0.463 50 20 JCGD CC(C)n1cnc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1835205801 RCKGNNKCXRRLGG-UHFFFAOYSA-N 462.599 0.417 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc(C)c1C(=O)O 1835932124 OWXAKIWQQZEOKV-RUZDIDTESA-N 496.325 0.065 50 20 JCGD Cc1ccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)s1 1835934164 NSKSYSGOVFKISY-UPWIVDSGSA-N 470.356 0.520 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4c(F)cc(F)cc4[nH]3)C2)C1 1835936753 BLHZXCVUXILDNI-XMMPIXPASA-N 499.279 0.510 50 20 JCGD COC(OC)C(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1836788947 LSDPDYYCKCETSG-BUVRLJJBSA-N 463.535 0.738 50 20 JCGD CCc1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456980 RPHNJCYONHIKET-HSZRJFAPSA-N 468.514 0.026 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)C#CC3(O)CCCCC3)CCO2)C1 1837490447 FDAURQRGAUGYCB-JOCHJYFZSA-N 452.624 0.993 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1 1837919350 ZYIFJWCITVPFJB-UHFFFAOYSA-N 470.291 0.529 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnco3)C2)C1 1838526767 CDPDSZBUQDOQJD-OAQYLSRUSA-N 474.426 0.892 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838721505 SKCPSNRJINULGR-FOCLMDBBSA-N 451.568 0.398 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn(-c3ccccc3)n1)CCO2 1838746423 FADNCAICEBMWOY-DEOSSOPVSA-N 484.557 0.315 50 20 JCGD COc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)ccc1[N+](=O)[O-] 1839136252 PHSZNNOJRKKLML-OXQOHEQNSA-N 471.894 0.202 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)c(C#N)c3)CCO2)C1 1839188122 LYMBEDUKKIXBNZ-LAUBAEHRSA-N 453.898 0.950 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199789 UUELMTLYRYATDK-LXIYXOSZSA-N 498.346 0.019 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200950 SRBIMCVINSABCB-GUYCJALGSA-N 459.272 0.167 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839752734 RFZXIWJRCGINLZ-OXQOHEQNSA-N 461.342 0.947 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1839966151 VXFKSPWTGVCJQO-OXQOHEQNSA-N 480.363 0.902 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(C)cc(C(N)=O)cc3C)C2)C1 1840153537 SCZBMUYJCBNYQQ-HTAPYJJXSA-N 467.950 0.726 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840184713 CAKDHASYXHJOHS-CYFREDJKSA-N 460.575 0.928 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C2)C1 1840186906 GBTSHYODVUBWIR-WCYCAPIHSA-N 489.529 0.437 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840895516 WPZZQZAWMUHCJO-SFHVURJKSA-N 464.009 0.568 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844279917 GMINDLLQQMSTJF-GOSISDBHSA-N 480.573 0.827 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OC)C(C)C)C2 1846364002 QXOJAUKPLCYRLQ-ULQDDVLXSA-N 486.997 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(C2CCCC2)C1 1848040142 FWJCBXCXWDHCAS-CCKFTAQKSA-N 454.531 0.292 50 20 JCGD CCn1nc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(OC)cc3)C2=O)c2ccccc2c1=O 17189135 MNXAULXVSMNIFD-DEOSSOPVSA-N 492.492 0.653 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(F)cc2Br)cn1C 725888146 HWUFENFFBDPULI-UHFFFAOYSA-N 462.301 0.760 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)c2ccccc2c1=O 726282875 UGUYYZWTKLDGSS-QHCPKHFHSA-N 477.481 0.615 50 20 JCGD CNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 728214980 WNKKMMCDMHMMHE-UHFFFAOYSA-N 467.573 0.288 50 20 JCGD CCOC(=O)C1=NN(c2ccccc2)[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1 728633915 QOXASICUHUPJEK-PXNSSMCTSA-N 496.476 0.715 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F 729845901 XJCPSKJBJSFDFR-UHFFFAOYSA-N 480.497 0.873 50 20 JCGD CS(=O)(=O)CCCC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 731186790 VEBSFYBKIXXCOM-UHFFFAOYSA-N 453.542 0.751 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)CN(C)C(C)C)c(=O)n2Cc1ccccc1 742787688 UJEYYRUSHHSAFM-UHFFFAOYSA-N 483.573 0.552 50 20 JCGD CS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 873921822 ZXCUJHLPYHMAFP-UHFFFAOYSA-N 487.581 0.498 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1 906470457 AWRWKIANJLMDLU-OAHLLOKOSA-N 490.538 0.434 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)cc1 918781118 JGAHTVVZMFRDDB-KRWDZBQOSA-N 488.522 0.892 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H](CC(=O)N(C)C)c3ccccc3)nc2)CC1 920046146 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COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1 1783872811 HQKNBWOFTLKFLH-DNVCBOLYSA-N 459.952 0.324 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1)n1cnnn1 1784603891 SKBINMHCTOORRJ-MYXQPPCBSA-N 457.441 0.949 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785576118 HEUWUPQPYUICDL-GAJHUEQPSA-N 479.578 0.106 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(N2CCOCC2)cn1 1785721223 BQDUNXLOMUEGAO-CBVHJVASSA-N 452.939 0.111 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc[nH]3)[C@H]2C1)NC(=O)NCc1ccccc1 1785783672 FBHIFWLTXOBIOC-FHWLQOOXSA-N 469.546 0.349 50 20 JCGD CCc1c(Br)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)nn1C 1787163795 LNWBCHGEECALPK-IMIFBBOLSA-N 477.787 0.938 50 20 JCGD CCS(=O)(=O)CC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1 1789519697 FPJBBHABTKEMCT-UHFFFAOYSA-N 459.528 0.868 50 20 JCGD 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JCGD COc1cccc(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1804399477 OOEYVPYKRXNSSP-NTKDMRAZSA-N 474.326 0.727 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1C 1805590962 IUDSHPBDUSMKQN-OXJNMPFZSA-N 462.514 0.755 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807154996 GSQSUPRZGSUQIG-KPDCDPCYSA-N 473.342 0.977 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807367894 OLBAUEMEPSZHBA-DENIHFKCSA-N 496.373 0.996 50 20 JCGD CN(C)CC(=O)N1CC[C@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1807454722 WVWOPUXHRZTVGL-QPPBQGQZSA-N 481.601 0.995 50 20 JCGD COCCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1 1808659511 LJOQZONWZZAZEV-AVRDEDQJSA-N 471.562 0.617 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1 1809333193 HQYHQWYXWZLZOH-UWJYYQICSA-N 464.530 0.817 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCCNC3=O)[C@@H]1c1cccnc1 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CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cocn3)C2)C1)NC(=O)NCc1ccccc1 1839054017 BZROVVCIUWWBNS-QHCPKHFHSA-N 486.529 0.091 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1839153453 IHAVSDGUYIEVEZ-ROUUACIJSA-N 461.302 0.481 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CCO2 1839388242 LLCLKNJJWBUSES-VEVIJQCQSA-N 480.356 0.069 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1839638006 ABRAECUCLOTSBY-HYFFOGBASA-N 491.029 0.915 50 20 JCGD O=C(CCc1ccc(F)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840053259 BWKPMDKDEWVPSS-DEOSSOPVSA-N 470.306 0.208 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1 1840075521 NQVABSDQRMQASI-LNJOJYBOSA-N 492.548 0.677 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1 1840152663 PFPPYHSLPJVJMO-QRWLVFNGSA-N 466.926 0.065 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](NC(C)=O)c3ccc(F)cc3)C2)C1 1840154279 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Cc1nc(C)c(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)s1 731123358 CMSFGRKHUFIDTC-UHFFFAOYSA-N 453.594 0.960 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)cc1 751208609 GRRDDEBSXCWARO-UHFFFAOYSA-N 492.579 0.929 50 20 JCGD Cc1cc2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)c(C)n2n1 818798358 IVGCAPJJNNVZKN-UHFFFAOYSA-N 458.500 0.442 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 873822209 YTCCQGXPGQGDPZ-BRWVUGGUSA-N 496.611 0.605 50 20 JCGD C[C@@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)OCC(=O)NNC(=O)c1ccccc1 914633525 ZSRQEMAYCSCPND-QHCPKHFHSA-N 450.451 0.990 50 20 JCGD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2)[nH]1 914688274 RUAGSSBJFVUCPD-GOSISDBHSA-N 452.423 0.482 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1ccc(S(=O)(=O)N(C)CCO)cc1 915473120 JDKSNFUUOUMJAI-UHFFFAOYSA-N 499.929 0.579 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc1 916391616 HZFDJRRPABXHKT-INIZCTEOSA-N 483.525 0.955 50 20 JCGD Cc1c(/C=C(\C#N)C(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc(C#N)n1C 918571785 MFQRRNKXXPFLTK-CPNJWEJPSA-N 467.555 0.775 50 20 JCGD CN(C)C(=O)CNC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O 918717281 SYQSLDYSBBFCNU-UHFFFAOYSA-N 465.557 0.068 50 20 JCGD CCCOc1ccc(C(=O)NNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC 918779266 JNFDRVCZNJZDMT-UHFFFAOYSA-N 454.447 0.749 50 20 JCGD CCn1c(SCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)nnc1-c1ccccc1C 919884412 IQYDBBCIOBCEMO-ZDUSSCGKSA-N 452.562 0.883 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O)N[C@@H]1CCS(=O)(=O)C1 919886948 YAXUGJGGLORLRD-MRXNPFEDSA-N 470.507 0.656 50 20 JCGD CCCn1nc(C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@H](C(N)=O)C2)c2ccccc2c1=O 934079996 JUAGVSAPDQCAAX-SFHVURJKSA-N 479.472 0.827 50 20 JCGD NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=O)CC12CC3CC(CC(C3)C1)C2 935518746 GSYVTNYGEHALDV-UHFFFAOYSA-N 462.528 0.996 50 20 JCGD O=C(NC[C@@H]1CCS(=O)(=O)C1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 1321718053 JNCVPRLMSZKGQA-INIZCTEOSA-N 469.523 0.824 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ncn(-c3ccccc3)n2)C1 1778184863 IQORVODBJYJZBC-NTKDMRAZSA-N 483.573 0.768 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(C4CCN(C(C)=O)CC4)CC3)C2)C1 1778321578 ZCTMOMOYFXOGRH-URXFXBBRSA-N 499.052 0.793 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCC=CO3)C2)C1)NC(=O)NCc1ccccc1 1778992367 RNYQDAVMUQSKIZ-RDPSFJRHSA-N 471.558 0.855 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1F 1779028523 FUYSUNOLQQTVOG-QFIPXVFZSA-N 457.462 0.590 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(Cl)CCl)C2 1779203730 ONDPJZMCEGAOMG-AXYPVASZSA-N 454.351 0.801 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cccnc1)C2 1779371002 FQPCGBDGJCMTHO-OHNKKSECSA-N 464.526 0.921 50 20 JCGD CCNC(=S)NCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780098914 XSRDDUBYWGQXMM-NRFANRHFSA-N 493.542 0.448 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 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O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2nonc2c1 1809125007 CKQRXJMYQWIIAL-PGRDOPGGSA-N 471.282 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1 1810298229 HFERUTVHSBQMOT-JXFKEZNVSA-N 461.482 0.347 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813020441 CKUPTAWXWXXOMP-KZKAQZJJSA-N 491.353 0.836 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1 1813351031 LZFXYVJVXLTWBL-KXBFYZLASA-N 460.564 0.371 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)C(=O)OC(C)(C)C 1814234705 MXUFIPBSLAYHFE-HNNXBMFYSA-N 488.375 0.916 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1 1814863687 AALGYFKASKNGAS-RDBSUJKOSA-N 459.931 0.887 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(Cl)nc1)CC2)c1ccc(B(O)O)cc1 1815335756 OLZCSVIHLJMJQM-ZDUSSCGKSA-N 457.708 0.806 50 20 JCGD COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1 1815343719 LGAYJLGWSIIOBE-ZDUSSCGKSA-N 453.289 0.161 50 20 JCGD C[C@@](O)(C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(F)(F)F 1815350343 ROHBEDUXIAEPKF-APPDUMDISA-N 457.239 0.362 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnnn1C)CC2 1817277579 YJQSYJGNKPSXLY-IVWJEFBKSA-N 455.504 0.631 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc(O)c([N+](=O)[O-])c1 1823223772 JIWGPQKGBJUBPT-CQSZACIVSA-N 482.283 0.976 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3nc4ccc(F)cn4n3)sc2C1)c1cccc(B(O)O)c1 1824390039 LQKJDZBZDHCDFV-AWEZNQCLSA-N 480.290 0.544 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3CC(c4ccccc4)=NN3)sc2C1)c1ccc(B(O)O)cc1 1824435275 ZMTNQBPXSACJHU-PXNSSMCTSA-N 489.366 0.815 50 20 JCGD Cn1nc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)cc1O 1825458587 UZPNPNSWFXBZJJ-SFHVURJKSA-N 455.519 0.671 50 20 JCGD COC(=O)C12CC(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)CC3)(C1)C2 1827053099 BWJMBQJCXYCUIT-LXKSKSEUSA-N 468.359 0.943 50 20 JCGD COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1828861308 NJIGRZHLVOWICI-RUZDIDTESA-N 495.341 0.079 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)C1 1830716105 UDVPNAUHYPJOBR-CSODHUTKSA-N 456.612 0.884 50 20 JCGD N#Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccc1Br 1830733332 IPXUQQYRPXOIKJ-QFBILLFUSA-N 486.750 0.990 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830737659 GOKFUKDRCFAPKR-FVMGUFKOSA-N 487.981 0.440 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832793135 DWTLLIYXMVQTGW-DYVFJYSZSA-N 474.312 0.279 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3C(=O)CNC3=O)CC2)CC1 1833678012 QAJSLRYLSTXZMJ-IBGZPJMESA-N 462.378 0.346 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCSC(=N)N)CCO2)C1 1835656264 HSNRBLBJDKQNSY-LRDDRELGSA-N 451.387 0.633 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccn4ccnc4c3)CC2)CC1 1835737841 GRWDVIYEZQWEIK-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836775712 ARNNHKINBWZBOO-VBKZILBWSA-N 498.378 0.118 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1837117715 QFXSVEFOMNDJJS-CABCVRRESA-N 473.368 0.757 50 20 JCGD O=C(c1ccc2ncnn2c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837170369 OPSXQYVUJYWLDV-RHSMWYFYSA-N 456.272 0.490 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(=O)n3O)CC2)CC1 1837285110 DVGGZEUECVTBKU-UHFFFAOYSA-N 484.513 0.010 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1O 1837459574 KRFOVIFNUSREJY-QHCPKHFHSA-N 469.498 0.083 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC4(CCC4)C3)C2)C1 1837461292 SPAJJQIYMNTQFF-QHCPKHFHSA-N 457.531 0.335 50 20 JCGD NC(=O)[C@@H](N)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1837882330 XHFYTLCTLLSMFT-DZGCQCFKSA-N 451.337 0.268 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCO3)C2)C1 1838528183 KEJIQAMBNNDGOM-KNQAVFIVSA-N 477.470 0.769 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201642 DISPNDJUPHDAON-KBXCAEBGSA-N 458.284 0.546 50 20 JCGD O=C(c1ccc2nn[nH]c2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203058 YIDNOFWAVSJPIB-YOEHRIQHSA-N 456.272 0.718 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839518609 UTXHZYFEXQLMRE-OALUTQOASA-N 461.346 0.972 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3ccoc3c1)CCO2 1839535161 LXLJQWLLFOWPHC-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)cnc2c1 1840033200 XKEMTQVXWAOFNW-QVKFZJNVSA-N 493.358 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(F)cc4)CC3)C2)C1 1840182777 UDVBGNMPRGLHOS-QHCPKHFHSA-N 476.549 0.687 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1 1840184518 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TXSRSOYROSDZKH-UHFFFAOYSA-N 493.494 0.528 50 20 JCGD CCCN(CCC)S(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 729341753 SCEODANPDFUGRX-OAHLLOKOSA-N 460.578 0.628 50 20 JCGD Cc1ccc(-c2nnn(CC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)n2)cc1 730471593 RTYKLUJJMBMMBX-QGZVFWFLSA-N 452.427 0.179 50 20 JCGD O=C(NNS(=O)(=O)c1cc(Br)cc([N+](=O)[O-])c1)N[C@@H]1CCS(=O)(=O)C1 731178788 RDNCTZCJXDLPSL-MRVPVSSYSA-N 457.284 0.037 50 20 JCGD CCOc1ccc(S(=O)(=O)N[C@@H](CCSC)C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1 732307170 AWBPBZAFRBJWBV-BBRMVZONSA-N 493.629 0.067 50 20 JCGD Cc1ccc(S(=O)(=O)Oc2ccc(S(=O)(=O)NNC(=O)N3CCOCC3)cc2)cc1 745833945 IKKYEBMUJUQDQU-UHFFFAOYSA-N 455.514 0.998 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1)C(=O)N1CCCC1 748241367 YDHGUKMWBGLZEH-UHFFFAOYSA-N 450.542 0.653 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2cccs2)cc1 782179741 XMBGXOWEDUPEGJ-UHFFFAOYSA-N 453.498 0.624 50 20 JCGD Cc1cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)ccc1-n1cnnn1 914749994 GXDPLJKFUOKWSL-UHFFFAOYSA-N 499.553 0.385 50 20 JCGD Cc1nnc(O)c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1C 915133558 QWDSPBMLYCFLTD-UHFFFAOYSA-N 463.516 0.214 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CCn1ccccc1=O)N(S(C)(=O)=O)CC2 916159590 VFIAHKMEYFOWHA-KRWDZBQOSA-N 492.554 0.352 50 20 JCGD C[C@@H]1CCCN([C@H](C)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1 916450427 NURBOJVUYIDMKS-IAGOWNOFSA-N 453.613 0.764 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)cc1 916649013 GUQVJGKFPNTORK-UHFFFAOYSA-N 451.461 0.664 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C(/C)C1CC1)c(=O)n2Cc1ccccc1 918017219 RPFHJDXFHAZSQO-PTNGSMBKSA-N 450.499 0.932 50 20 JCGD CN(C)S(=O)(=O)c1ccc(NCCO)c(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1 918058606 VECYYLFQRCPBEM-UHFFFAOYSA-N 498.945 0.613 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cccc4ncsc34)C2)C1 1778649390 YGHPAPIQESWIKF-QFIPXVFZSA-N 451.313 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cnccc4c3)CCO2)C1 1779030918 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NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(C(F)F)c3)[C@H]2C1 1785523634 HRCRCBHDPXKMCY-OWQGQXMQSA-N 474.468 0.925 50 20 JCGD CN(CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)C(=O)OC(C)(C)C 1785586291 QWMCBVQGAFQBQU-XMMPIXPASA-N 489.378 0.457 50 20 JCGD CC(C)n1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1C(=O)O 1785720063 WSVMLYCRJSPOKX-MPGHIAIKSA-N 478.550 0.129 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccc([N+](=O)[O-])c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980161 PIFKWWUQRCSNSB-NYVOZVTQSA-N 481.314 0.501 50 20 JCGD CC(C)(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)c1ccccn1 1786983803 SWGCUNMYJWBRPO-IHPCNDPISA-N 451.332 0.333 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)nc(O)n3)[C@H]2C1 1787435629 KNFYBAVFJDVYAG-JURCDPSOSA-N 499.952 0.613 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3cccn3C)C[C@@H]21 1787508206 PRPHWJQAQHMUIN-GDJYOZILSA-N 468.514 0.322 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NO[C@H](c4ccccc4)C3)[C@H]2C1 1788143191 QBJRIYWHPYVQEU-QIJZPMMNSA-N 471.558 0.857 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1)[C@@H]1SC(=N)NC1=O 1788762523 DMFFTYHZJUSMBW-BLDNINTCSA-N 456.641 0.620 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnn4n3)[C@H]2C1 1789141947 FBJMHCHVCZIDJB-MDUUWBQSSA-N 478.513 0.457 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc2cc[nH]c2cc1F 1789251669 VXBNWJMVPVXJPW-BPXKWBHBSA-N 465.290 0.894 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C#N)c[nH]3)[C@H]2C1 1789344824 HPTUGKSCYJCKAA-RBFTXDQOSA-N 451.487 0.614 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1OC 1791287887 ASZUQMCSGRTZDH-IPJJNNNSSA-N 490.601 0.989 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccc2c(F)cccc21 1792928865 OGSPRPWZFAUZII-RSQQPWMTSA-N 459.522 0.743 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1 1796185761 LIZBROYIWIOSKO-REPLKXPHSA-N 456.329 0.336 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796368084 CBHNLUKLJJQMRU-AICCOOGYSA-N 499.989 0.438 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3nccc3c1)C2 1796441983 LVMIAIQPASVXOG-KEMUROEHSA-N 463.498 0.672 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1cccc1)C2 1796445504 CLEADQJPEVFYOZ-JBUXMVGSSA-N 454.531 0.992 50 20 JCGD C[C@H](Sc1cccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1797596591 GNDJHONIWLGUSM-AMVTXUCVSA-N 460.386 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(Cc2ccccc2)CCO1 1797856346 QLEPJFAYFMUCOI-VLVHOKLOSA-N 492.580 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncn(-c3cccc(F)c3)n1)C2 1798440682 JWNYNJNLTUKMRU-ACHSLPGTSA-N 478.488 0.971 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)[S@](=O)c1ccccc1 1800213261 UERUCACFTZEKLT-PDNGSJIUSA-N 499.593 0.906 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1800320884 ABPQZUTZZFRFRK-RXHHHXIQSA-N 464.872 0.987 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1ccc(C)cc1 1802118885 VQEGKOUCMJMQJS-IIMWNBLQSA-N 494.552 0.448 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H](O)CN1C(=O)OCc1ccccc1)[C@H](O)CCl 1804189270 FUDQPQGESQRLOF-DWIKVQACSA-N 479.961 0.996 50 20 JCGD CCCNC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807359947 NKYVZOKWJMGGOG-WMZHIEFXSA-N 466.347 0.387 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccn3c(O)nnc23)[C@H]1c1cccnc1 1808194913 SBHMPCFBELSZOT-OXJNMPFZSA-N 480.529 0.523 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810307529 DNAWUKQFZVCHRZ-HGHGUNKESA-N 476.541 0.933 50 20 JCGD Cn1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1Cl 1811166755 FVLDRHOUGLIBTF-LPHOPBHVSA-N 467.722 0.782 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnn2c1OCCC2 1812117839 QOUMIEZPHJZZIN-WIYYLYMNSA-N 475.314 0.374 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CS(=O)(=O)N2CCCC2)[C@@H]1c1cccnc1 1813030561 JJCRJCYRELABRM-ZIFCJYIRSA-N 472.995 0.767 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)Cc2cccnc2)[C@H]1c1cccnc1 1813071948 ZXIYWOCCASYHIQ-JTAQYXEDSA-N 467.574 0.425 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1 1813188506 XBJCPFTZVJUEBI-QUJKESNLSA-N 466.542 0.951 50 20 JCGD Cc1cc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1C 1815335699 LEMPCZJLLMPBGN-HNNXBMFYSA-N 453.333 0.333 50 20 JCGD Cc1cc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1C 1815335700 LEMPCZJLLMPBGN-OAHLLOKOSA-N 453.333 0.333 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc3cccnn3n1)CC2)c1cccc(B(O)O)c1 1815360655 LNCVBVIADFZNTE-CQSZACIVSA-N 462.300 0.405 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCC(=O)N1)CC2 1817280423 VRMLGKBILKYFGT-FMICNJIVSA-N 457.516 0.468 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cn1 1819797206 PLGLJRZYWBYEFY-LBPRGKRZSA-N 495.521 0.863 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4c3OCCC4)sc2C1 1824001776 SCCZKHSQFPPAHI-GFCCVEGCSA-N 461.548 0.721 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052329 VLRQWORWQYDNKS-UWJYYQICSA-N 453.352 0.528 50 20 JCGD N=C1NCCN1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829051951 GBPDMHWGAOWYOF-PGRDOPGGSA-N 494.955 0.813 50 20 JCGD CC(=O)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829300620 GZNHSGWQFONOGI-PGRDOPGGSA-N 480.949 0.174 50 20 JCGD CC[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1830513347 CIPOOUWIAZZUEF-MDOVXXIYSA-N 463.959 0.346 50 20 JCGD O=C(c1nc2ccc(C(F)(F)F)cn2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830723246 MQBUFNFMKZHQCZ-SCLBCKFNSA-N 491.854 0.418 50 20 JCGD O=C(c1cn2cc(Cl)ccc2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728096 OYEFEJUILDVKAS-DNVCBOLYSA-N 457.314 0.657 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830735742 MLTFQPZWUIRFDI-QFBILLFUSA-N 459.858 0.333 50 20 JCGD O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1832361669 XYMGDNRSZHYRFL-GZRFBZBPSA-N 490.370 0.924 50 20 JCGD C[C@@H](S)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551422 NSMUZZUXPKJFCU-BIENJYKASA-N 466.000 0.893 50 20 JCGD O=C(c1cnc(OCF)cn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1833573249 ZHAVKLMKRQAZIY-CZUORRHYSA-N 465.251 0.543 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1833587823 GRSSWXWDNGBWSK-HSZRJFAPSA-N 485.545 0.020 50 20 JCGD Cc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1F 1834020430 JGVQKKYNJFWBTL-UHFFFAOYSA-N 451.547 0.415 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)/C=N/O[C@H]3CCCCO3)CC2)CC1)c1cccc(B(O)O)c1 1834801336 YPTDLXJAXLVOMD-OINMWHHXSA-N 486.378 0.081 50 20 JCGD CO[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1834925819 YAPAJVWELCPITM-HYBUGGRVSA-N 483.525 0.143 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCCNC4=O)CC2)CC1 1835516137 WHLPTHAEOYMNKI-AWEZNQCLSA-N 495.422 0.985 50 20 JCGD COCC1(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1835734928 YQCVFRFXCSQRMZ-UHFFFAOYSA-N 458.563 0.297 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1sc(N)nc1C)CCO2 1835803497 KNGXAZBWDBHUBT-PFRKPPGBSA-N 489.558 0.238 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835847390 OHNOPRGSHASWCF-SFHVURJKSA-N 479.390 0.447 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc4ccccc34)C2)C1 1835930435 INXXNGPYRJPCDL-RUZDIDTESA-N 491.309 0.004 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1)N1CCN(C)CC1 1836372911 LWYCSZVNUXAZST-SJORKVTESA-N 472.472 0.977 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc4ncccn4n3)CC2)CC1 1837920397 UCFDQVORMLCGSM-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cncc(C(F)(F)F)c1)CCO2 1838181075 MTUIIVBVHGRQBL-NRFANRHFSA-N 493.247 0.164 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCOC3)CC2)CC1 1838395531 ZELMWSLOQNSKTN-INIZCTEOSA-N 459.547 0.724 50 20 JCGD COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)nn1 1838512763 NTJCQZOGUDVTQK-UHFFFAOYSA-N 462.551 0.470 50 20 JCGD COCc1c[nH]c(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)c1 1838515395 WWJZVIHCCHQDLX-LRULAXNGSA-N 486.529 0.365 50 20 JCGD O=C(CSc1nc[nH]n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203460 LTLGDVMMWYGBOX-FZMZJTMJSA-N 452.306 0.044 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1c(O)cc(O)cc1O)CCO2 1839371164 FRAUHTNXLJUINQ-GOSISDBHSA-N 459.293 0.658 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2)NC(=O)NCc1ccccc1 1840814871 JWMLUXKQNKMMMI-RUZDIDTESA-N 498.584 0.483 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1840854808 NZQMOHUIXHNQRZ-IPELMVKDSA-N 452.379 0.984 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265503 JNQAYGGACDVZDZ-MRXNPFEDSA-N 460.535 0.805 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2n[nH]c3c2CCc2ncccc2-3)C1 1844663035 RDDMCZHQGFNSFP-UHFFFAOYSA-N 457.299 0.381 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1 725872812 SCYRJQSIDLYSNR-UHFFFAOYSA-N 475.936 0.472 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)c1 726615079 ZUBRPEKIKGESOO-UHFFFAOYSA-N 476.511 0.934 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1ccc(Br)cc1Cl 728869812 DICVKADVWAIOLO-GXSJLCMTSA-N 478.752 0.899 50 20 JCGD CCC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 747409698 JMKOAUJYWJGADO-UHFFFAOYSA-N 496.567 0.679 50 20 JCGD CS(=O)(=O)C1(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CCCC1 749786346 NHWGXTCCGKQZTN-UHFFFAOYSA-N 487.600 0.145 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)cc1 756139218 YIXGCNRDNHIWQN-UHFFFAOYSA-N 477.543 0.740 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNS(=O)(=O)/C=C\c2ccccc2)n1 759781954 RDUROXRSTSLHFI-FPLPWBNLSA-N 452.514 0.275 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cccnc1OC)N(S(C)(=O)=O)CC2 910844726 LTBBCPCHRZMWGG-MRXNPFEDSA-N 478.527 0.818 50 20 JCGD Cn1cc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1C(=O)O 912979404 PESHGSZYTCDHBU-UHFFFAOYSA-N 456.502 0.131 50 20 JCGD O=C(NC[C@H](c1ccccc1)N1CCOCC1)NNC(=O)c1csc(N2CCOCC2)n1 913464972 HSTBXONMNSTJRM-GOSISDBHSA-N 460.560 0.997 50 20 JCGD COc1cc(C#N)cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779032162 DBFJLAJLXGILLK-HSZRJFAPSA-N 464.482 0.323 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779295113 YMDYZUQFPOJETC-IIBYNOLFSA-N 473.643 0.944 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)CCO2 1779296753 CQIGBEJGLKSXCZ-QFIPXVFZSA-N 484.589 0.866 50 20 JCGD Cn1nc2c(c1C(=O)N1CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C1)CCC2 1779374194 JVPNJPJQCVKCOJ-NTKDMRAZSA-N 481.557 0.349 50 20 JCGD CCn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)cc1C 1779833809 KMOATPWIIXUAKW-AUSIDOKSSA-N 469.546 0.651 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2c(F)cncc2F)C1 1779840694 FGGIAQUOMCNZPL-VGOFRKELSA-N 474.468 0.800 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097814 MIYICDXSLQRCBP-AVRDEDQJSA-N 492.485 0.115 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OCCCO)cc3)C2)C1 1780126582 NRMQZWLZOVKFBK-HSZRJFAPSA-N 462.547 0.264 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968270 ICKLIELRPGPSKS-HOYKHHGWSA-N 488.589 0.029 50 20 JCGD CCc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n(C)n1 1780968537 NCQCLXLYLXYVBJ-RUZDIDTESA-N 497.600 0.772 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1 1781552204 XRCHZYRAYAWMDP-NRFANRHFSA-N 457.223 0.171 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN(C(=O)OC(C)(C)C)C3)C2)C1 1783553480 ZEHGQVTTZAQNOO-HOYKHHGWSA-N 495.621 0.836 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCN(C)CC3)C[C@@H]21 1783968483 VISDBKXJJRSQFI-OWSLCNJRSA-N 459.429 0.635 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1 1784093810 GJIRRSLKUFKOMY-KANFNMMFSA-N 472.991 0.602 50 20 JCGD CC(C)(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)ccn1 1785558710 JDSRRGPDKYQTDM-JBACZVJFSA-N 465.359 0.966 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1785609252 WNJQKGHVEAKGOH-QTJFZDIUSA-N 495.404 0.821 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncsc3Br)C[C@@H]21)c1ccc(B(O)O)cc1 1786979705 ATHBFPCIJQBZGF-QEJZJMRPSA-N 494.176 0.493 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786985127 NDMUJTOEUCKNAK-AXHNFQJDSA-N 474.706 0.338 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)CC1 1786986884 PJGILBRSJIYQSZ-WDSOQIARSA-N 487.362 0.017 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4sc(N)nc4c3)C[C@@H]21 1788610492 BZAMFWKNAPTTFH-OWQGQXMQSA-N 495.565 0.784 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3coc([Si](C)(C)C)c3)C[C@@H]21 1791291296 RSYDOXRJXVIKKP-SZMVWBNQSA-N 464.639 0.791 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792978496 DPDJOLKZIMWRAB-KSWRQPAISA-N 459.971 0.823 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl)c1ncn2nc(N3CCOCC3)ccc12 1793109579 AWDDXHGCYVRKJL-IVSAIRAKSA-N 462.938 0.417 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794108694 PAWLESJSXVMIMM-ZRTFPUAOSA-N 483.363 0.613 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COC(=O)C(F)(F)F 1798340213 PQOSZMVIOHAUEG-AIUQWGENSA-N 457.409 0.864 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1799812511 PEASNDDLGRWQBL-MSPZUWAUSA-N 467.306 0.576 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)nc2ccc(Cl)cn12 1800087621 TVFMTQXCCVIHRA-VPTLXERWSA-N 482.733 0.493 50 20 JCGD N=C1NCCN1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800436085 QKQGXHHCQSSDCV-SFNKJDCFSA-N 478.391 0.422 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)CCO2 1800688239 IVYAMGLXLGZLRG-DQNPHBRESA-N 479.537 0.888 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(-n3cccn3)nc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376533 WHORVBWWVJDXRT-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD 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CC(C)N1CCC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1827304037 HSUKSYQOVZVHHE-WMZOPIPTSA-N 456.377 0.922 50 20 JCGD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)n1cncn1 1828925344 ITOFQWVZOBUAAT-KXBFYZLASA-N 454.535 0.771 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1829762978 WLCBRLNUKRDUSU-DAFSOKFYSA-N 458.353 0.332 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)CCO2 1830419591 XEYMBRIFSFCWNM-SLSDLSHTSA-N 482.317 0.379 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c([N+](=O)[O-])c1 1830733649 QQCBOMLQCUBLQQ-PXNSSMCTSA-N 471.894 0.202 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F 1831319506 ZPTQWDUSSDTYAU-DEOSSOPVSA-N 478.565 0.896 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1832396521 KDOJUNXKIZXWBT-LJQANCHMSA-N 450.366 0.034 50 20 JCGD O=C(CN1CCc2sccc2C1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832586900 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NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)c(F)cc3F)C2)C1 1837459978 PZYYUJJOUWKHRU-JOCHJYFZSA-N 493.442 0.486 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc4cccnn4n3)CC2)CC1 1837919349 ZYCSQGHSDAVPGD-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnnc3)C2)C1 1838526729 AXMPCDUVQNJWCD-QFIPXVFZSA-N 485.453 0.694 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(O)C3)C2)C1 1838527031 FNSYKZXAFAFIRX-SGHZUCRHSA-N 477.470 0.361 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(C)C)C2)C1 1838528091 DWBHIEYDSMXFDO-QHCPKHFHSA-N 492.529 0.978 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528461 ZPIVIASJXYWQCZ-RCDICMHDSA-N 492.485 0.115 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1cccc(Cl)c1 1839043407 WZSJJCVGXFVHDY-OPYAIIAOSA-N 488.368 0.573 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2)C1 1839141453 IZACMUULEBSWJB-MDOVXXIYSA-N 463.959 0.346 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1839142248 KWDMXKZTUPAHIE-XLDJFRKUSA-N 468.938 0.467 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839157667 CFSPXSJISNQDIV-DEOSSOPVSA-N 489.573 0.071 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)CCO2)C1 1839450431 NNOFELUZTZVGBU-UTKZUKDTSA-N 484.937 0.985 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839670468 JSSGFRVEYDRSDT-UGSOOPFHSA-N 473.324 0.191 50 20 JCGD COC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802021 KBEWRUDGJQUUOG-UWJYYQICSA-N 498.374 0.805 50 20 JCGD C/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839815125 FMBFLUSVQPCVBD-HORZDZNUSA-N 459.547 0.365 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1839964841 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O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1 25166590 OHVMEKTYFJQJAQ-UHFFFAOYSA-N 485.526 0.077 50 20 JCGD O=C(Cc1ccccc1)NCCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 27229227 GRSGXXWJLUCFEB-UHFFFAOYSA-N 458.540 0.981 50 20 JCGD COc1cc(Br)c(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1OC 28810597 NYOOXBDFEUERTK-QMMMGPOBSA-N 457.324 0.211 50 20 JCGD CN1CC(=O)N(CCCC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)C1=O 725908268 IBRVNANHQMZQCM-UHFFFAOYSA-N 479.540 0.984 50 20 JCGD CCOC(=O)c1sc2ncc(S(=O)(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2c1C 728510334 HBNVEDFZJUHBCL-VIFPVBQESA-N 464.547 0.029 50 20 JCGD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1 746350825 IQWSRVRAXPMUNF-UHFFFAOYSA-N 490.581 0.527 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccnn1C)c(=O)n2Cc1ccccc1 748830972 LQOUBKDVBGLFLQ-UHFFFAOYSA-N 478.513 0.259 50 20 JCGD O=C(NNC(=S)Nc1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)c1cnccn1 818260407 AEGCFDQOYMKNGI-UHFFFAOYSA-N 456.937 0.782 50 20 JCGD O=C(NN=Cc1ccc(-n2cncn2)c(F)c1)C(=O)NN=Cc1ccc(-n2cncn2)c(F)c1 863950910 VDILMKAJGHKGCB-UHFFFAOYSA-N 464.396 0.727 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 913444455 XWTWOXDHFYUXTB-UHFFFAOYSA-N 483.597 0.517 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)C[C@H]1CCCO1)c(=O)n2Cc1ccccc1 915637079 GYYDLGUFIWDOQX-GOSISDBHSA-N 482.541 0.781 50 20 JCGD C[C@H](CN1CCOCC1)C(=O)NN=Cc1ccc(C=NNC(=O)[C@H](C)CN2CCOCC2)cc1 916362043 HWISBMCIDKQMOV-WOJBJXKFSA-N 472.590 0.523 50 20 JCGD NC(=O)c1cccc(CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 916480042 CWAODGOTXGRPBR-UHFFFAOYSA-N 489.554 0.270 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)Cn3cnc4ccccc43)CC2)cc1 917911495 LTLHBPUNACQJNN-UHFFFAOYSA-N 470.555 0.499 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(Cl)nc1F)CCO2 1779028698 OHAOQQNPTDZRRA-HXUWFJFHSA-N 462.869 0.630 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc4c(s3)CCC4)CCO2)C1 1779030564 CUWSSJRBZQOYGY-JOCHJYFZSA-N 455.540 0.993 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)c1ccco1)C2 1779371071 AZSBXESYTBJACU-VGOFRKELSA-N 455.471 0.289 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)NC=O)C2 1780055515 XPAFKIZWURMLBC-BPSNYSSFSA-N 476.486 0.782 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(Br)CC2)C1 1780780552 KFYBNQGLVXUOPF-VQIMIIECSA-N 465.153 0.421 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781335197 WBXQXRZNADAJEY-XAYKYTGQSA-N 457.300 0.720 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C34CC(NC(=O)OC(C)(C)C)(C3)C4)C2)C1 1783438354 ROHHJIPYGIVSGH-VHYCJAOWSA-N 493.605 0.637 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cn3c(=O)n(C)c4ccccc43)CCO2)C1 1783874740 KTXRCBHANJGHPC-BTYIYWSLSA-N 450.923 0.424 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cn1ccc3c(F)cccc31)CCO2 1783932756 DJJOIZOQUBLDAD-QHCPKHFHSA-N 459.522 0.983 50 20 JCGD COC(=O)N(CC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)Cc1ccccc1 1783936346 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0.495 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)C=CC1=O 1802541682 NNXOWVQZCYPRMT-QDMKHBRRSA-N 470.438 0.697 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1 1803139432 PIJXIIQKMDBWTQ-ATZDWAIDSA-N 480.974 0.941 50 20 JCGD Cc1ccn(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1804622638 CQHYOPCMFUUQNN-DYESRHJHSA-N 462.514 0.605 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(=O)oc2)[C@H]1c1cccnc1 1806120452 OVZOVQMCMCZJQP-FOIQADDNSA-N 462.466 0.667 50 20 JCGD N[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccn1 1807163880 RJWVBYXHEKGRTH-COPCDDAFSA-N 459.315 0.176 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1 1807361087 OSDMINPRUQTFAE-RXVVDRJESA-N 476.346 0.741 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366865 HUOXGCTWUXURMD-NQSCKRDGSA-N 461.331 0.614 50 20 JCGD 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CC[C@H](C)[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831506027 RNUAXFKOFSGLTC-ACTFIFLWSA-N 492.013 0.982 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1833262605 YAEDMGDSRLGQST-CQSZACIVSA-N 495.422 0.843 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCc3ccccn3)CC2)CC1)c1ccc(B(O)O)cc1 1834797498 PMDKBNQZASTPDE-UHFFFAOYSA-N 464.375 0.579 50 20 JCGD Cn1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c(C(F)F)n1 1834800175 WNRYZNQNLWDKDK-UHFFFAOYSA-N 489.332 0.537 50 20 JCGD Cc1cccc(/C=C/C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834800556 MDRGFDRWJIEZAA-CMDGGOBGSA-N 476.386 0.968 50 20 JCGD CSc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1O 1835931165 HSRHQSLJTOIIOR-HSZRJFAPSA-N 486.355 0.178 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835932032 LCHLQOUJBJSKNL-QKYRPPLUSA-N 498.316 0.298 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4F)CC3)C2)C1 1835933530 BADJETBTGZJHKF-DEOSSOPVSA-N 482.317 0.307 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nccc3[nH]ccc13)CCO2 1836447715 CGJDHHPGGYTPCN-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1836670967 NHUYPUXOXCMLEG-GFCCVEGCSA-N 496.366 0.456 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1 1836842889 DTITXWORDWLHLH-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3[nH]ccc3n1)CCO2 1836905721 VRHRMSBCXPOMFF-BATDETSNSA-N 493.524 0.767 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3cc(Cl)ccc13)CCO2 1837086286 CCUVFMYMTWRLDJ-JOCHJYFZSA-N 492.964 0.659 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccco3)C2)C1 1837456948 QJDHOZIMNIHWAB-SIAOZKNOSA-N 455.471 0.062 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)[C@H]1SC(=N)NC1=O 1838100612 WELNIQSTGQVTSO-IFXJQAMLSA-N 496.634 0.160 50 20 JCGD CC(=O)O[C@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)C(C)C 1838360865 BHZKEOIMRQCEFD-QFIPXVFZSA-N 468.595 0.946 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)ccn1 1839200969 PPWAANHBIHOOMI-YJBOKZPZSA-N 473.299 0.801 50 20 JCGD N#Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(Cl)c1 1839423484 DMWZXABUUUQRIC-HSZRJFAPSA-N 483.717 0.275 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1839946056 WJUAOPBHCPYBMG-UQBPGWFLSA-N 466.343 0.549 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)[C@@H]2C1 1840009534 KLVIZHJXKLXVRX-HGRWERBWSA-N 487.981 0.155 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncn3-c3ccncc3)C2)C1 1840150888 SOHPUEFRKWZAPQ-DYESRHJHSA-N 463.922 0.591 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1 1840154458 XECWLAHDGFDIET-FZKQIMNGSA-N 455.924 0.410 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1 1840182360 AQUZEZZXPUCXOZ-FQEVSTJZSA-N 453.927 0.178 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185223 NVIZMSNOILUZTQ-DEOSSOPVSA-N 499.572 0.019 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1 1840647995 ZGFCCMXUTLMULG-RDTXWAMCSA-N 458.284 0.546 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1OC(F)F)CCO2 1840744483 HSLHZNJAAWTSJQ-HSZRJFAPSA-N 490.268 0.352 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)O2)C1 1841348989 YDLFHHGFTYTVSR-LSDHHAIUSA-N 457.955 0.958 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)[C@H]2C1 1843012484 SDFKUWZRLOLTCF-VAMGGRTRSA-N 499.373 0.065 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1843947881 ZNMXASGNFGWHSV-UHFFFAOYSA-N 457.336 0.440 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)Cc1cnccn1)C2)NC(=O)NCc1ccccc1 1845038185 BJWGERCWDNFELB-UHFFFAOYSA-N 451.531 0.569 50 20 JCGD O=C(C[C@@H]1CCS(=O)(=O)C1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 10105266 XBLDGENNYYKPLK-INIZCTEOSA-N 465.553 0.751 50 20 JCGD CS(=O)(=O)Nc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 10891525 HNUIDBRRFUCPLJ-UHFFFAOYSA-N 466.541 0.917 50 20 JCGD CCn1c(=O)c2ccccc2n(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1=O 16364885 STWQCLQJLYHALU-UHFFFAOYSA-N 458.858 0.841 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 105281446 OUICSPNBNJANNW-MRXNPFEDSA-N 461.496 0.990 50 20 JCGD Cn1cc(S(=O)(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)cc1C(N)=O 105831164 WWLYJIVCPGRGTF-UHFFFAOYSA-N 480.506 0.506 50 20 JCGD C[C@H]1CN(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CCO1 726259177 GUDONVIYNOSSFO-INIZCTEOSA-N 453.565 0.526 50 20 JCGD Cc1cccc([C@@H](CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)NC(N)=O)c1 728322461 BBMXXNPTXVZAAE-CRAIPNDOSA-N 456.455 0.625 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)[C@@H]1COc2ccccc2O1 728340013 FFFOFVANVSRCTB-LBPRGKRZSA-N 489.915 0.210 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(c2ccc(S(N)(=O)=O)cc2)CC1 729221224 LBYCZHVOXHNUJH-UHFFFAOYSA-N 457.516 0.467 50 20 JCGD Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 729295107 BLFYKGUFEHWTMK-UHFFFAOYSA-N 472.527 0.509 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCO[C@H](C(N)=O)C2)cc1 747775599 FNEGLWQUEHUYSX-KAPURRDVSA-N 452.471 0.054 50 20 JCGD O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC1 748247449 ONQHTAIUBLEYFJ-UHFFFAOYSA-N 461.456 0.779 50 20 JCGD CCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)cc1 834766128 XWWZHEKFNXQFLS-UHFFFAOYSA-N 465.484 0.620 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NN=Cc3cn(C)c(=O)n(C)c3=O)cc2)cc1 839386409 NSAIWJNZFKVOFM-UHFFFAOYSA-N 483.550 0.977 50 20 JCGD CN(CC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1)[C@@H]1CCS(=O)(=O)C1 914531949 PHTWIHKWFZKYJB-CYBMUJFWSA-N 486.597 0.429 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)cc1OC 914643021 DPIFJSPEZHTBRV-UHFFFAOYSA-N 497.464 0.547 50 20 JCGD CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 915789095 JGRXAVMWQIVGMC-UHFFFAOYSA-N 460.921 0.360 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)ccc2Cl)c1 916110252 AKAQVSAIPWIXLE-UHFFFAOYSA-N 461.905 0.912 50 20 JCGD CC(=NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1ccc(S(=O)(=O)NCC(=O)O)cc1 916276808 OZFJWUKUBUFDFF-UHFFFAOYSA-N 496.567 0.519 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Nc1ccccn1)c(=O)n2Cc1ccccc1 916737583 HWYFLJVYSLLQTM-UHFFFAOYSA-N 492.496 0.302 50 20 JCGD CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1 920385345 YCEGSUMIHPJHFK-RDJZCZTQSA-N 486.572 0.525 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)/C=C(/C)C(=O)NNC(=O)Cc1ccccc1OC 1263847271 BQSPOGSBYMEIQF-QINSGFPZSA-N 454.483 0.730 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)no1 1779435691 FJXNHOXVSKVCJP-QIIPPGSGSA-N 475.315 0.917 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1F 1780110447 HVYZIWJRXWJTIV-DEOSSOPVSA-N 484.289 0.440 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1nccs1)CCO2)NC(=O)NCc1ccccc1 1780968675 DFYBHCAXTRELIE-QFIPXVFZSA-N 472.571 0.933 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2 1782211866 BUFVVWYLTBGAJU-AUSIDOKSSA-N 460.531 0.916 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)CCO2)C1 1783872504 ADHJDVQXZWMHAK-AOMKIAJQSA-N 479.965 0.105 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CCO2)C1 1783876924 SOQQRKINPOFRIH-YLJYHZDGSA-N 458.964 0.716 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784094495 OKOBJQJWYUXDHR-PSKKIHNDSA-N 471.982 0.679 50 20 JCGD CC(C)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)CC1 1784996466 KNHFWEFJOFRALF-UFYCRDLUSA-N 451.612 0.460 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(c4ccccn4)CC3)C[C@@H]21)c1cccc(B(O)O)c1 1786984846 PUKMEECFNCERQM-PMVMPFDFSA-N 492.385 0.271 50 20 JCGD CCc1ccnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1787230832 NTNVWWGECKPKPP-QSFXBCCZSA-N 452.515 0.550 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cn3)C[C@@H]21 1787508564 AXMAGANBQHJERK-ZMEUDLNSSA-N 470.505 0.877 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c([N+](=O)[O-])cc1O 1789272469 KAWNMWISQJPHIV-RFUYNDQBSA-N 493.517 0.275 50 20 JCGD COc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)ccc1[N+](=O)[O-] 1789848258 PRQIIRJMHBTJKX-JLMWRMLUSA-N 497.313 0.119 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(O)cc1 1792776273 DVGVTKXNOFJLRY-QTLLOYRASA-N 469.498 0.495 50 20 JCGD CC[C@@H](C)[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793396897 VCNLHBDHJSDDEF-QOXYCXOJSA-N 475.590 0.329 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878311 QZFVAENQSNBZHY-RBGFHDKUSA-N 496.026 0.389 50 20 JCGD O=C1CN(c2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)n2)CCCN1 1794505517 CMPMYCHYDWOKJX-JGTCGTHISA-N 453.902 0.146 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732729 DLNNKXNLSXGGNA-RMFSNUHRSA-N 489.378 0.265 50 20 JCGD C[C@H](N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)C1CC1)c1ccccc1 1795736739 IGWRDDLNQHFHBL-USDRJLJOSA-N 491.397 0.699 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)c21 1798440033 VFXONLXDUUWHLI-BTTYYORXSA-N 463.498 0.843 50 20 JCGD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)N(C)C(=O)OC(C)(C)C 1799916956 UIVVYUZTRGJHSD-DQEVTTJGSA-N 459.352 0.874 50 20 JCGD COCCOCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1800204858 LOOGKKGIXFGFLT-MHORFTMASA-N 450.960 0.311 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C3)C2 1800326288 LLOLRYYWSMJSAK-XLKGFZLASA-N 482.965 0.466 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1800333308 FFWSQNUZXLSTSU-YJMBJCRISA-N 496.474 0.774 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCNC(=O)C1)C2 1800334495 SXAOYNBKXCXYHK-PUPWTTRCSA-N 458.465 0.988 50 20 JCGD O=C(COCCOCCOCc1ccccc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800848345 YKDSEGJQIIHUKI-IIZPIQPGSA-N 484.977 0.426 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1OC(F)F 1801814263 CRPWQXJJWGTPDA-CCWDJLKJSA-N 460.242 0.485 50 20 JCGD C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1803007330 ARILKSBUFGGOIX-KFNAQCHYSA-N 489.334 0.558 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803137056 ZWPNZFRVDXVHCO-BRSBDYLESA-N 484.981 0.963 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c(F)c1 1805082662 IDIUJNZUPWDSTP-JTSKRJEESA-N 478.289 0.938 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2cnc3ccccn23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359431 ITMNMAFRAWNLND-NLFFAJNJSA-N 483.337 0.971 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)Cc2ccccc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807366945 ITXVCNGTQGXTGY-QTJGBDASSA-N 473.338 0.685 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)n1ccccc1=O 1807374399 HEWCAUZBCLMNHV-MONBJTKQSA-N 474.326 0.504 50 20 JCGD CC(=O)NCCC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808415956 CDDWFDHYYNFPSZ-OBPKGMNYSA-N 467.530 0.748 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2nc(CO)[nH]c2c1 1809112237 LXWQRVUAANERFO-NTKDMRAZSA-N 499.336 0.763 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cc(=O)nc4sccn34)CC2)C1 1809971274 QGVMPCFIYJXNNZ-UHFFFAOYSA-N 480.355 0.594 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1 1810356017 APQMWGMVMNNIOQ-PSLQGDIJSA-N 455.353 0.521 50 20 JCGD 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CC(=O)Nc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1804829053 WTPFHWOIMPWAMB-WMZHIEFXSA-N 487.325 0.748 50 20 JCGD CCn1nc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1C 1807362222 UZQHOPZZPZSJIP-SIKLNZKXSA-N 461.331 0.920 50 20 JCGD O=C(Cc1cscn1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807487925 FNVTUCGFPIGLMZ-UTKZUKDTSA-N 450.329 0.780 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1 1808597996 XHDAHCXTLBQMLR-VGOFRKELSA-N 482.541 0.956 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1)[C@H](F)Br 1808682093 YTOMEDVWFCKSPV-VUCTXSBTSA-N 453.268 0.703 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1 1809359080 YAMWSIXLDAPQDK-VGSWGCGISA-N 464.530 0.817 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cc1 1809363831 KOUCURGXBXHRJQ-UHFFFAOYSA-N 498.410 0.994 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809974105 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CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnc4ncccn34)sc2C1 1818440211 ZZVJWDRGIHHMPM-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD CC(=O)O[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(C)C 1819247887 RMVLPFSJZFUKGJ-UYAOXDASSA-N 456.308 0.983 50 20 JCGD O=C(COC(=O)C(F)(F)F)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819313358 HVIRTDALDGIOFG-AWEZNQCLSA-N 468.197 0.501 50 20 JCGD CNC(=S)NCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1819409307 ZXWLIWYDFDLTMW-AWEZNQCLSA-N 452.585 0.259 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826806272 NPYSTWSTZSRBFQ-CZUORRHYSA-N 466.328 0.911 50 20 JCGD O=C(NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccc[nH]1 1827050375 PKONNXTXRYWYCJ-QFIPXVFZSA-N 480.374 0.748 50 20 JCGD C[C@H](NC=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829220893 GHWCMSOYKRSIGE-ZJBJCVSYSA-N 480.949 0.173 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCN(C)CC3)C2)C1 1830537761 NVCRPGJSFUATNR-XLIONFOSSA-N 475.428 0.111 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)CCO2 1830568745 JYDNGLASFDFKNZ-GCKMJXCFSA-N 477.986 0.736 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc(Cl)cnc1O 1833023500 OMYHLPYZSNICMA-UHFFFAOYSA-N 486.765 0.619 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1)[C@H](O)CCl 1833313678 MYQMMRMAOXIXDU-AYOQOUSVSA-N 454.999 0.559 50 20 JCGD CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834800973 DFFIHLBZGCZBAD-UHFFFAOYSA-N 478.402 0.931 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@]4(CN(C(=O)CCBr)CCO4)C3)c(C)n2n1 1834821404 IHCWICRPYYVAMQ-IBGZPJMESA-N 481.351 0.596 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1 1835255076 BFQXVHOUYAMBAN-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD Cc1ccc([C@@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1835932138 PXJAVYRKSFXFCD-KBMIEXCESA-N 466.343 0.549 50 20 JCGD Cc1cc2nnc(C(=O)N3CCC(OC4CCN(C(=O)[C@@H](O)CCl)CC4)CC3)c(C)n2n1 1836717258 QFGHDEACZUYJJJ-KRWDZBQOSA-N 464.954 0.953 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1 1837384960 MRHATQICXANFHM-LBTNJELSSA-N 463.373 0.324 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nn1C 1837451550 SFYBPECWSBXMBH-UHFFFAOYSA-N 454.336 0.334 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)cn2[nH]cnc(=O)c12 1838471370 MUSCVBHLINQBRG-UXHICEINSA-N 486.356 0.637 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C(C)(C)C)nn3)CCO2)C1 1838760080 HUXOHUFOZWYHEB-SCLBCKFNSA-N 458.357 0.887 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839200542 MIOAGIPWOHCEHJ-SUYBPPKGSA-N 452.321 0.438 50 20 JCGD O=C(c1nc(O)n2c1CCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200636 NAPGBBOEVMGGNJ-KSSFIOAISA-N 475.315 0.686 50 20 JCGD O=C1COc2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cc2N1 1839201262 SSCDZUJDIKFTRU-APWZRJJASA-N 486.294 0.778 50 20 JCGD COc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)ccc(F)c1F 1839381673 ALVFSFBTXQTJBL-HSZRJFAPSA-N 490.268 0.037 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3ccncc13)CCO2 1839507459 ABYTUBYANJSPQD-RUZDIDTESA-N 475.310 0.298 50 20 JCGD C=CCC(F)(F)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839887758 PBYRLOCLJKWKFF-RASHHNMQSA-N 467.473 0.788 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1839963074 ZCYUNHREOQKESL-OXJNMPFZSA-N 483.363 0.441 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1840036628 SFWZILMOBBHLJZ-BDJLRTHQSA-N 480.406 0.087 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1 1840184551 UYLVDLQXMHRWJQ-JOCHJYFZSA-N 492.964 0.659 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840189379 OHNBJFNKWBRRBA-BFUOFWGJSA-N 484.377 0.522 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc(C)c(O)nc3=O)CCO2)C1 1840805971 LJTULZLPENJGHZ-MGPUTAFESA-N 456.927 0.121 50 20 JCGD CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014622 HDSZFHKUQLKCBU-UHFFFAOYSA-N 491.762 0.522 50 20 JCGD Cn1cc(/C=C/C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)c(=O)n(C)c1=O 11777906 UQKULKXIRPQXRF-VAWYXSNFSA-N 497.533 0.037 50 20 JCGD Cc1cccc2c(=O)n(CCC(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cnc12 12606329 CEWMRUKWZUOKIP-UHFFFAOYSA-N 499.549 0.577 50 20 JCGD COc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 28808292 DHJQCNALFYNYGL-UHFFFAOYSA-N 457.490 0.828 50 20 JCGD O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 110881921 CKJTTXAURWNPIB-UHFFFAOYSA-N 485.613 0.950 50 20 JCGD C[C@H]1CC(C)(C)C[C@@]2(C1)NC(=O)N(CC(=O)NNC(=O)C1CCN(c3ncccn3)CC1)C2=O 728845662 OBGXFVQKLQRFGN-NPMXOYFQSA-N 471.562 0.977 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1S(=O)(=O)N(C)Cc1ccccc1 748246634 MUODABPFCPYNFY-UHFFFAOYSA-N 474.539 0.899 50 20 JCGD C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CNC(=O)c3cccs3)c2)C[C@@H](C)O1 751210559 HEFIMWRDCVMYSD-ZIAGYGMSSA-N 480.568 0.737 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1 906486779 OOTMCJOMCXKXIS-UHFFFAOYSA-N 484.538 0.180 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c(C)c1 917718141 GRHNULGXGMQWLN-UHFFFAOYSA-N 469.541 0.648 50 20 JCGD CN1CCC(NC(=S)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 920306848 BBMVNIADUATEKU-UHFFFAOYSA-N 469.633 0.230 50 20 JCGD COc1cc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1OCCO 1317901032 MBRXOYHUJOBAHN-UHFFFAOYSA-N 451.505 0.504 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3cc(C(F)(F)F)ccc3=O)cc2)CC1 1318242380 HQGGDULLJXVYKC-UHFFFAOYSA-N 473.477 0.947 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1778091533 JIVWTRQIWRWCGJ-NWGBDYHPSA-N 453.927 0.234 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1778952448 DFBIEJHDRLRYEK-PEBXRYMYSA-N 491.501 0.671 50 20 JCGD C[C@@H]1CCc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)n[nH]c21 1779030299 NVEPDPZQROURTN-MCMMXHMISA-N 453.503 0.215 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779356853 FLGVXMXSHBCYLC-QFQXNSOFSA-N 493.369 0.523 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779376021 VBIZGTNHDPDPTB-LZBHBKQYSA-N 482.541 0.675 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1 1779963253 NLKCSBQTDINWRK-IBUSPFOHSA-N 464.486 0.307 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c2n1 1780044463 AOKPGOMUWPJETE-HSZRJFAPSA-N 479.497 0.327 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1781395657 OTTBHWAXBFUWOK-CYFREDJKSA-N 488.589 0.963 50 20 JCGD O=C(CNC(=O)C(F)(F)F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2 1782234217 JQUUNKDQXPRFOG-IAQYHMDHSA-N 458.275 0.964 50 20 JCGD Cc1cnn([C@@H](C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)c1 1782513440 PMPJTVOQNDIVOC-XKDCRVNJSA-N 469.546 0.579 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccc(F)cc1 1783934666 FYWCNZJWFJFYCJ-JTHBVZDNSA-N 477.537 0.206 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(CO)c(F)c3)C2)C1 1785265057 OBABFSPXXDEFGQ-OJLHXUGZSA-N 471.489 0.896 50 20 JCGD Cc1oncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786121432 KPJWVISMWHTBSP-JBACZVJFSA-N 484.557 0.923 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cn[nH]c3)C[C@@H]21 1787506553 GIXQEQYXZONZGA-CCYFIYGFSA-N 455.519 0.456 50 20 JCGD NC(=O)c1ncccc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788140322 SITYODLGTBOQRT-UHFFFAOYSA-N 458.283 0.922 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1788195935 DMLNHBSNAQGZAR-SSPYTLHUSA-N 478.354 0.527 50 20 JCGD Cc1ncncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726589 BRAWOYVJFAXTTM-BVSLBCMMSA-N 495.584 0.725 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21 1789866558 RNWFVSSWBYIJEY-XSWJXKHESA-N 470.419 0.628 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COCCOCCOCCOC)[C@H]2C1 1791142940 ANLBFBGEJDOTKW-VJANTYMQSA-N 464.987 0.680 50 20 JCGD O=C(Cc1ccc2ncccc2c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793619012 WELQABSWMSUVJA-IRJINJETSA-N 459.311 0.361 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cccnc1 1793935489 VFDDAHVJLJCYBV-FFZFCVPESA-N 454.487 0.184 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@H]1CCc2nc(O)nc(O)c2C1 1794112382 SNOVLSYQGIHDOM-XXBVRILMSA-N 473.299 0.273 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncnc1 1794824120 ZRVWCOGIWQXQGV-CCWDJLKJSA-N 455.427 0.827 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795111409 JFPCSVLDDCUOAN-JYYAWHABSA-N 490.395 0.997 50 20 JCGD O=C(NC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)CC1)OCc1ccccc1 1797248864 LEDZDYRVFPRIPO-XMTFNYHQSA-N 465.934 0.635 50 20 JCGD CC(=O)O[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)C(C)C 1797592580 KCMVDUIHDAQIHF-QAMHDZDCSA-N 461.519 0.298 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(-c2cnccn2)c1 1798588755 KXDLPDHOFRIIHQ-BBIADKPPSA-N 466.542 0.720 50 20 JCGD COc1ccccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1800628558 FXHKCEPCZVLNHT-VPTLXERWSA-N 453.499 0.140 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1OCCc3ccccc31)C2 1801010714 RJHWEUWWLPXTKS-DSPLJNTKSA-N 458.559 0.653 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O)C2 1802336571 MXZZQLZFSRXNJY-XCDZQEORSA-N 495.621 0.616 50 20 JCGD C=CCO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803566970 PTXIBDGIYKXTLB-WRWLIDTKSA-N 452.515 0.991 50 20 JCGD CN[C@H](CC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1)C(=O)O 1807204876 IFKXVEDKGGSHHJ-JBKKHTOXSA-N 483.529 0.284 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CC(c3ccccc3)=NN2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368132 ZIVQBHWDLPDJQJ-GPUOULLFSA-N 497.364 0.847 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCN2CCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374105 IKGATCKIJZUHNM-NZQKXSOJSA-N 450.348 0.567 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374767 JAGLJKGYYKTYKU-XXBNENTESA-N 473.342 0.928 50 20 JCGD Cc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1810300362 XQYNYKIMFIXKJC-OXJNMPFZSA-N 460.498 0.812 50 20 JCGD Cc1cnn(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1 1810303614 SYHMQWPVARZYAX-LAUBAEHRSA-N 462.514 0.605 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](N)c2ccccn2)[C@H]1c1cccnc1 1810303909 WOCZOMWGOYYYSC-DQLDELGASA-N 474.525 0.495 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1 1810305937 QTEKQTVKYFXOHK-JXFKEZNVSA-N 463.502 0.082 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1nc(O)n2c1CCCC2 1810591026 VCYASNNEUKWQTD-GCJKJVERSA-N 489.341 0.633 50 20 JCGD COCc1c[nH]c(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1811347976 GSEWYSPMQYMBMN-UGKGYDQZSA-N 462.315 0.869 50 20 JCGD CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)CCC(N)=O)[C@@H]1c1cccnc1 1812777810 XBAZDBNIJFYCOD-WBTNSWJXSA-N 454.369 0.854 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)/C=C/c2cnccn2)[C@@H]1c1cccnc1 1813484220 NVZCPFMTTYEHDP-OQUIVNFOSA-N 472.509 0.903 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348084 DEDXBXFGNCIQPY-BRWVUGGUSA-N 483.355 0.804 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)CC2)c1cccc(B(O)O)c1 1815360097 MIMIWHLIFDCTCC-CQSZACIVSA-N 482.283 0.976 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816673394 BAVPHBHZQOCWNV-RNFRBKRXSA-N 467.309 0.278 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817471095 RNWJHCQPQFTIOG-DNVCBOLYSA-N 450.308 0.928 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)[nH]n1)c1ccc(B(O)O)cc1 1817476001 ZFXLPFGEZWNAQS-JOCHJYFZSA-N 488.357 0.792 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817478811 BQVMEMCDCABNLI-DNVCBOLYSA-N 450.308 0.928 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CC(F)(F)C(=O)O)[nH]n1 1819403132 VVANQIFTJDLIJI-ZDUSSCGKSA-N 465.417 0.824 50 20 JCGD C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCS(=O)(=O)CC1)CC2 1825635456 GURNKVCPQWAPFX-GHMZBOCLSA-N 479.422 0.569 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825964571 GOGDVRJQERCTJM-YESZJQIVSA-N 483.355 0.804 50 20 JCGD N=C(N)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1 1828974652 PXRSSSZFGJOWMT-UZLBHIALSA-N 468.917 0.456 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1 1830216468 DHIGHMCXYIELSH-BXWFABGCSA-N 475.311 0.876 50 20 JCGD C[C@H](CN)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549140 GKTKIKXZVAORDS-QEEYODRMSA-N 462.975 0.170 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833028486 PUEVUYIQUVDSAQ-RDXCRGQUSA-N 499.362 0.233 50 20 JCGD Cc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1834800055 RSLDMECNPVPQGP-UHFFFAOYSA-N 464.375 0.498 50 20 JCGD CN(CC(=O)NC1CCN(C2CCN(C(=O)c3ncon3)CC2)CC1)NC(=O)NCc1ccccc1 1836343523 HWKJRPMUFMAHKS-UHFFFAOYSA-N 498.588 0.601 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccc1 1837463037 YOIKKPRSEPDTAT-XDHUDOTRSA-N 467.526 0.559 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1F 1838914740 VUBVDRIOUQSMFO-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD C[C@@H]1C[C@@]1(C)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054357 VOFFHQHGIRSIHN-WVQWTBLQSA-N 487.601 0.835 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2)C1 1839147534 UNHKVWICMHDKNP-CKJXQJPGSA-N 477.986 0.736 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)C(C)(C)C 1839198474 FKTUPKTXKUNNMK-LBTNJELSSA-N 466.348 0.684 50 20 JCGD COc1ccc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1839358852 UAHGWBLXBQJKLG-XMMPIXPASA-N 468.315 0.067 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c([N+](=O)[O-])c1 1839462438 SHVZRVPLZJQJCS-HNAYVOBHSA-N 473.841 0.986 50 20 JCGD Cc1cccc2c(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)n[nH]c12 1839597374 XLURAELZWFFQGE-HSZRJFAPSA-N 472.546 0.314 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2 1839636610 RMTNHMNFZLZEHO-RRMPHLOHSA-N 479.375 0.992 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H](O)CN3)C2)C1 1839743927 FHJWVUWLKUHLHU-YSAHLOBYSA-N 476.480 0.051 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1839881098 LLGJXENETYZLPU-PERKRYKHSA-N 496.402 0.974 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1 1840153312 KBAKIOMARGTDHW-KKSFZXQISA-N 451.907 0.505 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840437018 MBXZRADQRWXQMH-SJLPKXTDSA-N 461.332 0.726 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)CC1 1843012875 PPSDQDZJJZZLLF-UHFFFAOYSA-N 457.336 0.488 50 20 JCGD O=C1CSc2cc(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)ccc2N1 1843318901 RKIPZNJJCFVBGV-UHFFFAOYSA-N 451.313 0.541 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846297793 FRBUPRAELLFBQR-LJQANCHMSA-N 471.363 0.877 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnco1 1847925484 OFPFITXYCKOPPA-FHWLQOOXSA-N 498.345 0.306 50 20 JCGD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 16128104 MQMVBUXSKYJBON-UHFFFAOYSA-N 484.512 0.547 50 20 JCGD COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 16785863 GSSIYKNUGJQGTI-HNNXBMFYSA-N 493.563 0.642 50 20 JCGD CCN(CC)Cc1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)o1 109007950 UMWOCXWDFJWVBK-UHFFFAOYSA-N 477.543 0.317 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)CCOC)cc2)c2ccccc2c1=O 116430611 NBJODTULHGYBNT-UHFFFAOYSA-N 458.496 0.911 50 20 JCGD COc1ccc(C(=O)NNC(=O)Cn2c(-c3ccc(OC)c(OC)c3)noc2=O)cc1OC 726432531 MZCSAPBMJMJRRQ-UHFFFAOYSA-N 458.427 0.999 50 20 JCGD O=C(CN1C(=O)Cn2c(cc3ccccc32)C1=O)NNC(=O)C1CCN(c2ncccn2)CC1 728890491 SUXCTJUJQYHKCP-UHFFFAOYSA-N 461.482 0.478 50 20 JCGD CCn1c(CCC(=O)NNC(=O)NC(C)C)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 745139634 LLWCKGDLBTUKDX-UHFFFAOYSA-N 466.564 0.749 50 20 JCGD Cc1ccc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 749847517 JFHPVOQBOGEDQD-ZDUSSCGKSA-N 472.570 0.988 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2cn(C)c(C)n2)cc1OC 750663440 NVBBIWZJWCKCFD-UHFFFAOYSA-N 453.521 0.656 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1ccc(NC(=O)C[C@@H]2SC(N3CCCC3)=NC2=O)cc1 752995359 ITZFJWGGOFXUNS-HNNXBMFYSA-N 474.543 0.395 50 20 JCGD CS(=O)(=O)c1ccccc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 874057711 IFEJGIUIVOZQPW-UHFFFAOYSA-N 487.581 0.498 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)NCc1ccoc1)c(=O)n2Cc1ccccc1 916636134 XPDRIZDQVOMOSP-UHFFFAOYSA-N 495.496 0.178 50 20 JCGD COc1cccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)c1O 919756784 KZLLTZSVEDQWNT-UHFFFAOYSA-N 450.473 0.441 50 20 JCGD O=C(NCCN1C(=O)c2ccccc2C1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 919788214 FZTOYLMIZVRRPM-UHFFFAOYSA-N 485.522 0.711 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919885828 RXINDEQKRYXGSV-HUUCEWRRSA-N 472.589 0.689 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2ccccn2n1 1778480901 CKZTWNIMKNNMGM-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD Cc1cn2c(=O)c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)cnc2s1 1778687110 IEJFGNOIZVBFLI-BXTJHSDWSA-N 468.963 0.792 50 20 JCGD Cc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031311 RNXPTHFSDCXLJD-HSZRJFAPSA-N 453.499 0.516 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2c(c1)CNC2=O 1779157441 ZWKJVPFAIPUGNR-PXDATVDWSA-N 477.326 0.051 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c(O)n1 1779372642 QWDSNLXDBRHLTA-WZONZLPQSA-N 468.514 0.535 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)C2)C1 1781181546 DYSKDBKWWGKAQU-DEOSSOPVSA-N 493.325 0.840 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]cnc1-c1cccnc1)C2 1782212350 WCRKSGUMBJZFTD-HOYKHHGWSA-N 483.573 0.972 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2)n1cccn1 1782561267 JTFCTJJDLPGSGY-YBOAYWMSSA-N 455.519 0.270 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(c4ccc(F)cn4)CC3)C2)C1 1782800544 YGDKUSLSHRTVPZ-XMMPIXPASA-N 490.580 0.640 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)CNCP(=O)(O)O)CCO2)C1 1782863818 ABYAVPUKPZDNGU-GYNNGBBESA-N 484.396 0.426 50 20 JCGD CC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1783141771 NMVOVMJSVIUJDO-XLIONFOSSA-N 452.349 0.959 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2 1783534675 NDGHWLRADHGASX-ZJNRKIDTSA-N 464.357 0.485 50 20 JCGD COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1F 1784702839 MDMPIRWGOMOGRO-HSZRJFAPSA-N 471.489 0.519 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cnc(-c2ccccn2)nc1 1785504446 CTDASHAHGNNTHY-XJABCFGWSA-N 487.325 0.126 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccnc1OCC1CC1 1785732367 GKFSGJCIUULGSJ-NYVOZVTQSA-N 479.342 0.457 50 20 JCGD O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21 1786405831 DHNAZOHPPRCHIT-MJVIPROJSA-N 475.365 0.216 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cc(F)ccn3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980215 WLVQDHJPWJRLDM-NDXORKPFSA-N 455.295 0.127 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21)c1ncn2nc(N3CCOCC3)ccc12 1787176330 ZQSOAKANFCITEB-PWDMQXDWSA-N 480.928 0.694 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cncnc3)C[C@@H]21 1787506661 KIDHRYIZMUNUTE-CCYFIYGFSA-N 453.503 0.133 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3F)[C@H]2C1 1790053118 KJDVECTVHLAMAY-KHDYIWLOSA-N 457.462 0.437 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)NC(=O)CC4)[C@H]2C1 1790504013 OKCDRVHZRCASQH-LRQRDZAKSA-N 492.536 0.477 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(Cl)ccc3F)C[C@@H]21 1791288758 SLJBTDPQUGRCJA-YDHLFZDLSA-N 455.918 0.840 50 20 JCGD COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1F 1792106340 WMWHDLWIJXOFBJ-QSFXBCCZSA-N 456.279 0.421 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1Cl 1793739735 MOZUHMSMFLMBQU-USGNIVHTSA-N 454.930 0.984 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1CS(C)(=O)=O 1794405665 XUXJVDBIDQFNMW-IARIHHJXSA-N 459.952 0.083 50 20 JCGD COc1ccc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)[nH]c2c1 1795738848 HWUMORKCPGRSSC-FAQVEIGNSA-N 463.299 0.373 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCO1 1797117659 WRAROUBCIRRXQQ-CWQOZTLDSA-N 489.997 0.856 50 20 JCGD CC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)c1ccc(F)cc1 1799817760 PDXCJNINVZYGDQ-NYUBLWNDSA-N 482.516 0.953 50 20 JCGD Cc1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN(C)NC(=O)NCc2ccccc2)c(=O)[nH]c1C 1799865846 OLBJTWCRHRZGHL-ACDBMABISA-N 495.584 0.985 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1800298956 YXFAVBJNWMKYJI-CWFFCZEZSA-N 480.403 0.995 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c[nH]c2ncccc12 1802067372 GJJFUIRAPPAXDE-FAQVEIGNSA-N 456.547 0.458 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C2=NN(C)C(=O)CC2)[C@H]1c1cccnc1 1804119491 IHSPDXFERZDCEC-LNRKUZHGSA-N 492.540 0.830 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360586 LHWTUXSCKZBZGM-YJBOKZPZSA-N 479.220 0.187 50 20 JCGD NC[C@H](C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccccc1 1807366039 XKBADCGBEGQULD-XWGVYQGASA-N 472.354 0.824 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc(Cl)nc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807366907 VUQPDCCZRSNWCR-VQIMIIECSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C#CC2(O)CCCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374319 GYVDBGKPNJQDCP-XUZZJYLKSA-N 475.354 0.780 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(Cl)ncn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374492 HOZVDWBNCYKZQT-JXFKEZNVSA-N 465.706 0.838 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808417900 RZBOPMSHERKZCB-OTWHHZRWSA-N 497.556 0.373 50 20 JCGD CC(=O)N(C)CCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810293325 CQZAAVMGNJNXFU-DYESRHJHSA-N 467.530 0.268 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)c2ccccn2)[C@@H]1c1cccnc1 1810303911 WOCZOMWGOYYYSC-ORYQWCPZSA-N 474.525 0.495 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1C 1811140847 HRTWUJKEMLIGFU-PGRDOPGGSA-N 461.331 0.691 50 20 JCGD CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812779274 RDBRMSPYJQKUPA-ZIFCJYIRSA-N 471.396 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)O)[C@@H]1c1cccnc1 1813072388 BMEIBOYSOAGTFP-MGPUTAFESA-N 451.549 0.278 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C(=O)c2cccn2C)[C@H]1c1cccnc1 1813478814 IGPRYGONIDEUOV-LAUBAEHRSA-N 454.531 0.682 50 20 JCGD CCOc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1 1817471268 UALQLTVWELIODD-SFHVURJKSA-N 464.291 0.898 50 20 JCGD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)n1ccccc1=O 1819570560 KTSFKAVDRPZIAW-DNVCBOLYSA-N 463.303 0.818 50 20 JCGD Cc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cn1 1819795816 SWRWLGGGYFUGJU-NSHDSACASA-N 452.500 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSc1nc[nH]n1)CC2 1819802184 YTXPNABIYTUCFC-VIFPVBQESA-N 473.544 0.278 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1)C(Cl)Cl 1822418778 GEELQILOIPHWTN-LBPRGKRZSA-N 452.364 0.936 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc2nn[nH]c2c1 1824411925 LBGJAZVBCYBPTL-CQSZACIVSA-N 462.300 0.634 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(C)=O)CCN2C(=O)OCc2ccccc2)C1 1829303161 IBTHOAFIFLYOTI-WMZHIEFXSA-N 494.976 0.828 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1830159110 CTZGAVLKFUBWDK-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1830535856 UUINHHPHNGSIKT-LIRRHRJNSA-N 488.404 0.965 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@](C)(O)CC(=O)O)C2)C1 1830543759 CBDKMYXARDKROX-XWIAVFTESA-N 465.341 0.090 50 20 JCGD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830720456 ZUYHRDJRKOTKOT-LPHOPBHVSA-N 476.313 0.847 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)C(C)(C)C 1831095735 LHSDNNBJNURRAG-HBUWYVDXSA-N 466.348 0.684 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1831446722 MYQKTWSCGRCJKD-IRXDYDNUSA-N 457.376 0.585 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873404 IXCFUVCHKSVPDP-FUHWJXTLSA-N 452.600 0.687 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1 1834798176 ZIEZROMZVFHKOI-RTBURBONSA-N 485.390 0.141 50 20 JCGD COCCOCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835239289 AZKDVBOMQNDBFK-HRAATJIYSA-N 493.985 0.238 50 20 JCGD O=C(c1ccc(O)cc1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921294 VSCPHNRDKDYTSQ-UHFFFAOYSA-N 452.316 0.998 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1837922016 BFTVHNATSWZXED-UHFFFAOYSA-N 479.342 0.391 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1838471483 PWEUFRRGLIHJHQ-YWZLYKJASA-N 451.911 0.418 50 20 JCGD CNc1nsnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839197227 NHTAHPQANSIKRH-IINYFYTJSA-N 452.306 0.340 50 20 JCGD CN(C)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839197842 JTTBEVZRDOHFSH-QAPCUYQASA-N 459.316 0.908 50 20 JCGD Cc1nn(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1F 1839197960 NWHGSAMQSVNUIG-BBRMVZONSA-N 451.268 0.628 50 20 JCGD Cc1cnc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cnn2c1 1839200023 ACJAIEGUOMFPCT-KDOFPFPSSA-N 470.299 0.798 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc3c(O)cccc13)CCO2 1839607463 ZBWIMWWRCYZWPC-DEOSSOPVSA-N 485.541 0.383 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)Cc1ccccc1)CCO2 1839960046 AWKYVKTVPJRGSI-KNBMTAEXSA-N 455.349 0.830 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn(C)c3=O)C2)C1 1839963001 XEPVAZAKFVMIBP-BEFAXECRSA-N 456.337 0.629 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1840059535 GLYSMJFTXAWJDU-OHNQJVKOSA-N 479.933 0.348 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1 1840154870 IFBXHWOJOCCLCT-UGKGYDQZSA-N 465.934 0.820 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnccn3)CCO2)C1 1840484470 RKZKZLLXAMWGIU-QIGIYGOBSA-N 453.337 0.977 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(C(=O)OC)cc3)CCO2)C1 1840958718 WOASFGJYXNZSQY-GCJKJVERSA-N 484.933 0.562 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1841355756 XGBNUGOGHCGEPR-AWEZNQCLSA-N 460.535 0.663 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2ccc[n+]([O-])c2)C1)NC(=O)NCc1ccccc1 1842146949 WZLZFCWSHVMDGD-UHFFFAOYSA-N 452.515 0.483 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1847647078 AWDONSCBLRTCRQ-SFTDATJTSA-N 450.300 0.601 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)C1CCN(Cc2ccccn2)CC1 1848245572 OFWWBBBUGJQVFH-GOTSBHOMSA-N 462.359 0.489 50 20 JCGD O=C(COC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccccc1 11333395 HWFZKAUNDBEOPO-UHFFFAOYSA-N 475.523 0.645 50 20 JCGD Cn1c(=O)c2nc(Br)n(CC(=O)NNC(=O)c3ccc(Cl)cc3)c2n(C)c1=O 23058043 IJQBHNCVCLCCFV-UHFFFAOYSA-N 469.683 0.311 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 28663109 MDFTZTHNLPZECU-QGZVFWFLSA-N 488.566 0.606 50 20 JCGD COCCCNC(=S)N(C)NC(=O)c1ccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)cc1 726076616 ZPINCZZWVQLLOG-GJZGRUSLSA-N 458.606 0.972 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc3nccn3c1)c(=O)n2Cc1ccccc1 727754104 FUNXCNUTBNTWRO-UHFFFAOYSA-N 486.492 0.537 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])c1ccc(-n2cnnn2)cc1 728503680 WYQPUIQEPDRBSU-UHFFFAOYSA-N 468.249 0.956 50 20 JCGD NC(=O)C1CCN(c2ncccc2CNC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1 729230572 NIJZLARMEIADSL-SFHVURJKSA-N 454.487 0.454 50 20 JCGD O=C(NNC(=O)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)c1ccc(-n2cnnn2)cc1 729493861 AIKUZWLBTNPIID-MRXNPFEDSA-N 488.505 0.599 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1 770424310 LDCVHCXUUOJFBX-HNNXBMFYSA-N 464.500 0.925 50 20 JCGD O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 912642859 AIHHDANBLBUSSJ-KODHJQJWSA-N 472.523 0.039 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1ccc(Br)s1 914831423 LNYBYWXFOSFDLZ-IUCAKERBSA-N 450.336 0.307 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1)c1ccc(-n2cnnn2)cc1 916144787 ZFGKOBNCPIBNAK-HNNXBMFYSA-N 461.529 0.728 50 20 JCGD CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)s1 918398740 FCHHXXNOQGLEIT-NSHDSACASA-N 474.586 0.819 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCc1nccs1)c(=O)n2Cc1ccccc1 919843023 SXMBFDVNORLMIA-UHFFFAOYSA-N 481.538 0.665 50 20 JCGD Cc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N1CCCCC1 919884995 JITCQTVXCPAIMO-OAHLLOKOSA-N 458.562 0.301 50 20 JCGD COc1ccc(OCc2nc(C=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)cs2)cc1 920371173 SMWMTQRTEMTYGM-UHFFFAOYSA-N 476.540 0.766 50 20 JCGD O=C(NNC(=O)c1nn(-c2ccccc2F)cc1Br)N[C@@H]1CCS(=O)(=O)C1 1251233014 LRYKIKJMDLKCNQ-SECBINFHSA-N 460.285 0.905 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3occc3c1O)CCO2 1779037381 YVSHVYJVAVBXBZ-QHCPKHFHSA-N 465.466 0.894 50 20 JCGD Cc1cn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CO[Si](C)(C)C)C2)c(=O)nc1O 1779545753 IOZZCNORRMSKFU-IIBYNOLFSA-N 466.611 0.623 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(OC)c1 1780534913 OJHXHDITMSVHNO-HSZRJFAPSA-N 454.288 0.141 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(Br)ccc3O)C2)C1 1780557548 MUXVRQMJXVQRDV-OAQYLSRUSA-N 489.131 0.592 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cncn1C)CCO2)NC(=O)NCc1ccccc1 1780969871 KWOOVDIERNCOMI-HSZRJFAPSA-N 469.546 0.210 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@H](O)CN3)C2)C1 1781047533 CBXHFGUOMOSMCG-RYLXDESZSA-N 466.376 0.545 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCS(=O)(=O)CC1)C2 1781997179 IZAWZDKFBGYUTE-IIDMSEBBSA-N 480.425 0.014 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1782162961 LUXFQNGZUKSNSQ-XMMPIXPASA-N 475.314 0.013 50 20 JCGD CC(C)c1nc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)no1 1782208947 CNBYHLAWKBNYGT-OPAMFIHVSA-N 464.567 0.622 50 20 JCGD COC(=O)c1ccc(OCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)cc1 1783347416 KACZXBDWEIVRAC-JBYIUTFZSA-N 468.934 0.966 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1 1783397939 XKPUAQDDPHBBPB-BHSKHCGUSA-N 476.534 0.475 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1 1783534058 PBSRIVGBGMQOCG-FHSNZYRGSA-N 454.325 0.208 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)C1 1784014183 XNYXEYVIVWPSKX-FASAQXTFSA-N 494.358 0.879 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1 1784848582 SDCLLTKGYWVFDI-YZLPMWMCSA-N 457.955 0.841 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNc3ccc(F)cc3)[C@H]2C1 1786812113 TXJRPKRVNHPBOT-GKCIPKSASA-N 470.505 0.530 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)N(C)C(C)=O)[C@H]2C1 1787518042 NBAIYDQDYBBGCA-CCNVXBGZSA-N 490.513 0.980 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cc(F)ccc4n3)[C@H]2C1 1788344848 QDDBNRLURKYRGF-IXDGSTSKSA-N 481.488 0.379 50 20 JCGD Cc1cc(F)cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1791362516 FSPYDYVJQLKXDU-NDXORKPFSA-N 469.517 0.969 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1794251897 ZORWDBRNYHEGCN-XJFOESAGSA-N 495.378 0.245 50 20 JCGD Cc1oncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1794828961 MXBXSFZRGVZCKW-RMFSNUHRSA-N 470.530 0.532 50 20 JCGD COc1cc(Cl)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1 1795736669 AFDKXSVJBDHDLN-CWPLJXCYSA-N 458.707 0.545 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(OC(F)(F)F)cc1)C2)c1cccc(B(O)O)c1 1795737421 FNFYDWDCYSQEGF-UPHUGPLXSA-N 492.259 0.711 50 20 JCGD Cn1c(=O)n(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)c2ccccc21 1797172872 UOOSUDINHNBHDY-VPTLXERWSA-N 460.607 0.781 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(-c3cccnc3)n1)C2 1797750596 LEZHSYXVEGSSCW-CCWDJLKJSA-N 493.549 0.721 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1Cl 1797754340 RXKDCQBBMHOLAS-HBCWATKFSA-N 473.917 0.864 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1 1799333468 IGSNEFDIACAAQL-WUUQAYSMSA-N 475.970 0.514 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2 1801012933 NKPXLDANSGVETB-ZIVKBKJYSA-N 486.495 0.106 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)CC1 1801941848 NNXQZHWHJIIUPN-CEQLMSFQSA-N 499.373 0.137 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1803162090 ZLHNOBOORBXQAQ-NNWRFLSQSA-N 450.348 0.565 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@H]1COc2ccccc2O1 1804198956 YSPBVDJZHCGVEJ-IEXUWNMDSA-N 487.321 0.921 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cncn2-c2ccncc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369916 YVPCQUFFIUNVSP-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD CN(CC(=O)N1CCC2(CCCN(C(=O)C(=O)N(C)C)C2)CC1)NC(=O)NCc1ccccc1 1809578840 RJPWNQBPKWYIDD-UHFFFAOYSA-N 472.590 0.652 50 20 JCGD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n(C)n1 1810299943 VSMGHNGSEAJGPQ-OXJNMPFZSA-N 462.514 0.755 50 20 JCGD Cn1cc(CCC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1810301622 AQRSDJIXCGSOFF-XMSQKQJNSA-N 476.541 0.766 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccnnc2O)[C@H]1c1cccnc1 1811226308 JZOYNUVOKUEJPS-KBXCAEBGSA-N 462.470 0.209 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CSCC(=O)O)[C@H]1c1cccnc1 1813072390 BMEIBOYSOAGTFP-QRWLVFNGSA-N 451.549 0.278 50 20 JCGD Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)ncc1[N+](=O)[O-] 1815341261 VFERVHFLSBIVOI-AWEZNQCLSA-N 481.299 0.974 50 20 JCGD COc1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)nn1 1817476790 QJUBRSHGHQCCPW-QGZVFWFLSA-N 450.264 0.508 50 20 JCGD Cc1cnc2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3ccc(B(O)O)cc3)CC4)cnn2c1 1819088049 DVWNMEAERAFBOG-OAHLLOKOSA-N 476.327 0.714 50 20 JCGD CNc1nsnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819400209 DVOZVDLAOZGNAH-ZDUSSCGKSA-N 470.519 0.921 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cncc(O)c1)CC2 1819800371 OAKNWVLIBHSROJ-LLVKDONJSA-N 453.484 0.782 50 20 JCGD C=C(CC(=O)OCC)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826088367 DZUZIRVOILYNJO-CYBMUJFWSA-N 451.549 0.938 50 20 JCGD O=C(c1cnn2ccncc12)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052006 LKHFESPXDCDEGW-NRFANRHFSA-N 461.331 0.956 50 20 JCGD O=C([C@@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1827400589 XOFQDLBQMGADHY-TZMCWYRMSA-N 470.303 0.736 50 20 JCGD O=C(COCCO)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829224045 YXWZXEYVLZAFAB-XMSQKQJNSA-N 483.949 0.047 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F 1830152034 YRKTUBKZMBYFOQ-QFIPXVFZSA-N 466.510 0.277 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H]3Cc4ccccc4CN3C)CC2)CC1 1833709995 JPXSWDJFZXWQFO-XMMPIXPASA-N 498.672 0.988 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CNc3ccc(F)cc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797841 CJAXCQHFKWPGFE-UHFFFAOYSA-N 482.365 0.803 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4ncsc4[nH]3)CC2)CC1)c1ccc(B(O)O)cc1 1834798451 XMJUIMODULSPTC-UHFFFAOYSA-N 481.387 0.803 50 20 JCGD Cc1cccc(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834800555 MCDYKIOUFDEASZ-UHFFFAOYSA-N 464.375 0.498 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)C1 1834819606 SBVASUVPXHGIEP-QMTMVMCOSA-N 461.353 0.817 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1 1834821812 ZLZRTYZLBNWRCK-SFHVURJKSA-N 452.309 0.813 50 20 JCGD C[C@H](Nc1nccs1)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835106435 YTXCMEUEHBEMLJ-INIZCTEOSA-N 479.651 0.888 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@]3(F)CCCCC3(F)F)C2)C1 1835930339 GXESOPJVRWDDKW-LEWJYISDSA-N 484.280 0.354 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461357 VCBQHTWSFMLDPH-DEOSSOPVSA-N 485.516 0.445 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837715054 TZHYXRLMSLYCIT-JXFKEZNVSA-N 475.615 0.137 50 20 JCGD O=C(Cc1ccncc1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921136 DGGAGCZLZFACQU-UHFFFAOYSA-N 451.332 0.616 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)nn1 1838831309 CSGYIQGJCYJBOP-RHSMWYFYSA-N 461.288 0.636 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)ccc1O 1838974946 VNEDBAHTZZFYGC-NHVVDLMHSA-N 499.524 0.605 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2 1838998311 SDIOUGJCUBADKV-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1839155573 XUVZXMAVRVZUIG-ROUUACIJSA-N 463.318 0.254 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1839205093 NLSVRZLATAKKBO-KSMMKXTCSA-N 467.922 0.253 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])cc1F)CCO2 1839278700 XWBWGRLJNVQPGZ-NRFANRHFSA-N 481.481 0.177 50 20 JCGD COc1c(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1839393817 IVSQQCVQEZTTKB-VWLOTQADSA-N 497.552 0.694 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839765615 YMNKJSVHBXRUAS-CJAUYULYSA-N 484.333 0.454 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1839966526 HZXYMCPDBCBAJW-LAUBAEHRSA-N 498.422 0.962 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1 1840032677 HDRXQUFWFCBPFY-SGTLLEGYSA-N 487.307 0.852 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCOc3ccc(F)cc3)C2)C1 1840183115 RTTZZEJQRLLTLX-QHCPKHFHSA-N 480.537 0.424 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1 1840648610 VATBVYMVSNPDJA-YJYMSZOUSA-N 454.321 0.639 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(C)CC1(F)F)CCO2 1840825383 DTFVSAKUCGBXAM-IKYHASTISA-N 467.473 0.622 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840905565 MLILSCZINLXFAM-FOIQADDNSA-N 463.959 0.347 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccc(F)cc1 1843014420 IQYQAFJEZSZZOC-FQEVSTJZSA-N 453.279 0.200 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(CCN3CCCC3)nc1)C2 1846384768 GKOWIWKHRGWUTI-UHFFFAOYSA-N 456.591 0.910 50 20 JCGD Cn1cnnc1SCC(=O)Nc1cccc(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1 22193157 WFSZJPWHJTVRFL-UHFFFAOYSA-N 478.498 0.596 50 20 JCGD CCC(CC)N1C[C@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1=O 729301686 IWNIETDWPZYOBV-GOSISDBHSA-N 494.614 0.825 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccnc(F)c1)c(=O)n2Cc1ccccc1 745421460 OPNKEGKCHQCBGE-UHFFFAOYSA-N 465.445 0.423 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)ccc1Cl 914595739 PUNUKJKMEXTPCX-UHFFFAOYSA-N 486.959 0.751 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CSCC(N)=O)cc2)cc1 914684258 DFIAVKAVWNXWMG-UHFFFAOYSA-N 466.541 0.866 50 20 JCGD CN(CC(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1)S(C)(=O)=O 914710962 NLTILDVMKCONOJ-UHFFFAOYSA-N 487.626 0.823 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cn(C)c(=O)nc3O)c2)cc1 916095307 DAMVUWMNDSHBOE-UHFFFAOYSA-N 473.467 0.370 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1C 916561636 BIDDIZAESFOQQT-UHFFFAOYSA-N 490.538 0.919 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)OC)cc2)c1 917717209 AJSIRIYXARGFGX-UHFFFAOYSA-N 499.567 0.892 50 20 JCGD COc1ccc(NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1 918540785 BQWGFBDPJMWMAP-UHFFFAOYSA-N 463.516 0.897 50 20 JCGD CC(=O)N1C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)Oc2ccccc21 920058601 QGQMPLHEOCSEND-MOPGFXCFSA-N 455.423 0.331 50 20 JCGD COCCCNC(=O)NNC(=O)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(C)C 920862455 HJTMLMIDOWMEOP-QGZVFWFLSA-N 458.537 0.518 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)cc3)C2)cc1 1318069705 UMBJDIOICQWGIR-QGZVFWFLSA-N 469.523 0.688 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCO3)C2)C1 1778281356 RIRIRFHEJCVSGI-OFVILXPXSA-N 487.601 0.090 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c([N+](=O)[O-])c1 1779036891 IFIWGNZYUQEKAE-HSZRJFAPSA-N 498.496 0.288 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779222230 WWUCAEABGJCMOU-YADARESESA-N 498.588 0.090 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)[C@@H](O)C1 1779300782 ZANCFLYGOPAQLI-HOIFWPIMSA-N 485.654 0.896 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2 1779374525 NGGGJYHWFLDWSE-DDIBASDRSA-N 498.584 0.214 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1 1779688343 JVTZHEVMQBYYFM-MRAZWZEMSA-N 490.524 0.845 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1780051397 DONKVDFLYNGQQV-JOCHJYFZSA-N 471.518 0.257 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC(F)F)cc3F)C2)C1 1780140306 NJXYJIXOZPDXHJ-JOCHJYFZSA-N 478.232 0.864 50 20 JCGD CCc1ncsc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1780246881 QGWPRLRHSBLOBO-XMSQKQJNSA-N 457.361 0.827 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(C)nc3O)C2)C1 1780271054 BWKBTZGRXDBXSC-BHSKHCGUSA-N 454.487 0.673 50 20 JCGD COc1ccc(C2(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)CCC2)cc1 1781210180 YPOSFGLKTWAVLA-VWLOTQADSA-N 478.354 0.940 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)CC(C)(C)NC(=O)OC(C)(C)C)CCO2 1783933431 YUZQAANFGKSJRC-QHCPKHFHSA-N 483.610 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)CCO2 1783937035 DSRWQYPTXFDTCD-QHCPKHFHSA-N 454.531 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)CCO2 1783940168 UXLJLHHIYDRKAI-SEPYTNNBSA-N 481.594 0.493 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=N)N)[C@H]2C1 1786808568 YXGUGILAWFOJAU-DCHBYBGLSA-N 489.374 0.819 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)c2c1 1786983315 MCUCFOHXHSPTRB-OEOAZWSVSA-N 475.354 0.992 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)CC1 1788110916 AERLTYFHNHYYAJ-IHRRRGAJSA-N 456.392 0.441 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1 1788610925 AQNFCADNFVVEFH-HSQYWUDLSA-N 494.552 0.480 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1 1789925673 UCFNTEVJPWCDSQ-QBYUYEEZSA-N 469.348 0.726 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1c(F)ccc(O)c1F 1790209762 QEVYIZLWXXNHAA-YEWWUXTCSA-N 460.242 0.257 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(=O)CN3C(=O)OC(C)(C)C)C[C@@H]21 1791248839 AXTAFYMOBPFXNV-JFMONLCZSA-N 487.981 0.798 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)ccc2c1OCCO2 1791289194 NPICFFCQACTSOV-QRFRQXIXSA-N 474.558 0.733 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C[C@@H]21 1791291094 LEVIJIIOMVXLOM-ORQYLMBXSA-N 473.530 0.074 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1 1791296846 QRELNIOMBIBNOB-ULQDDVLXSA-N 485.405 0.856 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1792223381 GMXURYGWHMKEEG-ARKGTOAJSA-N 491.969 0.022 50 20 JCGD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)c(=O)[nH]c1C 1794310178 GUJMDWUDPORRFQ-FZKCQIBNSA-N 497.980 0.722 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccccc3n1)C2 1796441894 DSLVLQPJCAPOJK-MABAGPRWSA-N 475.509 0.967 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797750462 GQZUTPLAYLIMNB-CCWDJLKJSA-N 466.542 0.895 50 20 JCGD N#Cc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1799746819 PLOPOCLKYUPWKG-HBCWATKFSA-N 452.446 0.213 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)CC2 1800103585 TUQSAEGSMQSCJA-VPTLXERWSA-N 478.509 0.087 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(O)nn1 1800179388 ZGARECGSEFBALN-YEZVWNJWSA-N 499.480 0.852 50 20 JCGD COCCOCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1800204860 LOOGKKGIXFGFLT-XMTFNYHQSA-N 450.960 0.311 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801017935 AZZUOTYHHZTYCU-OPDFLTKYSA-N 482.361 0.836 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)CCC(N)=O)[C@H]1c1cccnc1 1803009091 RASGTDRGJRJXQW-DYWXZXKOSA-N 454.369 0.711 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)C1 1805383932 QJEKHSFYPLJUJY-MRXNPFEDSA-N 478.453 0.979 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)no1 1808388799 NUBPBVMNXPPZGY-MBSDFSHPSA-N 491.313 0.406 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CN2CCN(C)CC2)[C@H]1c1cccnc1 1809601588 JGAAQMIGDSGQPI-SHIASZOCSA-N 494.600 0.469 50 20 JCGD Cc1cc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)on1 1810295601 UJHUFWBHEXXVNE-HRAATJIYSA-N 463.498 0.939 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810478270 RUFSYMPMJFYZLA-OXFYSEKESA-N 477.529 0.328 50 20 JCGD CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)CCC(N)=O)[C@H]1c1cccnc1 1812777804 XBAZDBNIJFYCOD-AESZEHBQSA-N 454.369 0.854 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1813031593 QTDSXEVVHWLJMZ-WBAXXEDZSA-N 460.922 0.654 50 20 JCGD NC(=O)c1ncccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1816074216 GYURLTFFPZBSKO-QGZVFWFLSA-N 462.275 0.203 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472477 UEBHNPBMPOVDFA-KSSFIOAISA-N 455.324 0.700 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc2ncnn2c1 1819214116 UGPURYJWJVKUOJ-GOSISDBHSA-N 459.275 0.752 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1825731476 CDKXMNIBWVHXAY-LJQANCHMSA-N 469.546 0.974 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)[C@@H]1SC(=N)NC1=O 1827059339 NCTBNHBBBZHCAE-JVPBZIDWSA-N 486.403 0.402 50 20 JCGD O=C(c1nc2ncccn2n1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059427 PEEWAQNUIWXWQQ-LJQANCHMSA-N 462.319 0.351 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1827692735 YRCBYDUSEBKADB-FOIQADDNSA-N 458.563 0.785 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828524966 IZCCSMOCDPRJHZ-LEWJYISDSA-N 488.368 0.986 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCC(F)(F)C1)CCO2 1829654783 UWPRUBFZMOMOAK-XOBRGWDASA-N 467.473 0.191 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1830543597 VQMUVFMSHIMZLT-FOIQADDNSA-N 480.363 0.759 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C[C@@H]2C[C@@H]21 1830719605 GOKFUKDRCFAPKR-YFDQIPFUSA-N 487.981 0.440 50 20 JCGD O=C(/C=C/c1ccc(F)cc1F)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832136274 SLDFVXLHAIEGAC-LHLOKTHNSA-N 486.280 0.428 50 20 JCGD O=C(Cc1cnc2ccccn12)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833295030 NHRVNEMVHPVEFU-UHFFFAOYSA-N 489.385 0.442 50 20 JCGD CC(C)n1nc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1C(=O)O 1833307959 FLOMDXVIWJFEDV-GOSISDBHSA-N 469.970 0.947 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1 1833338601 USXCISGWYPJZLT-QAPCUYQASA-N 473.299 0.801 50 20 JCGD CCS(=O)(=O)CC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1 1833456540 ZCVRJGAMDTZONR-CYBMUJFWSA-N 452.415 0.776 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CC(F)(F)F)CC2)CC1 1834597671 DVOZIASKMBSHNW-UHFFFAOYSA-N 456.469 0.823 50 20 JCGD CC(C)(C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccn1 1834801376 DBWBAIQVGHFTCV-UHFFFAOYSA-N 478.402 0.924 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2 1835674718 FLYCRRVNERMJJX-BEFAXECRSA-N 459.385 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccn4cncc4c3)CC2)CC1 1835738202 YPMUQKVDTRALIK-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD CNC(=S)NCCC(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1835741951 UPYVWFDUHJELOB-HNNXBMFYSA-N 466.421 0.733 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc2ncsc2[nH]1 1835850773 YFKOURZMKZSTRA-UHFFFAOYSA-N 481.387 0.803 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cc(Cl)n3)C2)C1 1835938102 LAZGKBMDHBOEFQ-OAQYLSRUSA-N 494.140 0.452 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cc(F)ccc4[nH]3)CCO2)C1 1836805271 RHCSRAJYJZMNDN-XMMPIXPASA-N 496.499 0.689 50 20 JCGD O=C(Cc1cscn1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921019 SNTKZGMEUHWTSH-UHFFFAOYSA-N 457.361 0.678 50 20 JCGD O=C1Cc2cccc(C(=O)N3CCC(OC4CCN(C(=O)c5cccc(B(O)O)c5)CC4)CC3)c2N1 1837921412 ILPLAITVZCPGDU-UHFFFAOYSA-N 491.353 0.787 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3nccc4nc[nH]c34)CC2)CC1 1838052961 BZEZBSZKPDFJSJ-UHFFFAOYSA-N 492.540 0.882 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnn3C)C2)C1 1838527148 JSZFCPSZZVFCHN-JOCHJYFZSA-N 487.469 0.637 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Cl)COC)C3)C2)ccn1 1838722644 GSKCPVHPPVTDJG-IERDGZPVSA-N 469.922 0.582 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1 1839197830 JIQNOFRFPDNRKQ-QAPCUYQASA-N 473.299 0.801 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CCOC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1840190696 IMVBWIXMGVMZEA-UXHICEINSA-N 496.388 0.618 50 20 JCGD COc1ccc(COCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1840254580 ANZMQERZDIKITC-XMMPIXPASA-N 492.573 0.041 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)COC(=O)C(F)(F)F)C1)NC(=O)NCc1ccccc1 1844207167 VPZNQKYZWSKBEN-UHFFFAOYSA-N 485.463 0.642 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c(C)c1 1844265560 OPMYIVHUXODSFC-UHFFFAOYSA-N 451.483 0.911 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cnc(O)nc1O)C2)NC(=O)NCc1ccccc1 1845038658 FEHRZDZBQTZVKF-UHFFFAOYSA-N 469.502 0.051 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1COC3(C1)CN(C(=O)OC(C)(C)C)C3)C2 1846386030 WMTBFALJNAYTCH-QGZVFWFLSA-N 493.605 0.589 50 20 JCGD O=C(NNS(=O)(=O)c1cc(Br)ccc1Br)[C@H]1CCS(=O)(=O)C1 14870808 NKJAMLQKALXMHK-ZETCQYMHSA-N 476.168 0.956 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)OC)c2)c1 20901054 VBJWISGGXALRPG-UHFFFAOYSA-N 498.583 0.974 50 20 JCGD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNc1ccc(S(=O)(=O)NC2CC2)cc1 726862599 WCNAQQBUUYQIIO-UHFFFAOYSA-N 461.456 0.904 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)C1 728260599 KKTSBSZAJHCCMI-QLFBSQMISA-N 493.629 0.097 50 20 JCGD CN(C(=O)CN1CCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1)C1CCCCC1 728577031 WZMNCDVQOZHYLZ-UHFFFAOYSA-N 460.535 0.765 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O 728848222 HLCJKLCVYQXAFS-UHFFFAOYSA-N 470.511 0.461 50 20 JCGD O=C(CN1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1)NC1CCCCC1 728961468 IKQVWUNCTFXBRT-UHFFFAOYSA-N 472.594 0.500 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)c(Cl)c2)c1 748689019 FSXHTIWPQIVBHG-UHFFFAOYSA-N 491.931 0.677 50 20 JCGD NS(=O)(=O)Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1 749715698 QFGQPLVKVKUOBQ-UHFFFAOYSA-N 480.568 0.725 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)CNc2ccccc2OC)o1 915064798 QCYZOMHBDXZUGK-OAHLLOKOSA-N 494.526 0.878 50 20 JCGD O=C(NCc1cn2ccsc2n1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916218075 HRMRPKJRUZJWHZ-UHFFFAOYSA-N 464.529 0.561 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)c2ccccc2c1=O 916253758 KBBLATPLTCZUGB-UHFFFAOYSA-N 464.548 0.613 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cc3c(s2)CCC3)cc1[C@@]1(C)NC(=O)NC1=O 917722503 DMGZZMXNQOUJNX-LJQANCHMSA-N 464.525 0.923 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(S(=O)(=O)N(C)C)cc1 918105108 OOFQAUURXKRVMU-AWEZNQCLSA-N 497.599 0.892 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc(CN3CCOCC3)c2)cc1 918223415 GZSJXOXXXDETFK-UHFFFAOYSA-N 489.598 0.978 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)Cc2ccccc2)ccc1Cl 920287458 CTBYPUDVSOMWCO-MRXNPFEDSA-N 464.931 0.982 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2 1779404661 XGYDZSLDICQXIF-FRQCXROJSA-N 477.352 0.780 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097354 YNRWQKFAFNBBHS-IERDGZPVSA-N 477.474 0.411 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(-n2ccnc2)ccn1 1780215057 LRKCNIWIUMENCM-RCZVLFRGSA-N 489.341 0.388 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]nnc3n1)C2 1780712807 DTVYLGYJTQRCNB-OCBCSQNSSA-N 472.333 0.176 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780936179 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C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784093180 PWGCYHLWHHJRIS-IDOKYYSUSA-N 455.914 0.523 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786980195 UIRSILWIMXTPPE-WDSOQIARSA-N 489.378 0.263 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc[nH]n3)[C@H]2C1 1787221475 LTWOQEQRMRMRHA-NUTKFTJISA-N 458.431 0.545 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1csc(Br)n1 1787725798 XKLGUIGHFSYJGM-NOLJZWGESA-N 494.176 0.493 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc(C)n1 1787731298 VXYJPDNTDYARDA-HSQYWUDLSA-N 451.332 0.539 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)no1 1788142334 PVYLKHYXNAEHBB-UHFFFAOYSA-N 476.298 0.841 50 20 JCGD C[C@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)N1CCN(C)CC1 1788144283 FONNAHQUAYFFKD-GOSISDBHSA-N 464.375 0.750 50 20 JCGD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)[C@@H]1SC(=N)NC1=O 1788634260 PXBLMMOILMTQDE-ACJLOTCBSA-N 480.355 0.917 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/O[C@@H]3CCCCO3)[C@H]2C1 1788659295 HPSNCCIWGBTPDN-YTDLAWOASA-N 488.545 0.629 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cn4c(nc3=O)SCC4)[C@H]2C1 1789707651 HCIKCIVQEBKSLF-HNKHHVNMSA-N 454.980 0.889 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(-c2ccccc2)on1 1792406915 AAGFOSAKEGPRQA-OPMZPASUSA-N 461.283 0.538 50 20 JCGD C[S@](=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1792893965 OBGOCTKHOXPEAX-PTEKZVAISA-N 480.027 0.886 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc(-c2ccccc2)n1 1796535202 JDGDGTWAQALWKF-IRJINJETSA-N 471.322 0.945 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3C1)C2 1797754036 PXSQGGUTFCJJTI-VWNVYAMZSA-N 463.538 0.693 50 20 JCGD 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O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1n[nH]c2c1CCCC2 1835002393 OONOZWYCTXJSEL-UHFFFAOYSA-N 479.390 0.467 50 20 JCGD COc1cc(C(=O)N2CCC(N3CCC(NC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CC3)CC2)nn1C 1835117605 DGFAJPLLBLHWLZ-JVWAILMASA-N 498.588 0.748 50 20 JCGD COc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)ccc1O 1835738317 VMZMEZQKFVANOT-UHFFFAOYSA-N 496.568 0.898 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1 1835837454 HXCVLIJLWPVSRG-UHFFFAOYSA-N 451.600 0.925 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835934129 LUFNWXZIINKHLU-KOSHJBKYSA-N 452.316 0.240 50 20 JCGD Cc1oc(C(C)(C)C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935289 MZGZDGYIRUDPDA-RUZDIDTESA-N 484.358 0.949 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837715348 LRMDNYQXCMJJIY-UZLBHIALSA-N 451.600 0.585 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921568 ONHMVFVZGKOGIA-MRXNPFEDSA-N 476.335 0.540 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(O)c4ccn(C)c34)CCO2)C1 1838439709 IKOOLQCJIDXTKP-IIBYNOLFSA-N 466.922 0.603 50 20 JCGD CC[C@@H](NC)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528349 SHPODOGOLLMVHP-XMSQKQJNSA-N 478.502 0.588 50 20 JCGD N#Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1Cl 1838595839 FBEKQEVZVNTUDW-HSZRJFAPSA-N 483.717 0.275 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)ccc1F)CCO2 1838860541 LOUHCALYXDIJDC-OAQYLSRUSA-N 454.474 0.408 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1839150865 ZYXCGFVFRDVGOZ-IAGOWNOFSA-N 464.306 0.484 50 20 JCGD O=C(c1ncc(Cl)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839197790 IJKIVERZHUDLFN-NHYWBVRUSA-N 451.680 0.891 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1 1839630695 OMEFBVNSFXZXJP-KPZWWZAWSA-N 452.309 0.811 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1 1840077723 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CC(=O)Nc1ccc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1843912039 LETZQBAKICTNOB-UHFFFAOYSA-N 450.499 0.703 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O 26737262 IUAVPNQOIBLWRW-UHFFFAOYSA-N 452.467 0.683 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@H]2CCCO2)c1 725739217 AHAFYIBDWYBINV-CYBMUJFWSA-N 484.918 0.581 50 20 JCGD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 727609349 JVOVDUYOONMNEQ-GFCCVEGCSA-N 468.561 0.593 50 20 JCGD C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728889389 GJYMMNRXMPQRHX-ZDUSSCGKSA-N 466.951 0.861 50 20 JCGD CN(C)C(=O)COc1ccccc1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 769254964 XPIOUOQODLFTIR-UHFFFAOYSA-N 454.892 0.529 50 20 JCGD COCCn1c(C)cc(/C=C(\C#N)C(=O)OCCn2cnc3c2c(=O)n(C)c(=O)n3C)c1C 916418692 JVDNDQSGVMZFFM-GZTJUZNOSA-N 454.487 0.649 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NC[C@H]1CCCCO1)N(S(C)(=O)=O)CC2 920344170 OKGXBYYFZSRFRD-NVXWUHKLSA-N 484.575 0.852 50 20 JCGD CS(=O)(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 1318317640 GQCPQGXKUKDFPF-UHFFFAOYSA-N 457.509 0.245 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccc3nc[nH]c23)C1 1777926189 BYXPBIRJDVFTJL-UZUQRXQVSA-N 478.513 0.398 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nc(CO)[nH]c3c2)C1 1778515419 UMNBMFCUWJFXNR-NTKDMRAZSA-N 486.573 0.556 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nncn4c3)C2)C1 1778594163 UNIJSODVFYLBTG-BHSKHCGUSA-N 464.486 0.307 50 20 JCGD O=C1Cc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)ccc2N1 1778923556 DONAKRGFOVPLOX-PXDATVDWSA-N 477.326 0.302 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)c(F)c1)C2 1779374564 OTRBHRGJYAQQMM-AUSIDOKSSA-N 471.489 0.971 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1779534164 ZQGTXBFYVQHHJN-GUWYOOCRSA-N 472.546 0.325 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)nn1C(F)F 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O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccccc3OC(F)F)C2)C1 1785144471 RYAHOGHWKFIOAT-QFIPXVFZSA-N 460.242 0.725 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(F)c3)[C@H]2C1 1786145489 NYOLDTAUTVRGJI-XCIGDDLJSA-N 456.478 0.948 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3scnc3C3CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979454 KVPUQVMLFDQSPO-SZMVWBNQSA-N 455.345 0.607 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]cnc3-c3cccnc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984742 DUPPOJPEFVGEPV-IHPCNDPISA-N 475.314 0.059 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc4cccnc4cc3F)C[C@@H]21)c1cccc(B(O)O)c1 1786984860 RMLSCRVGAKEENI-XZOYJPPVSA-N 491.328 0.890 50 20 JCGD Cc1nc2ccccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1787848393 PYZQXLZKMKSURH-IHPCNDPISA-N 462.315 0.230 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4cccnc4)[nH]n3)[C@H]2C1 1788935938 JMRZUICGEWZTLV-ZWOKBUDYSA-N 469.546 0.438 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788979883 RUXDABHQEABSHI-YSSFQJQWSA-N 487.749 0.721 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789921479 LRWNGJXNMXZPNM-HPCHECBXSA-N 482.347 0.542 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4ccccc4O3)[C@H]2C1 1791229066 GVVCZASRZYGPHF-MMKMLUHNSA-N 458.559 0.733 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(N4C(=O)C=CC4=O)cc3)[C@H]2C1 1792071926 KXANDMKIHFTSEU-IHPCNDPISA-N 497.552 0.082 50 20 JCGD COC(=O)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)Cc1ccccc1 1792982404 CQNPVFUXZDDAMJ-ZMMAXQRCSA-N 453.923 0.444 50 20 JCGD CN(C)CC[C@@](Cc1ccccc1)(C(=O)O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792984340 XPHQMOPVCZCOMY-NTOJSVKISA-N 496.004 0.441 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1nc2ccc(C(F)(F)F)cn2n1 1796189326 YRUBYADGVJCQMQ-BJWYYQGGSA-N 487.247 0.994 50 20 JCGD CN1CCN(c2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)cc2)CC1 1796189547 AOUPFSAZKPBINY-VILGAWFOSA-N 476.386 0.684 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CO)NC(=O)OC(C)(C)C 1796300124 JQFRNGRIVQKQDE-HPCHECBXSA-N 464.357 0.245 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1CC1)C2 1796908554 ZSNMAKCIFSQNOF-WOZUAGRISA-N 485.390 0.850 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(c2ccccn2)CC1 1799089096 GUUAXMGQXYVADX-OPMZPASUSA-N 493.568 0.200 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1C1CC1)C2)NC(=O)NCc1ccccc1 1799094854 DEBIHDMEVCZQFD-FPQOSCNCSA-N 469.586 0.968 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnccn1)C2)NC(=O)NCc1ccccc1 1799098224 CSHMNBVYXCZFCI-IRJINJETSA-N 495.584 0.345 50 20 JCGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cn2[nH]cnc(=O)c12 1799348813 PVTQUQSMSGCDLB-QPPBUOOMSA-N 456.272 0.225 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc(Br)c1F 1799497810 FYCKYWGTXHMIME-HBCWATKFSA-N 491.122 0.785 50 20 JCGD Cc1ccc(C(=O)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1800884134 MPQIUKMGCIMSCE-HGKCTWBKSA-N 451.483 0.080 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cc(C)c(O)nc1=O 1804091670 FJZUEAAVUBSMJF-MVRRYPJTSA-N 469.502 0.030 50 20 JCGD CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1804917574 RDPSMKJXTYESAP-PGRDOPGGSA-N 475.314 0.584 50 20 JCGD CCOc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1804917603 SLMCOTCZWINHGL-XMSQKQJNSA-N 475.314 0.584 50 20 JCGD CCn1nccc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1805915703 DIGZWSRKLRURMY-UZLBHIALSA-N 462.514 0.930 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374296 YRULRNWSXLCFCJ-NQIIRXRSSA-N 475.314 0.374 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc(O)n1 1808334545 XZYAZSGRIWFFEM-PGRDOPGGSA-N 460.299 0.804 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ncn(-c2ccccc2)n1 1808547869 FPBKKOROXSIWBE-OFNKIYASSA-N 496.336 0.976 50 20 JCGD CC(C)=NO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808845553 KJCOKOXVVMWKLD-BSIFCXSSSA-N 452.320 0.882 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@H]1c1cccnc1 1811452468 ZMRJFZXCHIHLON-IVIIRQTASA-N 476.497 0.619 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1812776133 HFNSNUBWELQAGA-DZKIICNBSA-N 477.296 0.986 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)c21 1815343763 OCNVILFXNFMOCD-CQSZACIVSA-N 491.338 0.955 50 20 JCGD CN1CCN(CCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)CC1 1817153735 OSMRDCKHKLSIJA-FQEVSTJZSA-N 468.367 0.033 50 20 JCGD Cn1nc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c2c1CCC2 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Cc1cccc(C)c1N1C[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1=O 1830726701 UAVUDDUTPYYHEG-YDIMBITNSA-N 493.988 0.712 50 20 JCGD O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830730737 DDLVXZRAAPKQJH-VGOFRKELSA-N 475.933 0.240 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830732148 VLGCLQRBPUFJFR-MRUHUIDDSA-N 475.970 0.300 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CCc2ccc(O)nn2)CC1 1831084263 VIZYJACEXPUYLE-OAQYLSRUSA-N 466.347 0.728 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCCc1ccncc1)CCO2 1833060009 PUHKZMZCSQBMAH-HSZRJFAPSA-N 461.563 0.234 50 20 JCGD O=C(NCCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)c1ccccc1 1833313874 ZBRXGONSALCKBN-FQEVSTJZSA-N 464.994 0.978 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc1 1834798478 ALFMXHQGCRGGJT-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD O=C(/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2)NCc1ccco1 1834823387 RETXPIWUDWRDOR-WUUFJKRQSA-N 484.347 0.693 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1834824186 VXEFXDGQGWEBDV-GQIGUUNPSA-N 472.380 0.629 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1834849310 ACTNVVRACSRLJZ-XMMPIXPASA-N 476.574 0.457 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835644757 FXKCRJFRPMJFQG-UKRRQHHQSA-N 467.336 0.313 50 20 JCGD Cc1nc(N)sc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1835806449 KIWZCAOAIIARRC-ABAIWWIYSA-N 451.318 0.794 50 20 JCGD N#Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(Cl)c1 1835931937 HSXZNLGMYGAEET-QHCPKHFHSA-N 483.717 0.275 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CC3)CC2)nn1 1836056427 HQSJNPJCEDDTNI-JVWAILMASA-N 496.572 0.804 50 20 JCGD O=C1NCc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCBr)C4)C3)ccc21 1837150190 UJEIMJRRXGFEGA-HXUWFJFHSA-N 466.332 0.785 50 20 JCGD CN(C)c1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)o1 1837387222 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CC(=O)NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839886224 OMZRRERZHWDJMS-UGKGYDQZSA-N 496.402 0.975 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(C)C(=O)CC3)C2)C1 1839962676 NUAGVNPRIBCEPI-UGSOOPFHSA-N 459.341 0.225 50 20 JCGD CC(C)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CC1 1839975194 VNODNOKENBXIDO-RLSLOFABSA-N 472.391 0.899 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1 1840032678 HDRXQUFWFCBPFY-XIKOKIGWSA-N 487.307 0.852 50 20 JCGD Cc1c(F)ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1N 1840184312 ZFMMOTZNJLBRPM-QFIPXVFZSA-N 465.526 0.159 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840185231 MQRBGESQLWABCV-DQJRMYJUSA-N 488.585 0.928 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3ccc(C)cc3)CCO2)C1 1840905515 KPLMFEFEKHBNPT-XMSQKQJNSA-N 467.950 0.435 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1 1841347843 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C[C@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NC(=O)C1CCCCC1 727292808 CVEXPKMNFKWPLY-MRXNPFEDSA-N 480.587 0.944 50 20 JCGD Cc1[nH]c2ccnn2c(=O)c1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 729283549 ILKSVUDPVMKDBF-UHFFFAOYSA-N 458.500 0.119 50 20 JCGD CCS(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 730515478 VGYSAOVSSOJUOD-GFCCVEGCSA-N 465.623 0.110 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)CN1C(=O)COc2cc(Br)ccc21 751201136 GAKBUSFZQTYEEG-UHFFFAOYSA-N 451.233 0.345 50 20 JCGD COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1 913055448 YMLGBDXPXVYWHO-UHFFFAOYSA-N 487.538 0.977 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cccn3C)CC2)o1 915191401 IMDHUOJUYFZJEC-UHFFFAOYSA-N 452.489 0.657 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)cc1 916112466 VRCNLKZLOAHYNB-UHFFFAOYSA-N 498.583 0.763 50 20 JCGD C[C@H]1CN(CCCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C[C@H](C)O1 916250084 VIFIYZGHSXXNGN-IRXDYDNUSA-N 467.592 0.914 50 20 JCGD 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1810306379 XREOWUGGFWMKFN-RJYYHGSASA-N 466.542 0.951 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@](C)(O)C(F)(F)F)[C@H]1c1cccnc1 1813067789 DNRMHFIJVCXPGW-FNHZYXHNSA-N 459.469 0.774 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813408045 UOOLGPRBKXKKPF-NYDSKATKSA-N 474.326 0.944 50 20 JCGD COc1nn(C)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337079 LLPHZOQEJZEQCU-CYBMUJFWSA-N 455.305 0.105 50 20 JCGD CCc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n(C)n1 1815344416 YNFPNIZGZVZPJE-HNNXBMFYSA-N 453.333 0.658 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356938 VRRVJQVTFWHYQI-WITJGNNASA-N 472.332 0.578 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)CC2)c1cccc(B(O)O)c1 1815360096 MIMIWHLIFDCTCC-AWEZNQCLSA-N 482.283 0.976 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)n1ccccc1=O 1817476072 DQKRCRCCYRFVFI-DNVCBOLYSA-N 463.303 0.818 50 20 JCGD O=C(CSc1ncccn1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1817592500 INEBBFCTDPYUPD-QGZVFWFLSA-N 466.332 0.978 50 20 JCGD COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)nn1C 1819403524 RBKOVVYBNVBZPV-INIZCTEOSA-N 467.490 0.770 50 20 JCGD CC(C)CNC(=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797326 SLWZKZXKBFPYAI-NSHDSACASA-N 459.532 0.140 50 20 JCGD Cc1nccn1CC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1821731203 TYLMVPHPURWNBS-QGZVFWFLSA-N 451.491 0.919 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1823790103 VYGIOFGTRGCISB-PMACEKPBSA-N 458.563 0.833 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCOC2=O)CC1 1824333648 QJPKPWXBQOSLLA-GOSISDBHSA-N 458.519 0.371 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1828492807 BKUGVYZDFBONOE-QFIPXVFZSA-N 499.616 0.083 50 20 JCGD CNc1nsnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1829755875 OOXWURPUUBIQIY-HZMBPMFUSA-N 452.306 0.340 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1830535853 UUINHHPHNGSIKT-AUUYWEPGSA-N 488.404 0.965 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)nn1-c1ccccc1F 1830723820 QTTKVOFPUGPJPV-PGRDOPGGSA-N 496.923 0.690 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cn1 1833437152 ZLFVBFZRYNSNOF-UGSOOPFHSA-N 457.325 0.729 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnc(N(C)C)o3)CC2)CC1 1834098949 ZKCCTJSEUDFVBM-UHFFFAOYSA-N 463.583 0.299 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1834821628 QMTYRNOMEWLBBB-GOSISDBHSA-N 452.309 0.584 50 20 JCGD CC(=O)c1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n[nH]1 1835737156 PKDOBCBPTAHVHR-UHFFFAOYSA-N 482.545 0.110 50 20 JCGD O=C(c1ccc2scnc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930784 ZMRSXXFAGHDDDD-HSZRJFAPSA-N 481.339 0.360 50 20 JCGD Cc1cc(C)nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457814 SLTMUEVQHXHLTL-QHCPKHFHSA-N 468.514 0.081 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1 1837459208 MPRZWQWTLGYFRB-GOSISDBHSA-N 471.436 0.098 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1 1837653825 SNUFLSRWWFTOSZ-MRXNPFEDSA-N 464.357 0.835 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837709290 XBBLRLAGFXKHBQ-IIBYNOLFSA-N 489.642 0.180 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1 1838498348 KQPDELSXGHKDFX-IERDGZPVSA-N 463.922 0.796 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccc(F)cc1 1839038830 DQBZUYHJWYVVKE-UEXGIBASSA-N 471.913 0.059 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3F)C2)C1)NC(=O)NCc1ccccc1 1839054090 GQIBNYGFXIDXSY-SFYKDHMMSA-N 477.537 0.147 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1839144991 PXSMARSUTMDZBP-ZHRRBRCNSA-N 464.950 0.964 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1OC 1839374528 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CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Br)CC)C2 1779201027 QDBGDWKRDSGRAE-HOPMXRPOSA-N 464.357 0.738 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)n1ccnc1 1779371054 AFRKZDUXCSEPFF-QXATTWAWSA-N 455.519 0.270 50 20 JCGD Cc1cc(/C=C/C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)no1 1779438452 HBXKPGYUWDBRMJ-VFCPGPMVSA-N 468.514 0.822 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1 1779597491 MZGXRFVKERSIHK-VWLOTQADSA-N 489.536 0.687 50 20 JCGD O=C1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)=Cc2ccccc2N1 1779985647 ORCNNPFDRSPIJU-RUZDIDTESA-N 475.310 0.236 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)Cc3nnc(C)o3)CCO2)C1 1780096837 IKENUVJVBIRYJN-NRFANRHFSA-N 473.442 0.898 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCS3(=O)=O)C2)C1 1782952997 JVPNNMSAVLPNJX-AVYPCKFXSA-N 494.010 0.526 50 20 JCGD 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COc1ccc(F)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791292622 YIVDJZLGPNDMPS-FNHZYXHNSA-N 450.511 0.801 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1793118262 KKBXPPUUVIWFEJ-FZDIXFNVSA-N 459.352 0.779 50 20 JCGD CNC(=O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1793285391 DCKQENZAXVUJIE-YYAJDYIMSA-N 452.349 0.718 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(C)CCCN1)C2 1793879261 SRXOIVVNIFDTCI-QKQGURCUSA-N 458.987 0.850 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc(O)nc(O)c2C1 1794112397 TYCZQXGCIDGDTB-PKXQRHIVSA-N 473.357 0.819 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1795518744 CLFYBTVXLLVTKU-XLWJZTARSA-N 492.980 0.267 50 20 JCGD Cc1cc(C)c(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(C)c1 1795732751 GFGSSCDDEZLSDW-JHDGKUDLSA-N 466.343 0.574 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3ncccc3c1)C2)c1ccc(B(O)O)cc1 1795733021 YFKYUNIYTUQIHM-IRJINJETSA-N 459.311 0.361 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(-c3ccccc3)ns1)C2)c1cccc(B(O)O)c1 1795739200 ZRUMPPSNSQBAII-IZZQQSIFSA-N 478.339 0.402 50 20 JCGD Cc1noc(-c2ccccc2)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1796476973 MURIMBJOZSHHDH-HATOLVCRSA-N 475.310 0.847 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(c2ccccc2)C(=O)C1 1796934445 FPBBGJYRJXGDQK-ACHSLPGTSA-N 475.509 0.730 50 20 JCGD CC(C)(C)OC(=O)N1CCn2cnc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)c2C1 1797314692 HMKRPHNURZXZIE-FSDCSDTHSA-N 497.980 0.437 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(C)CCCN1 1799218865 RSZVDVDDSBTUEE-DAMNHTQYSA-N 460.487 0.865 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(C3CCN(C(C)=O)CC3)CC1)C2 1800978141 MARQPIGMOSAXEK-MXNKGDRCSA-N 499.052 0.553 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)n1)C2 1800978559 UXRBUIJDNPRODY-RCJHGTSTSA-N 452.939 0.375 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCN1C(=O)OC(C)(C)C)C2 1801012755 JQCVPBRBOMWKLY-AXVVYFOYSA-N 481.594 0.349 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)CC(N)=O)[C@H]1c1cccnc1 1803664397 ICXVQSSDUXGCRJ-CGGUUQLTSA-N 467.530 0.733 50 20 JCGD CCc1[nH]nc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1F 1805175428 NLIPZTVDRCZFNO-IIBYNOLFSA-N 465.294 0.819 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807359631 BMRKCJZLAFBRJQ-ZWDAVXSWSA-N 466.347 0.386 50 20 JCGD NC(=O)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc1 1807375214 QMLUUBUHXWYIMO-RBBKRZOGSA-N 472.310 0.494 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809967805 MLGWZZHPJZCXID-IBGZPJMESA-N 489.378 0.097 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1 1810084300 NOPKOHNOZHIAJJ-QVKFZJNVSA-N 485.508 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1 1810306377 XREOWUGGFWMKFN-QUJKESNLSA-N 466.542 0.951 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1810514655 OCGDBTVHPQXTMU-NRJQMVOHSA-N 460.579 0.765 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810540625 GLHCPSAYGRXLQE-NQIIRXRSSA-N 455.396 0.933 50 20 JCGD O=C(CN1CCCCC1=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1812973424 DRBNUAMQFWJGDM-AUSIDOKSSA-N 464.331 0.094 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1 1813071353 SMXLSLQLUAEHDE-WMZHIEFXSA-N 455.563 0.974 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)COc2cccnn2)[C@@H]1c1cccnc1 1813388196 XETUOOKFUDGFIH-KKSFZXQISA-N 476.497 0.269 50 20 JCGD C/C(=C/C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(=O)O 1814097130 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C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)N1C[C@H]2C[C@@H]2C1 1819797703 GSEGUHHPAITELR-AAVRWANBSA-N 469.571 0.708 50 20 JCGD COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)nn1 1819797932 ORQWWIRPGDWYSM-SNVBAGLBSA-N 468.499 0.480 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1C[C@H](O)CN1)CC2 1821304893 USCXDBKUKAXBJZ-FFSVYQOJSA-N 489.510 0.925 50 20 JCGD CN1CCN(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1827051350 UCMCXWYPHOKMLJ-HSZRJFAPSA-N 470.423 0.237 50 20 JCGD O=C(CCNC(=O)c1ccccc1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1827964356 BVUVGCGPNJMBBJ-GOSISDBHSA-N 492.366 0.869 50 20 JCGD CC(=O)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829300626 GZNHSGWQFONOGI-XMSQKQJNSA-N 480.949 0.174 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)COCCO)C2)C1 1829341116 XHQMGBQZRNGWLL-CVDCTZTESA-N 497.976 0.701 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nc2ccc(Cl)cn12 1830735748 MMWZNZFPNHRNCT-FOIQADDNSA-N 471.341 0.966 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833397055 REVALRBFLCJDRM-YLJYHZDGSA-N 473.979 0.963 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798353 LBEQHZOYPQMALW-UHFFFAOYSA-N 467.379 0.134 50 20 JCGD O=C(c1ccc2cnccc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930248 FILGHPYIRDOZQW-VWLOTQADSA-N 475.310 0.298 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)C3(c4cccc(Cl)c4)CC3)C2)C1 1835930325 GRJCTUWTBFJPCA-DEOSSOPVSA-N 498.772 0.822 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(s3)CCCC4)C2)C1 1835937165 QPCIXIPBWLTXLJ-DEOSSOPVSA-N 484.383 0.691 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1nn[nH]c1C(F)(F)F 1836175887 QKIXLNVTKLXVKK-GFCCVEGCSA-N 452.865 0.608 50 20 JCGD O=C(c1ncn2nc(N3CCOCC3)ccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1836289753 GSQDQPLKSGPCBW-WIYYLYMNSA-N 496.927 0.170 50 20 JCGD O=C([C@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)CCO2 1836687592 MHUTUSGEBPMLFR-XQBPLPMBSA-N 469.941 0.878 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)ccn1 1837921318 ZAKSNXBNSRHGOU-UHFFFAOYSA-N 451.332 0.996 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)ccc1F)CCO2 1838858491 KFHFDPOFOZCDMN-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD O=C(c1cnn2cccnc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200818 NWIDTRNZFVDXEB-CXAGYDPISA-N 456.272 0.490 50 20 JCGD Cn1cnc(C(=O)N2CCOC[C@@]3(CN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)CCO3)C2)n1 1839743453 RRDVIQUZPGSYRZ-XXFFJTNUSA-N 472.452 0.770 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1)n1cnnn1 1839743806 WTXRJYSHAXKVET-RWSPSULHSA-N 487.467 0.576 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1 1840036366 JDGYWIBWAVONSF-NJSLBKSFSA-N 455.353 0.754 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1840154998 MHXNDWZBXBULRL-LIRRHRJNSA-N 455.874 0.192 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nc[nH]c4c3)C2)C1 1840184365 IJQUVIODGJMJBQ-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184444 MZJMIHKXZNMHRD-OAQYLSRUSA-N 478.575 0.147 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840935482 HHZRKTAZCGJQRB-HSZRJFAPSA-N 480.537 0.206 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC2(CCCN2C(=O)CNCP(=O)(O)O)C1 1842875021 TZILMVPJTAJOPK-MKMNVTDBSA-N 454.370 0.800 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2n[nH]c3c2CCc2ncccc2-3)C1 1844663103 AEUGNGUYGKGYJS-UHFFFAOYSA-N 472.509 0.700 50 20 JCGD CC[C@H](CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)NC(=O)OC(C)(C)C 1845234429 KJBFKCWEQKOGKU-GOSISDBHSA-N 459.352 0.877 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@@H](O)CCN2Cc2ccccc2)C1 1845837162 RTANKVYHJGSIMW-UGKGYDQZSA-N 457.575 0.198 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]1O3)C2 1846385526 QKGSAZYJLATDQB-FGTMMUONSA-N 493.605 0.587 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1 1847556421 KMEQDDIDEFIWQM-LUKYLMHMSA-N 467.954 0.976 50 20 JCGD Cc1nc(N2CCOCC2)[nH]c(=O)c1CCC(=O)NNC(=O)c1cc(Br)c[nH]1 21408708 SWROBRYLBSZHTH-UHFFFAOYSA-N 453.297 0.399 50 20 JCGD O=C(CNC(=O)c1cccc(Br)c1)NNC(=O)c1csc(N2CCOCC2)n1 21967541 BWQYPZROAYJEQP-UHFFFAOYSA-N 468.333 0.933 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)NNc2ccc(S(=O)(=O)Nc3ccccc3)cc2)n(C)c1=O 728215490 MKVWSPYDKDXUHZ-UHFFFAOYSA-N 483.510 0.378 50 20 JCGD C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)C1 728958590 AWBGEEUBHRFKFZ-KDURUIRLSA-N 486.621 0.556 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc2c(c1)n(C)c(=O)n2C 747693311 TZKPQGVMRFTSEZ-UHFFFAOYSA-N 466.545 0.102 50 20 JCGD Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)cn1 747778063 ANFDOQWABLAWKF-NRFANRHFSA-N 482.566 0.473 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C1=C(C)C(C)(C)OC1=O)c(=O)n2Cc1ccccc1 748531201 GXCKCOKIAMQQRD-UHFFFAOYSA-N 494.508 0.227 50 20 JCGD CC(C)CC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N3CCOCC3)ccc2n1C 789852532 KYRGYGMAHIIPIR-UHFFFAOYSA-N 451.549 0.720 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1 789856924 NYCKBYFZHCFSAV-UHFFFAOYSA-N 493.586 0.081 50 20 JCGD Cn1nc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c2ccccc2c1=O 818483836 AMCBPIGWSPQGHA-JOCHJYFZSA-N 466.429 0.301 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2c(Cl)nc(N)nc2N2CCOCC2)cc1 874061417 OGKWOXWVRMKAGB-UHFFFAOYSA-N 481.966 0.628 50 20 JCGD CSC[C@@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 912852199 PSIIZTYGQJBITM-GUTXKFCHSA-N 481.600 0.648 50 20 JCGD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2)[nH]1 915190574 IVPXGWDYIZZVDE-UHFFFAOYSA-N 462.422 0.605 50 20 JCGD NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=S)Nc1cccc(Cl)c1 915267730 OHAZIJZHANIDBB-UHFFFAOYSA-N 455.905 0.913 50 20 JCGD CS(=O)(=O)NCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 916294951 WRTSDJVENANXAZ-UHFFFAOYSA-N 489.963 0.634 50 20 JCGD CCc1ccccc1OCC(=O)NNC(=O)CNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 916560051 OZKAAMFEBNVJBG-UHFFFAOYSA-N 462.528 0.456 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)n1 916649081 HZNQVJYCHUKDMH-QGZVFWFLSA-N 464.548 0.488 50 20 JCGD COc1cccc(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1OC 918218571 XJUHUSQBWWVSLH-UHFFFAOYSA-N 478.575 0.904 50 20 JCGD O=C(COC(=O)[C@@H](CO)NC(=O)c1cccc(Br)c1)NNC(=O)c1ccccc1 920654119 IHJZLIBSIRCHQD-OAHLLOKOSA-N 464.272 0.544 50 20 JCGD CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)s1 1115872247 DWIVFYPUHBJMGK-SNVBAGLBSA-N 459.575 0.862 50 20 JCGD C[C@H]1CCc2c(C(=O)N3CC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)n[nH]c21 1777849288 DVFBHLDWFPULBL-XMHCIUCPSA-N 453.503 0.215 50 20 JCGD CN1CCc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)ccc21 1778645055 YZGKIOPYGJOPTA-ZEQKJWHPSA-N 477.370 0.800 50 20 JCGD Cn1cc2cc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)ccc2n1 1779037166 RSRBAKPWIBBYTM-QHCPKHFHSA-N 463.498 0.329 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cccn2cncc12 1779130119 FUEGGQVLWXCIRF-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3cncc23)C1 1779134033 HDTWGVWOAOTBEQ-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)[C@H]1ON=C(c2ccccc2)O1 1779259406 QXPKHTVGAQLBRE-IMAQQZIHSA-N 451.907 0.835 50 20 JCGD O=C(c1n[nH]cc1I)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1779542681 AOIIZYJHRLXQBO-HZMBPMFUSA-N 468.679 0.058 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]cnc2-c2cccnc2)C1 1780035389 QPIWLFRDSFGVJO-HOYKHHGWSA-N 483.573 0.972 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)NC(=O)NCc1ccccc1 1780968514 MEPUEGCKWRODAV-HXUWFJFHSA-N 472.373 0.966 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781229996 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0.270 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3)[C@H]2C1 1786484657 PTHWYOFUWGXQFP-YSSFQJQWSA-N 453.499 0.357 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C[C@@H]21)c1ccc(B(O)O)cc1 1786980043 CCCXLTSYVSFUAE-ZZMFMQDLSA-N 466.265 0.692 50 20 JCGD CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CS(=O)(=O)C4)[C@H]2C1 1787151354 WHKKYSFEVPSFRF-DUPGQFARSA-N 458.968 0.839 50 20 JCGD Cc1cc2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)[nH]c2cc1C 1788548214 IJDZNDAADRBBGH-JLMWRMLUSA-N 476.342 0.767 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609878 QLROJOXXBOTCOQ-ALGWMNEGSA-N 467.526 0.746 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cccn4)cc3)[C@H]2C1 1790111289 QXDRBTHYHZFWSR-JBACZVJFSA-N 468.558 0.839 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1790666516 MMGXANXGBFZOGF-PXQJOHHUSA-N 465.978 0.201 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c(F)cccc34)C[C@@H]21 1791291058 JSEWHLJJOBURJB-QRTARXTBSA-N 460.510 0.668 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C[C@@H]21 1791292216 HRXTXLKWXIGDSC-ULQDDVLXSA-N 481.594 0.396 50 20 JCGD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(O)c1 1791925698 UHJGNVCWDFRHBV-DCPHZVHLSA-N 453.499 0.606 50 20 JCGD CC(C)(Cc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1792875050 QKJWNWHRTYXMQR-VTYHHJSWSA-N 450.344 0.839 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(Cl)c(F)c1 1793295176 PUYKOCOQZPMHMF-GFENJXEQSA-N 470.929 0.821 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795737527 RHTGFQFPTASPBF-NHKMSHSESA-N 480.326 0.241 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H](O)CN1C(=O)OCc1ccccc1)C2)[C@@H](F)Cl 1796370388 HZELMWFYAFYSCY-CABLIKTCSA-N 483.924 0.882 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(C)noc1C)C2 1796439620 RZEWCZPSDJEBPP-BPDXKDCOSA-N 456.503 0.558 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Cl)ccc2c1OCO2 1796939389 PAQSSHXBJBNDLM-DBWKPXFBSA-N 466.922 0.645 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccc2n(C)c1=O 1796998908 FRYTVEGBGSTMOP-JFILPPLUSA-N 463.332 0.920 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)COC2 1797013749 DTILLIPHJBMMEI-XEMDLRDOSA-N 451.483 0.232 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1COc3ccccc3O1)C2 1797748570 IXDHJTBIDAKKHT-JEZSTIGHSA-N 481.509 0.118 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799759032 FUZQPMOCZBVDSS-YVWYUNDQSA-N 471.250 0.239 50 20 JCGD COc1cccc(Cl)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1801798687 QZHSPFKDLJEBMG-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)[C@@H]1C[C@H](O)CN1C(=O)OCc1ccccc1 1802025027 INGOJVCIEZDFRC-CABLIKTCSA-N 483.924 0.882 50 20 JCGD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)ccc1[N+](=O)[O-] 1803819275 XBDKAWCRTVVJRD-BCDXTJNWSA-N 453.260 0.849 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1 1804086721 ACYFTOAASJPLEG-IFIJOSMWSA-N 466.336 0.670 50 20 JCGD O=C(Cc1ccc2ncnn2c1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807400987 OHOASUKNUWRGJD-RDPSFJRHSA-N 484.325 0.366 50 20 JCGD O=C(Cc1ccc(F)cn1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807477153 HLMIVUGGOLEOFS-JPYJTQIMSA-N 462.290 0.858 50 20 JCGD C[C@H](NC=O)C(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1808373360 SFGBWANISSNIGN-QTGUNEKASA-N 495.584 0.568 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)CC2)C1 1809974035 NSPOAADCRLWDFQ-HSZRJFAPSA-N 474.370 0.977 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810323694 IAORBHWAFVBLIE-LUQKVYGDSA-N 489.540 0.690 50 20 JCGD CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1812777164 QTOHPNCIOYBASY-WWGRRREGSA-N 489.334 0.701 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CCn2ccnn2)[C@@H]1c1cccnc1 1813430362 NOLQSAQELYWQLU-TYTKVZDVSA-N 477.529 0.903 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(C(=O)O)ncn2)n[nH]1 1816155512 DNLLGZHCASBDRR-HNNXBMFYSA-N 458.479 0.577 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1ncc[nH]1)CC2 1819801256 HKGGWNSJZCUYEB-NSHDSACASA-N 454.516 0.723 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)n1ccccc1=O 1820125064 NQIRTLPYURRKJJ-BBRMVZONSA-N 466.328 0.472 50 20 JCGD CC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)CC2 1822841104 HXQIDAYYVPEPJR-WDEREUQCSA-N 493.977 0.520 50 20 JCGD Cn1nc2c(c1C(=O)Nc1nc3c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC3)CCC2 1824238319 VNZRCPATXQCCQI-AWEZNQCLSA-N 465.344 0.585 50 20 JCGD O=C(O)c1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)ncn1 1827050217 ITCONZXCWMQMSY-HXUWFJFHSA-N 466.303 0.402 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC[C@@H]1C1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC1 1827050815 ZPEPNKZLEQJGNQ-MRXNPFEDSA-N 488.243 0.955 50 20 JCGD O=C(c1ncon1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828550974 FOSUNXFSXGJBHT-IERDGZPVSA-N 477.905 0.735 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2c[nH]c(=O)cn2)CC1 1828924532 WVYKCUBBERMBNP-SFHVURJKSA-N 453.503 0.316 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(C(F)(F)F)n1 1830731083 GWRWSDXBUGZWCF-UGSOOPFHSA-N 481.855 0.779 50 20 JCGD CN1CCCn2nc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)cc2C1 1831043087 JUAIOTOQVGGSGY-XMMPIXPASA-N 493.417 0.946 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C1(O)CCC1 1833067264 DXBQPLMKBVDOJG-KRWDZBQOSA-N 457.380 0.103 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1833262604 YAEDMGDSRLGQST-AWEZNQCLSA-N 495.422 0.843 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1833761684 FRKYURVFDDSIMS-WFASDCNBSA-N 472.384 0.187 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)CC1)c1ccc(B(O)O)cc1 1834797502 QBWJZJQAGOVFSE-DEOSSOPVSA-N 493.369 0.392 50 20 JCGD Cn1cc(CCC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1834820568 LBZNOLLYZIHKFI-UHFFFAOYSA-N 482.589 0.237 50 20 JCGD COCCOCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1835247908 CBIUVYQZLPUJTD-DRTMAPTHSA-N 479.480 0.991 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)COCc3ccccc3)CCO2)C1 1835366966 ACWUPNSMBCEDGD-AYDYRGASSA-N 497.552 0.794 50 20 JCGD Cc1ccc(F)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835933856 FDXISLPHTYYXNT-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(F)c(F)cc3F)C2)C1 1835939344 NAHMOLAHIXHGOI-JOCHJYFZSA-N 478.232 0.168 50 20 JCGD CN(CC(=O)NC1CCN(C2CCN(C(=O)CC#N)CC2)CC1)NC(=O)NCc1ccccc1 1836343538 IVVYQSRSJGIWMQ-UHFFFAOYSA-N 469.590 0.818 50 20 JCGD O=C(c1ccc2nncn2c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837019906 OZYYNPNBXVSAIA-YOEHRIQHSA-N 456.272 0.490 50 20 JCGD Cc1cc2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)[nH]c2cc1C 1837342047 RKKLPOLDGWUSBF-UTKZUKDTSA-N 450.923 0.849 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3Cl)C2)C1 1837458777 BIWMFRJKULGDNX-NRFANRHFSA-N 474.905 0.117 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)CCO2 1837474392 GGUNMOQFXGSIQI-CDNNERCOSA-N 488.610 0.704 50 20 JCGD CCc1oncc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837568033 BBKSMWVNSDDKKN-UHFFFAOYSA-N 455.320 0.843 50 20 JCGD O=C(c1ccnc(Br)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837810384 IPOLOEWSKKYWFQ-GUYCJALGSA-N 462.728 0.514 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1838404351 NRSKZIDKXJDLIR-UYAOXDASSA-N 466.406 0.872 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H](O)C3)C2)C1 1838528102 FNSYKZXAFAFIRX-JIGPKXGUSA-N 477.470 0.361 50 20 JCGD Cc1cn(CC(=O)N2CCC(OC3CCN(C(=O)[C@@H](F)Br)CC3)CC2)c(=O)nc1O 1838649356 HSVOIYBJYWXNMM-MRXNPFEDSA-N 489.342 0.946 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c2ccccc21 1839201297 UGPJIVQJNXGUKE-YLJYHZDGSA-N 499.337 0.487 50 20 JCGD O=C(c1cccc(N2CCOCC2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839343402 COPRYBKZTLCSMY-UGKGYDQZSA-N 467.950 0.193 50 20 JCGD COc1c(C)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1C 1839392947 POOWGADHBQCXGU-VWLOTQADSA-N 482.342 0.376 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn3c1OCCC3)CCO2 1839517286 SYYUHBDWTLANEL-GOSISDBHSA-N 457.325 0.521 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1 1839967265 HEIVIXPFAFKNCW-BXWFABGCSA-N 462.385 0.921 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840106523 PGIWLUKZZHUNOA-BEFAXECRSA-N 460.369 0.629 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1 1840153158 GBNMYEHNIRZWJI-QVKFZJNVSA-N 463.922 0.796 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cc(C)cnc34)C2)C1 1840153274 JOBWODNNXIVEGM-OXJNMPFZSA-N 451.911 0.362 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1 1840156795 UATQQHPVBPPTOS-FOIQADDNSA-N 492.953 0.553 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Cl)COC)C2)C1 1840909351 YDJUBUPCXJPVDO-HYFFOGBASA-N 487.981 0.613 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cnc(O)nc2O)C1 1843351061 FSJHKDKDWOHRCY-LBPRGKRZSA-N 455.899 0.837 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)C[C@H]2C1 1846105260 JTEUHEILWICWBJ-AVRWGWEMSA-N 483.374 0.831 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc3nnc(Br)n3c1)C2 1846384715 ZSHAMZIWGBIKJG-UHFFFAOYSA-N 478.351 0.682 50 20 JCGD COc1cc(C(=O)NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1OC(C)C 21968952 PTJJNPUDRRWPHN-UHFFFAOYSA-N 492.554 0.924 50 20 JCGD C[S@@](=O)Cc1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 25961063 GYONWIXWIWPJNX-YTTGMZPUSA-N 493.607 0.980 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)Cn2cnnn2)ccc1Cl 725908224 YJKBQIFQUFYPMN-UHFFFAOYSA-N 465.879 0.597 50 20 JCGD O=C(CSCC(=O)Nc1cccc(Br)c1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 728204242 ZNOQMPZVIHAFGG-SNVBAGLBSA-N 464.363 0.703 50 20 JCGD COc1cc(OCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1[N+](=O)[O-] 728333782 SUPMUEJLOXHWPX-QGZVFWFLSA-N 461.383 0.513 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)C(=O)N3CCCC3)cc2)cc1 748246698 GCKVZCGTATVCCM-UHFFFAOYSA-N 487.538 0.507 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1)N[C@H]1CCS(=O)(=O)C1 749583665 SWUGCMLBDVNCGU-UONOGXRCSA-N 473.349 0.571 50 20 JCGD Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNC(=O)CN2CCCC2=O)c1O 789857511 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KSVJUQCMPUULTB-UHFFFAOYSA-N 491.551 0.670 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1OC 918776257 KVMYAYBUZSVCOY-UHFFFAOYSA-N 464.504 0.676 50 20 JCGD Cc1c([C@@H](C)NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cnn1C 1248703710 FKUAGDDDLAXOQD-OAHLLOKOSA-N 478.575 0.774 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1 1779036977 LATQUVUAKVEUFV-NRFANRHFSA-N 472.433 0.490 50 20 JCGD O=C(c1cc(=O)nc2cccnn12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1780059722 GFADUPYIWXJEIK-PBHICJAKSA-N 454.256 0.224 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1780717377 GQGHSOFPXYBNNZ-QFQXNSOFSA-N 493.369 0.749 50 20 JCGD O=C(COCCOCCOCc1ccccc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1783684395 ZFBBZNDOLCIAQS-REWPJTCUSA-N 484.977 0.666 50 20 JCGD COC(=O)[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)NC(=O)OC(C)(C)C 1784093644 CURYXKXYQZGVKG-RBZJEDDUSA-N 491.969 0.022 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1784633360 DFONAERBDVOZBX-KBMIEXCESA-N 497.600 0.929 50 20 JCGD O=C(Cc1ccccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1786516601 UCBDXXALIOHVLQ-CUWPLCDZSA-N 456.735 0.856 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1 1786979424 HQABRIXQQFQWMV-APTRMMRNSA-N 494.353 0.631 50 20 JCGD COCCn1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1787626005 KPIHEKJYHKKXRQ-VMTJOPIRSA-N 485.545 0.257 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4[C@H]3O)C[C@@H]21 1788607763 FVSYQSTUZYRKJS-CMUWLQQYSA-N 493.564 0.574 50 20 JCGD Cc1cccn2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)c12 1790505541 AFYBNEKSCKGDNB-YYWHXJBOSA-N 462.315 0.230 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccc(F)cn4n3)[C@H]2C1 1790528164 QIPDQDHCNYDFSB-ZEYHFOIASA-N 496.503 0.596 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1nc(N)n[nH]1)C2 1793880088 NTDSTLWRQLGWRP-ZWUHOBOKSA-N 485.973 0.041 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(C(F)(F)F)nc1 1794805941 NENNZFULJDWAHR-JLVBRIDZSA-N 463.221 0.297 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3scnc3c1)C2)c1ccc(B(O)O)cc1 1795734399 NYBLNJVEJWSQJG-CWPLJXCYSA-N 451.313 0.493 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)n(-c2cccc(=O)n2C)n1 1795934406 MPQFQOZVCPQGPV-ZTENYAIWSA-N 492.374 0.866 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(Br)ncc1F 1796619978 QVFMUMGIAOEBOL-IVWMJMPLSA-N 492.110 0.180 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnsn1)C2 1798522756 VTARQYTZGIUZMZ-DPIQGUFMSA-N 461.456 0.889 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)[C@H]1SC(=N)NC1=O)C2 1800638960 FHCGYMIBCSFANZ-PQCBQTOFSA-N 461.382 0.552 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1[C@H]3CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C3)C2 1801421815 YXBOUUBNIJWLBR-RSPOEFSDSA-N 494.357 0.254 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1807022890 BLESGBPFCCJFJG-XPKDYRNWSA-N 477.296 0.843 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C[C@@H](N)c2cccnc2)[C@@H]1c1cccnc1 1807263418 DOTNUSQMDNNSEC-AAIMPIBUSA-N 488.552 0.885 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccccc2-n2nccn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807367139 QKQLGSZXGUAKMS-HYBUGGRVSA-N 496.336 0.976 50 20 JCGD CCc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1807369488 LOXSIHADICDYTH-IIBYNOLFSA-N 465.294 0.819 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807374094 XUPLUNCKQWZNGQ-CTNGQTDRSA-N 496.373 0.994 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1810097532 LGKDNWPEEYSAAC-AEKCRQKESA-N 499.528 0.286 50 20 JCGD COc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1 1810303784 YHDRBBQGDIWMOE-QRWLVFNGSA-N 476.497 0.512 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1 1812392606 UAQBZYIOQMLALT-DZKIICNBSA-N 469.336 0.804 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(C(N)=O)cc2)[C@H]1c1cccnc1 1813739784 SGMCWCMDMLGFCN-SIKLNZKXSA-N 466.542 0.873 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1814031156 JIHANSMYNHWXSZ-KNQAVFIVSA-N 496.373 0.996 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)CC2)c1ccc(B(O)O)cc1 1815343708 KJTFKJPNNKJIRX-GFCCVEGCSA-N 455.261 0.599 50 20 JCGD C[C@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNCP(=O)(O)O)n[nH]1 1817235022 LLXVSFIGYBWSHH-GXSJLCMTSA-N 452.246 0.910 50 20 JCGD O=C(Nc1cccnc1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819528177 DCXDMTJNJLUEMP-GOSISDBHSA-N 462.275 0.429 50 20 JCGD C[C@](O)(C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)C(F)(F)F 1819793588 QTQVJPWMFICYNK-QPFGOUBPSA-N 472.449 0.681 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(=O)oc1)CC2 1819794642 AEOZCNZKNUAGHV-LLVKDONJSA-N 454.468 0.634 50 20 JCGD NC(=O)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cc1 1823119296 WTZOEMPYJVHBQT-LJQANCHMSA-N 461.287 0.808 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](F)Cl)CC3)N1 1824807733 BVYUXKIUIKLCON-JMLLCIOISA-N 489.982 0.770 50 20 JCGD Cc1cc(C(=O)NCC(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)no1 1826088268 VRKPEVBGXMPWPS-LBPRGKRZSA-N 477.547 0.155 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055152 UFYOQFSFYKFDFY-NRFANRHFSA-N 454.380 0.882 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1 1827537056 WTYMDMGOXWFPNO-HXUWFJFHSA-N 477.330 0.662 50 20 JCGD O=C(Cn1cnnn1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1829016660 CGEQUORPSMGEIC-HXUWFJFHSA-N 496.355 0.929 50 20 JCGD C[C@H](NC=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829220891 GHWCMSOYKRSIGE-SGXKBVARSA-N 480.949 0.173 50 20 JCGD CC(=O)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n[nH]1 1830535260 LBAKFWHKFXSFAL-KPZWWZAWSA-N 457.325 0.713 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830719296 BUHPHRRFZSTQCL-AUSJPIAWSA-N 463.959 0.203 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(=O)OC)CC1)CCO2 1832012257 CCCLZGSTXPQEFN-NWZZKEMCSA-N 460.955 0.676 50 20 JCGD C[C@H](NC=O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)CC1 1833726703 CSELIAMPNGVVOT-YJBOKZPZSA-N 488.029 0.825 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4c3CCCC4)CC2)CC1)c1ccc(B(O)O)cc1 1834797879 HFHCTIZXGIUGKK-UHFFFAOYSA-N 479.390 0.467 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(OC)c1 1834798429 UWBQWGOCVUVPGT-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)CSC(=N)N)CCO2)C1 1835516071 LCRVGVVDSHHZMY-LFEYGZQNSA-N 479.509 0.955 50 20 JCGD O=C(CCc1c[nH]c2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928018 ANGIJAJAQVXEDE-AREMUKBSSA-N 491.353 0.551 50 20 JCGD CC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835935721 NWINGYJZSBEDLE-RDGATRHJSA-N 466.343 0.630 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)nc(O)c3)CCO2)C1 1836419774 ZAKASCFWMOVPFN-ACJLOTCBSA-N 458.309 0.736 50 20 JCGD O=C1Cc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)ccc2N1 1836790243 CRNSECSOWMRXTR-LPHOPBHVSA-N 470.295 0.942 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCOc3ccccc3)C2)C1 1837456049 BDRYYAYFYGQXHQ-XMMPIXPASA-N 483.525 0.224 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Nc1cnccn1)CCO2 1837476790 DMAVVGIGMZTYTA-VCBZYWHSSA-N 470.368 0.764 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)[C@@H]1SC(=N)NC1=O 1837711427 HQKJZSZTMCRCKA-RFUYNDQBSA-N 472.640 0.097 50 20 JCGD CC(=O)NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528425 WPMOTWVLMXQUGP-QFIPXVFZSA-N 492.485 0.116 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)C1=O 1839200304 IDNJNNXPQAAAKT-KXBFYZLASA-N 484.278 0.582 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nn[nH]c4c3)CCO2)C1 1839630696 OMEFBVNSFXZXJP-KZULUSFZSA-N 452.309 0.811 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1 1839924891 NBMLCKVGAGNGFX-WCAWZNPUSA-N 495.536 0.996 50 20 JCGD COc1ccccc1CC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839955862 XGXFVOIMNZXMGT-HSZRJFAPSA-N 462.547 0.067 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1839961581 BODMKXVAHXFDFF-QAPCUYQASA-N 464.426 0.665 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nc4ccncc34)C2)C1 1840032918 NJJMLHPOOFRMSE-XIKOKIGWSA-N 452.309 0.811 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)C1 1840149546 SFQIHUMDZBGJNJ-YLJYHZDGSA-N 455.895 0.848 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C2)C1 1840152128 XYIJUDDOAXGLQX-QVKFZJNVSA-N 466.922 0.290 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4F)CC3)C2)C1 1840187325 SKGUXKGULJJMFA-HSZRJFAPSA-N 476.549 0.687 50 20 JCGD CCOC(CC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)OCC 1840280733 DBEOXOOHKJNOHY-VAHWYXDJSA-N 493.561 0.366 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012576 BYUAZYRFKMWPQT-SFHVURJKSA-N 455.320 0.100 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc3nc(Br)nn3c2)C1 1843127927 ZMIAUMQCPFCEJY-UHFFFAOYSA-N 484.119 0.302 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1(NC(=O)OCc3ccccc3)CC1)C2 1844264372 LPWJSOXGGCXTPD-UHFFFAOYSA-N 492.536 0.961 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cncc(O)c2)C1)NC(=O)NCc1ccccc1 1846219893 SMRHOIXFWDUFQE-UHFFFAOYSA-N 452.515 0.950 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1)C1CC1 1847348782 AACLGTVCCCXDGP-OALUTQOASA-N 457.336 0.581 50 20 JCGD O=C(COc1ccc2scnc2c1)NCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847563840 QXFAZFKGMQPPIR-ULQDDVLXSA-N 480.974 0.983 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCCC2)c(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1 726242336 XLDFUFGGSBLCAS-UHFFFAOYSA-N 484.542 0.588 50 20 JCGD C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727098433 NQNGXVZEZFGORP-SECBINFHSA-N 467.255 0.647 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3=NN(c4ccccc4)[C@@H](C(N)=O)C3)cc2)CC1 728214557 RQAVARLLSMEAJC-HXUWFJFHSA-N 485.570 0.186 50 20 JCGD C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cn2)CCO1 728948288 ZIEIVKDIYKDYGE-MRXNPFEDSA-N 454.535 0.844 50 20 JCGD Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1C 729275981 UOWQFIMTLDEBMR-AWEZNQCLSA-N 468.557 0.803 50 20 JCGD O=C(NCc1nnnn1-c1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 730673557 XGGBYDBZNDCPOC-UHFFFAOYSA-N 484.542 0.981 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(Cc2cccnc2)C1)c1cccc(S(=O)(=O)N2CCOCC2)c1 749162628 NWHRNGZLKKICNE-HXUWFJFHSA-N 487.582 0.776 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(S(=O)(=O)NC)s2)nc1 916233230 SXFSXPVGSBZSQA-UHFFFAOYSA-N 476.606 0.908 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)COc3cccc(C)c3)CC2)cc1 916720373 SEJQQCIMZZKDCA-UHFFFAOYSA-N 460.556 0.836 50 20 JCGD COc1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCN(C(C)=O)CC3)cc2)c1O 919755576 DXVADWOPGIHYOQ-UHFFFAOYSA-N 476.511 0.328 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)c1 919809894 VQBGNVNTDNKJFH-UHFFFAOYSA-N 484.376 0.999 50 20 JCGD O=C(NNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1)N[C@@H]1CCS(=O)(=O)C1 919883437 CUVNMUHTSHTZTH-OAHLLOKOSA-N 452.514 0.619 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F)N[C@H]1CCS(=O)(=O)C1 919886591 SNMJJUQAXUSMQO-WCQYABFASA-N 460.459 0.410 50 20 JCGD CCCn1c(CCC(=O)NNC(=O)NCC)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 920858676 XZADHEDANSIREC-UHFFFAOYSA-N 466.564 0.750 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2Cc3ccccc3CN2)C1 1778036357 KYSKHYVYDRLYDA-XLGIIRLISA-N 492.580 0.527 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2 1779029603 ZLQYWYIMPUSRGW-QHCPKHFHSA-N 467.501 1.000 50 20 JCGD C[C@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)NC(=O)OC(C)(C)C 1779030329 OALKUTFCDUTONI-CMJOXMDJSA-N 490.561 0.432 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031886 GVCCERRHNLSODU-IVZQSRNASA-N 453.503 0.024 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(Cl)Cl)C2 1779474114 SZTCYVVUTXMGDD-BBEJJTJUSA-N 458.346 0.913 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnc(O)c4ccn(C)c34)C2)C1 1779979364 BDDCHJPEFAEDQM-JOCHJYFZSA-N 458.519 0.095 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2NC1=O 1780181639 XUVPTGJJEVESAQ-WNSKOXEYSA-N 473.530 0.223 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1 1780341722 PBNGMMHSKMEWMN-XMMPIXPASA-N 460.299 0.309 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1780918391 LNTASUVKTDWAAF-UTKZUKDTSA-N 450.923 0.952 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2[C@H]3SC=C[C@H]32)C1 1781529558 DWAKPBHEKWHIII-YKHZQOCDSA-N 457.556 0.688 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4c(F)cccc4n3)C2)C1 1782370381 WJWBXHAOKHFNNB-QFIPXVFZSA-N 467.461 0.229 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CSCN3C(=O)[C@@H]3CCC(=O)N3)C2)C1 1782871671 LPZUQBFHJQBYCS-ZSDSOXJFSA-N 487.022 0.261 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2 1783934062 VVGGEIILIMUYLY-FPOVZHCZSA-N 451.955 0.543 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(N4CCCNC(=O)C4)n3)[C@H]2C1 1785786586 TZQALJUOODFHHI-BMFAXAFESA-N 493.992 0.255 50 20 JCGD CC(=O)Nc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1 1788190624 FGAUZOPLTRSVHI-JBACZVJFSA-N 473.574 0.540 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)N1CSCSC1 1788611079 KMAKBMWSGVMHQJ-BODMPHMZSA-N 494.643 0.321 50 20 JCGD O=C(CC(=O)Nc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789680899 RYBUSSQWPOOFSR-NDXORKPFSA-N 483.305 0.128 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]3C2)cn2[nH]cnc(=O)c12 1791058922 MHWDIDRRNHZTSA-JURCDPSOSA-N 466.336 0.708 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3COCCN3C(=O)OC(C)(C)C)C[C@@H]21 1791249242 GHFLTTNSLVOLDM-AVEIZBFRSA-N 489.997 0.856 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)nc1F)C2)[C@H](O)CCl 1792975045 HIEKXEWDEYAGJX-INTNWOOBSA-N 450.692 0.786 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c2cc(O)ccc2n1 1795734765 ZFOZMWPZVYZCOG-GPVSGQMNSA-N 475.310 0.446 50 20 JCGD CCc1c(Br)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)nn1C 1796191119 AKCWVMIFVXQZQK-MUJYYYPQSA-N 489.179 0.990 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)nc3cccnn13)C2 1796891727 HXDRHEHASPFYHU-CWNKPHDYSA-N 476.497 0.475 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccn12 1796952153 QCPPJOCVXKVMBV-IHBLFXCCSA-N 463.498 0.672 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(S(C)(=O)=O)CC1 1797141052 UDVMBIFUEKXALJ-BASYENTBSA-N 470.419 0.484 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCS(C)(=O)=O)C2 1798522986 LLABNTNYBAWDFQ-HBCWATKFSA-N 483.499 0.158 50 20 JCGD COc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)c1 1799097639 ROOIQJWUYHABHD-BBIADKPPSA-N 496.568 0.640 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)c[nH]1)C2)NC(=O)NCc1ccccc1 1799097730 VYOJXBXMFONWEP-UPHUGPLXSA-N 472.521 0.703 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(Cl)cc2nn[nH]c12)c1cccc(B(O)O)c1 1799331905 QTTDYXDZJGUBKU-MUJYYYPQSA-N 453.695 0.857 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCOCC2)c1 1799611111 WPHWUWHPKADNKI-OPMZPASUSA-N 494.552 0.039 50 20 JCGD Cn1nc2c(c1C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C3)CN(C(=O)OC(C)(C)C)C2 1800127170 KNRSJDWEPIRUNJ-RMHZUWNSSA-N 497.980 0.474 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)(C1)C2 1800698656 AELCDQYUYTZUQF-ULCYKIJUSA-N 499.373 0.017 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnc(N(C)C)o2)[C@H]1c1cccnc1 1805344836 BXVGZFZTJZLUFA-OXQOHEQNSA-N 457.535 0.828 50 20 JCGD Cc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1805553463 CHPLETRHWBZNJJ-JXFKEZNVSA-N 460.498 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN2CCCC2=O)[C@H]1c1cccnc1 1806923654 LPVLLHCORWEVNO-HRAATJIYSA-N 465.514 0.022 50 20 JCGD COc1ncccc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807369626 QMSXUSSDYILPQR-GHTZIAJQSA-N 460.299 0.798 50 20 JCGD CN(C)c1cncc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)c1 1807429974 GASCJLWWDHZTNS-UHFFFAOYSA-N 450.348 0.986 50 20 JCGD NC(=O)c1nccnc1C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1 1808676856 WNEMUCVGLFXTAJ-UGFHNGPFSA-N 465.283 0.981 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc2n(n1)CCC2 1809979780 BCPCZPNAUWTCNL-AVRDEDQJSA-N 459.315 0.538 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)C1 1810295393 SIRIGSYMINTZMM-LZKITUNOSA-N 494.552 0.989 50 20 JCGD O=C(CNCP(=O)(O)O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](F)Br)CC2 1814770487 VZDHCHGJOXHBKY-WKEGUHRASA-N 459.234 0.470 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOC2=O)n[nH]1 1815025715 ZZGTZKLLUGZSHX-ANDSAHIGSA-N 470.490 0.988 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344307 SLZHYQOBCSTFMH-IUODEOHRSA-N 458.349 0.354 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccn(C(F)F)n1)CC2)c1cccc(B(O)O)c1 1815360672 LXNHEIXKPUMSCQ-GFCCVEGCSA-N 461.259 0.954 50 20 JCGD C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNCP(=O)(O)O)n[nH]1 1817235027 LLXVSFIGYBWSHH-ONGXEEELSA-N 452.246 0.910 50 20 JCGD O=C(Cc1ccccc1O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825299581 IZPXQJIOGZOREM-MRXNPFEDSA-N 451.313 0.997 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)CSc3nc[nH]n3)sc2C1 1826675330 OJKZSTPZSLVWBX-SNVBAGLBSA-N 452.566 0.339 50 20 JCGD CC(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548287 ICEMNCGSLBFYNF-DYESRHJHSA-N 451.907 0.627 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)CCO2)C1 1830351656 AXGBNUBFBSFKGY-NZQNYPKQSA-N 481.977 0.640 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1830539833 IXJHAOAXVHINLD-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1[N+](=O)[O-] 1830733353 JQSGXIYLGWYJNS-YLJYHZDGSA-N 455.895 0.502 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1831446170 CCPGGEJEXGCRAY-HIFRSBDPSA-N 457.318 0.040 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)NS(=O)(=O)CC)CC2)CC1 1833451333 FSKZIXWFBHCUEU-RHSMWYFYSA-N 451.033 0.903 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833596235 BLTNGELLWQEFNH-UZLBHIALSA-N 473.979 0.963 50 20 JCGD Cc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834144908 NKGKVNQNUKWFMD-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)Cn3ccnc3)CCO2)C1 1834386333 OWWAFRPYUBPUFJ-QFIPXVFZSA-N 487.469 0.487 50 20 JCGD Cc1ccncc1CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797478 MRGFEEXFSVCIKM-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CNc4ccccc43)CC2)CC1)c1ccc(B(O)O)cc1 1834797962 QDKREIGOMNSIAJ-HSZRJFAPSA-N 476.386 0.761 50 20 JCGD COc1ccccc1OCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800449 HHGJRMISSJPRQQ-UHFFFAOYSA-N 495.385 0.639 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)cn3)CC2)CC1)c1cccc(B(O)O)c1 1834801213 QSTJIYHBUKNAGM-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cccnn3)CC2)CC1 1835893433 BBXJMZXKLTZUQL-JVWAILMASA-N 466.546 0.796 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4F)CC3)C2)C1 1835933533 BADJETBTGZJHKF-XMMPIXPASA-N 482.317 0.307 50 20 JCGD O=C(Cn1ccnn1)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1836212270 DJAUDKBAISZTSH-WIYYLYMNSA-N 492.374 0.741 50 20 JCGD O=C(CCN1Cc2ccccc2C1=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836589928 HJUHDLSTCOVAJN-AVRDEDQJSA-N 465.934 0.089 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2 1837292699 JVAAKJHHOCVFDV-UXHICEINSA-N 482.331 0.963 50 20 JCGD C[C@@H](CN)C(=O)N1CCC(OC2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1837832121 ZTTVOWVTJJMAJZ-IBGZPJMESA-N 488.633 0.926 50 20 JCGD O=C(c1cnc2snnc2c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1838508914 DUXBVQNUHBLBPL-BLLLJJGKSA-N 474.312 0.847 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1 1838605021 MKKKUNKAYNIYFD-KKSFZXQISA-N 495.920 0.002 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1nn[nH]c1C(F)(F)F)CCO2 1838763582 BVOWIQLSAAYCOO-AWEZNQCLSA-N 470.246 0.679 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)Cc3ccc(O)cn3)CC2)CC1 1838788937 DUGGAQIMIOWRKQ-UHFFFAOYSA-N 461.563 0.701 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ccsc3[nH]1)CCO2 1839520850 TXEYQHCVGQYCAK-QFIPXVFZSA-N 469.328 0.293 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)nc2nccn12 1839550289 ZXUGDTDATMLYJU-KUHUBIRLSA-N 466.336 0.891 50 20 JCGD COCCOCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839743458 RYJOHMCJJMLKIM-DRTMAPTHSA-N 479.480 0.991 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1840033039 RAHDHDFYDQYCCL-LHSJRXKWSA-N 495.374 0.730 50 20 JCGD COC(=O)C12CC(C(=O)N3CCOC[C@]4(CN(C(=O)[C@@H](C)Br)CCO4)C3)(C1)C2 1840036568 OIIVMLTYWCIPOB-LUPGOKSRSA-N 459.337 0.570 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ncccc3OC)C2)C1 1840150929 SVUZNDREPUALGF-IIBYNOLFSA-N 455.939 0.733 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)C1 1840153759 ZCCAXUYUYUQUGU-HOIFWPIMSA-N 489.997 0.954 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(F)F)no3)C2)C1 1840184039 OOXISNCTNUGGCL-LJQANCHMSA-N 459.450 0.055 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1 1840185211 NOCMZAUZFLKRGQ-QFIPXVFZSA-N 476.509 0.145 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840189419 QDCKNAKIAUACNN-GOSISDBHSA-N 477.370 0.152 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Cl)cc1)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841354298 ROKKRNCZWQXLET-HNNXBMFYSA-N 464.371 0.812 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CNC(=O)c2cccnc2)C1 1841969353 PGOMSRBZXGOBGB-CVKSISIWSA-N 451.487 0.149 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccccc1 1843010548 ZRNPDPMFKWVDOP-LJQANCHMSA-N 451.288 0.281 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1843382402 XQWQDABNSKCEGH-CIRUFVMISA-N 490.561 0.864 50 20 JCGD CCCOc1ccc(C(=O)NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC 21967175 IMKSMHGXKIHSEC-UHFFFAOYSA-N 492.554 0.925 50 20 JCGD COCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 26068330 OQQUIYTYTNEOMI-UHFFFAOYSA-N 489.598 0.585 50 20 JCGD O=C(Cc1ccc(S(=O)(=O)N2CCCC2)s1)NNC(=O)c1csc(N2CCOCC2)n1 104737902 GWJMGICWMJRMQH-UHFFFAOYSA-N 485.613 0.829 50 20 JCGD O=C(NNC(=O)N1CCN(C(=O)c2cccc(O)c2)CC1)c1csc(N2CCOCC2)n1 725860138 KOCZSJZBKGJWDN-UHFFFAOYSA-N 460.516 0.498 50 20 JCGD CC1(C)CN(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CCO1 726262730 MVHFACJULYBZNY-UHFFFAOYSA-N 453.565 0.526 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(=O)N2CCc3ccccc3C2)cc1 726713968 AHAJFMPZQSVUCH-UHFFFAOYSA-N 473.555 0.531 50 20 JCGD O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1 726862186 HCOJIDXNXOTELD-JOCHJYFZSA-N 469.523 0.964 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)c1 728529294 SOTJYFFDKUJJQT-JTQLQIEISA-N 487.332 0.384 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc(CS(C)(=O)=O)c2)cc1 749192685 TYCSQZGGPXYHPI-UHFFFAOYSA-N 482.584 0.691 50 20 JCGD O=C(NCC(=O)N1CCN(c2ccc(Cl)cc2)CC1)NNC(=O)c1ccc(-n2cnnn2)cc1 750334501 DNRWVXADRQFOQL-UHFFFAOYSA-N 483.920 0.609 50 20 JCGD COc1ccc(CCN2C[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CC2=O)cc1OC 751211807 VIVVXVFJVBUWRU-OAHLLOKOSA-N 474.539 0.734 50 20 JCGD C[C@H](O)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)OCC(=O)NNC(=O)c1ccccc1 776971722 HCHRLFKVISUVHB-YCRPNKLZSA-N 485.518 0.872 50 20 JCGD COCCN1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3OC)c2)CC1=O 914457087 NLDAGUBSVMWUNY-INIZCTEOSA-N 490.538 0.752 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(C(=O)NC3CC3)c2)c1 916648166 CKUKPTLGCAPHMP-UHFFFAOYSA-N 459.528 0.973 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(C(=O)O)cc3c2CCC3)c1 917720403 VFYRPSVRXITRMZ-UHFFFAOYSA-N 467.525 0.747 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Nc2cc(-n3cnnn3)ccc2C)cc1 919896776 JTWZELZNXBHAAN-UHFFFAOYSA-N 458.504 0.753 50 20 JCGD C[C@@H](C(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccc(F)cc1 920531531 WXPYLONKRRCFQV-NSHDSACASA-N 453.404 0.901 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)NCC3CC3)CC2)cc1 920859200 HIUDIFNVLPWJIX-UHFFFAOYSA-N 451.549 0.349 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3c(Cl)cccc13)CCO2 1779037282 UYISNBUYHDXRQU-JOCHJYFZSA-N 483.916 0.972 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)N1CSCSC1 1779147333 RRZQTVUHZJIUKX-VLIAUNLRSA-N 480.616 0.172 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)n1ccccc1=O 1779372718 ZKOHTGVKMFVKDY-SWWFSWNPSA-N 482.541 0.236 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2 1779401944 HWZSQYYRJXAYGE-WAOWUJCRSA-N 472.611 0.847 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)Cc3csc4c3c(=O)n(C)c(=O)n4C)CCO2)C1 1781218730 SCTARLRAWIWBEQ-SZNDQCEHSA-N 482.990 0.689 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c12 1782376197 QGUSIXQODFVPHA-HSZRJFAPSA-N 457.531 0.993 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC[C@]3(C1)CN(C(=O)[C@@H](O)CCl)CCO3)C2 1782852505 WPVAJMFCEWZIRF-HTZUNMPGSA-N 468.938 0.052 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1783032654 UQBCVWJCVPQDGG-PGRDOPGGSA-N 465.934 0.685 50 20 JCGD N#Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1783441425 PIWLIDOEZPQKIX-PMVMPFDFSA-N 461.327 0.464 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C1)C2 1784094128 LHRGHWKFMVQLQA-WBOSRHFRSA-N 482.965 0.202 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785546172 BLTLYHRFWUOOPS-BMIGLBTASA-N 450.380 0.460 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2 1785608288 YOZHQSXCNXLZSX-FNFWKMNBSA-N 450.895 0.119 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cc(O)ccc4n3)[C@H]2C1 1787867474 NRDXGTBBMNLRLS-OHEPNIRZSA-N 490.520 0.846 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790245233 ZGJMHCNLCNQVEW-GYOIFBIXSA-N 489.916 0.657 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COCCO)C[C@@H]21)[C@@H](Br)Cc1ccccc1 1790780513 ZWDAIYHZPKTVSL-VJANTYMQSA-N 469.376 0.981 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C[C@@H]21 1791253401 BPYKFCZFMSXTSB-HJWJTTGWSA-N 479.921 0.526 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1796193198 TXRJTFDOBWACGP-DMRZNYOFSA-N 476.264 0.775 50 20 JCGD CC#C[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)c1ccc(O)cc1 1797754488 ZGGRGQAWOUNPKX-RGKFVRLKSA-N 491.548 0.791 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cnc2ccccc21 1800888066 MRZYUKPZIIQYKK-HNAUYISWSA-N 477.525 0.760 50 20 JCGD CCn1c(-n2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](Cl)COC)cc2C)cccc1=O 1800974916 HMSQMKZHNHKGPJ-DLRJPAPCSA-N 491.976 0.819 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2 1802148585 IVQFOXOWIODJSM-YRUWSNGVSA-N 495.404 0.581 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363045 ALMUSAPVZILFPL-FDDCHVKYSA-N 475.314 0.209 50 20 JCGD CN1CCC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1 1807373905 VGCDWRBIFJXQAE-JAXLGGSGSA-N 450.348 0.423 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)CN)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807453962 QXBXAZCEQAVWHY-UGKGYDQZSA-N 453.547 0.392 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnn3ccncc23)[C@H]1c1cccnc1 1809385443 CEMWSHFCZGLKLA-HRAATJIYSA-N 485.508 0.756 50 20 JCGD CN1CCN(CCC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1810303945 XYKUNTNIMWPZHV-AUSIDOKSSA-N 494.600 0.037 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810305677 OVTKWVWGIIGNOH-UTKZUKDTSA-N 480.525 0.909 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1812366385 SSNCYKDCKLZGDR-IDHHARJASA-N 484.513 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1 1813072978 IJBCJLNQZWSQAJ-LIRRHRJNSA-N 458.479 0.406 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)C(=O)OC(C)(C)C 1814234454 KAVYOYYZWDFEKP-OAHLLOKOSA-N 488.375 0.916 50 20 JCGD O=C(CN1CCSCC1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1814414776 IEQYVXNRMLOOPC-GOSISDBHSA-N 457.365 0.444 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3ncnn3c1)CC2)c1cccc(B(O)O)c1 1815356366 FVONVTLWWGJPIP-OAHLLOKOSA-N 462.300 0.405 50 20 JCGD COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nn1C 1817472476 LTSOLZBIVDCSSO-KRWDZBQOSA-N 452.280 0.451 50 20 JCGD Cc1cc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)no1 1819800884 BZUVIHCBFYCKGZ-NSHDSACASA-N 455.500 0.907 50 20 JCGD Cn1nc2c(c1C(=O)Nc1nc3c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC3)CCC2 1824242548 MKVBCLAQUMTFOW-NSHDSACASA-N 480.554 0.903 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@H]2CNC(=O)C2)CC1 1827679594 KMDSEZURRQCMPS-HQJNDZGUSA-N 456.547 0.876 50 20 JCGD CC(C)(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cn1 1829567409 OPDPNFHYWPCZBZ-RUZDIDTESA-N 481.358 0.443 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1OC 1830732754 ADKAKCPGJSINEE-HRAATJIYSA-N 456.923 0.682 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)NS(=O)(=O)CC)CCO2 1831317736 LDDXPDITHPDFGU-RLFYNMQTSA-N 453.989 0.178 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCN(C(C)=O)CC3)C2)C1 1831650138 DKDJLBVWVKESTG-WIYYLYMNSA-N 458.987 0.014 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833313493 HHYHQRXXFBUMJO-ROUUACIJSA-N 491.029 0.433 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cncc(S(C)(=O)=O)c1)CCO2 1833400294 QQSGOWGPMQCEKK-FQEVSTJZSA-N 485.635 0.407 50 20 JCGD O=C(CSc1ccncc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833764260 IGYFHGJGKFBJQH-UHFFFAOYSA-N 482.415 0.739 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc(O)nc(Cl)c1 1833992214 PGFIXIYNAJMJJF-UHFFFAOYSA-N 486.765 0.619 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3Cc4ccccc4CN3)CC2)CC1)c1cccc(B(O)O)c1 1834800159 USXNBTLJUGXRHR-VWLOTQADSA-N 490.413 0.266 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(N2CCC(NC(=O)Cn3cncn3)CC2)CC1 1834871923 JSSYLZPEKWLXTO-UHFFFAOYSA-N 499.528 0.997 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CS(=O)(=O)c3ccc(C)cc3)CCO2)C1 1835186001 XQNHAJJIAMFHJR-NQIIRXRSSA-N 488.990 0.479 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCN(C)C)CCO2)C1 1835386309 DQKLZMRNWIAETQ-JOCHJYFZSA-N 478.502 0.542 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCN(C(C)=O)CC3)CC2)CC1 1835510852 KPTFSWQCEFMPIQ-HXUWFJFHSA-N 456.031 0.740 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835644755 FXKCRJFRPMJFQG-HIFRSBDPSA-N 467.336 0.313 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4cccc(Cl)c43)C2)C1 1835932269 XEIMKGARNBEQEQ-CPJSRVTESA-N 498.772 0.820 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1 1835937987 DLEFBMGFLZGMEM-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCOC[C@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cnc2c1 1837713131 JCYVINGKZAACME-QHCPKHFHSA-N 488.617 0.924 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cncc3cnccc13)CCO2 1838466865 WGLIBYOZYABFRL-QHCPKHFHSA-N 470.530 0.073 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn3C)C2)C1)NC(=O)NCc1ccccc1 1839054424 YREGYGDSLWYFRJ-RUZDIDTESA-N 498.584 0.441 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)no1 1839154035 ZKUKNCIZAOYLSO-OALUTQOASA-N 477.345 0.406 50 20 JCGD C/C=C(/C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839825804 APXYAJUZHXKMBV-DOENUCRNSA-N 473.574 0.755 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1 1840149921 BQAUYOOGYRUPCO-MRUHUIDDSA-N 475.970 0.706 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)C2)C1 1840150579 NXTDKQLFUVOLHE-CKJXQJPGSA-N 477.986 0.857 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1 1840151367 ZNQCLCAAOBWNRW-FOIQADDNSA-N 451.911 0.142 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840188160 RJOXZUFMMKAODN-YJYMSZOUSA-N 483.393 0.489 50 20 JCGD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843012857 NNEJDZOMIJBAMZ-UHFFFAOYSA-N 457.679 0.988 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)CC[C@@H]2O)C1 1843825646 ZPAXVQWWXBUUIG-IRXDYDNUSA-N 481.594 0.181 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CSc1nc[nH]n1)C2)NC(=O)NCc1ccccc1 1845039302 CMOGNEUKBKRREP-UHFFFAOYSA-N 472.575 0.446 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)C2)C1 1846136996 SZUWGJIBFJKIBQ-UHFFFAOYSA-N 483.374 0.831 50 20 JCGD Cc1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)NCc1ccccc1 9931041 VORABVDBOYBJMN-KRWDZBQOSA-N 465.553 0.669 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)c1 105569240 VIOPLPJZPHRMSW-INIZCTEOSA-N 463.438 0.272 50 20 JCGD CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CNC(=O)c1cccs1 725741471 NTEBIUKESRZSFB-AWEZNQCLSA-N 477.568 0.923 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2csc(N3CCOCC3)n2)C1 728203180 HOMFJECCGBQGDT-CQSZACIVSA-N 497.603 0.182 50 20 JCGD O=C(COC(=O)CCS(=O)(=O)c1ccc(F)cc1)NNC(=O)[C@H]1COc2ccccc2O1 728313595 JPHFWIVQHZOVHN-QGZVFWFLSA-N 466.443 0.520 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)CNS(=O)(=O)c2cn(C)c(C)n2)c1 728525997 KIINIAFGROIYCL-UHFFFAOYSA-N 460.310 0.239 50 20 JCGD O=C(Cn1ccc2ccccc21)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 729497007 NTUZGNTXPVPGOX-UHFFFAOYSA-N 485.570 0.519 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)c1cc(I)ccc1-n1cnnn1 730782484 PFHZVZDCDJXRCA-UHFFFAOYSA-N 480.222 0.813 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)cc1 771197331 OJAMVRCXSSSXOH-AEFFLSMTSA-N 495.941 0.777 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cccc(S(C)(=O)=O)c2)cc1 903910671 YUTXYUMHZYKLSG-UHFFFAOYSA-N 475.570 0.029 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1OC 916831055 LDSSFJRLDMEAGB-UHFFFAOYSA-N 464.500 0.467 50 20 JCGD CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1 918550533 VNMXYBRVOQQDOE-QGZVFWFLSA-N 486.616 0.684 50 20 JCGD O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)N[C@@H]1CCS(=O)(=O)C1 919885868 OLHZCUUKFYKING-OAHLLOKOSA-N 470.504 0.758 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 921248334 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CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1783349469 MELUWTAHPUNNHR-DJJJIMSYSA-N 468.352 0.634 50 20 JCGD O=C(COCc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1786709135 QPASMSOBFLVOQY-BVSLBCMMSA-N 452.316 0.177 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(O)nc3O)[C@H]2C1 1787429227 FJRRSRIGYXUEFI-MXAVVETBSA-N 499.952 0.613 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCC4)[C@H]2C1 1788355041 PREOAOJZRFNEFL-HBBIPVJPSA-N 481.557 0.947 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)ccc1O 1788610156 MZTGIUKPEYHDLU-QSFXBCCZSA-N 453.499 0.606 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]32)no1 1788669920 DKIPQXQTXPOQKY-NGOJXBLDSA-N 461.346 0.929 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(Br)cn1 1788833923 UHMQMNXNGUSIFU-FNHZYXHNSA-N 488.147 0.431 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccncc3=O)[C@H]2C1 1790582792 WUWJRWVGBFTSPF-QSFXBCCZSA-N 499.480 0.370 50 20 JCGD NC(=O)[C@@H](N)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)Cc3ccccc3)[C@H]2C1 1790779419 DCYGJHZSSWMIJN-OYSTVDSJSA-N 495.418 0.565 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]cc3I)C[C@@H]21 1791255648 XLHROTAWKATVFG-ZPFDUUQYSA-N 496.733 0.861 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1COCCN1C(=O)OC(C)(C)C 1793604202 HOSDLVHFBAWJRB-IBEHDNSVSA-N 490.395 0.995 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)C2 1796441666 NXQIJDQCOIZZFS-WJDFIBMTSA-N 484.557 0.111 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc3cccnc3cc1F)C2 1797753149 VKDOWQJZCBWSLU-GPVSGQMNSA-N 492.511 0.818 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3cnco3)c1)C2 1797753699 DMCOGNJUSLQTAD-UPHUGPLXSA-N 476.493 0.857 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccc(O)c1)C2 1797754258 OQEHLVLAYOFXLT-VPTLXERWSA-N 453.499 0.227 50 20 JCGD O=C1CCc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)nc2N1 1799346246 MDSZNEJDUIFRCL-BAESOJJISA-N 455.284 0.860 50 20 JCGD CCOc1c(F)c(F)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1F 1799771553 HJSOIOKFXWYDDQ-VTEUUUEMSA-N 492.259 0.699 50 20 JCGD CN[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1)C(=O)O 1799871536 MNWMFWQIKYNSDK-FCGDIQPGSA-N 474.562 0.034 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCCOCCOCCOC)C2 1800644076 HNNKVPGRYFOLQB-SFNKJDCFSA-N 495.411 0.446 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1OCCc3ccccc31)C2 1801010716 RJHWEUWWLPXTKS-KBVWPGPTSA-N 458.559 0.653 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccc(Cl)cc3nn1)C2 1801011085 AKFQKECBAHLIAQ-USGNIVHTSA-N 474.949 0.859 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1 1806637832 TZQBBBYAJRBKOT-OKQVUBCTSA-N 465.514 0.500 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)CN)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807037405 KPYPEMMAGLHHOP-DENIHFKCSA-N 453.547 0.392 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370422 DGBRIJIDLMKNOJ-IERDGZPVSA-N 462.271 0.201 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](N)Cc2cscn2)[C@H]1c1cccnc1 1808207566 OWUUMLQCXKJPRZ-UIAACRFSSA-N 494.581 0.426 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)COCCO)[C@@H]1c1cccnc1 1808611861 BFCHKEBGHSIIOK-QOZRKGCKSA-N 456.503 0.230 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCCNC3=O)[C@@H]1c1cccnc1 1809680038 KJNZWPRBGCKXNT-BXWFABGCSA-N 474.949 0.985 50 20 JCGD Cc1cc2nnc(C(=O)N3CCC4(CCCN(C(=O)c5cccc(B(O)O)c5)C4)CC3)c(C)n2n1 1809978205 ORDIDHLWLOCMQX-UHFFFAOYSA-N 476.346 0.580 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2c(c1)CNC2=O 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NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3ncccc13)CC2 1819797263 SBQBGSZUVGBWKU-LLVKDONJSA-N 477.510 0.724 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)Cc2ncccn2)CC1 1825319286 CBJCJJGBWUAYRG-IBGZPJMESA-N 451.531 0.951 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(=O)Nc1cccnc1)CC2 1826088360 WZCUSASCGICTAN-GFCCVEGCSA-N 459.532 0.462 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1828872145 LERLKEYNEJFSLY-OXQOHEQNSA-N 458.368 0.307 50 20 JCGD CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1828887933 MSXUWYCUOVEOHF-XMMPIXPASA-N 480.525 0.771 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H]2CCNC(=O)C2)CC1 1828925322 IREATELPHGGCNF-LPHOPBHVSA-N 456.547 0.445 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1 1829627285 WOGVGZSOFPSWGD-FXAWDEMLSA-N 455.895 0.848 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)NNc1ccccc1)CCO2 1829815112 VIIPPDSEWPGLTI-DJPFJPOOSA-N 454.955 0.702 50 20 JCGD O=C(COc1cccc(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830278880 ZTSNWHOQMWENRQ-QHCPKHFHSA-N 488.733 0.169 50 20 JCGD N#Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(C(F)(F)F)n1 1830722887 ILOPQXGAZSXVDD-RDTXWAMCSA-N 476.839 0.642 50 20 JCGD O=C(c1ccoc1I)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830723060 KXIUOMBYRXMLJH-LRDDRELGSA-N 498.701 0.554 50 20 JCGD O=C(c1cnccc1C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726074 UAASVPYQJXONAI-PBHICJAKSA-N 451.829 0.770 50 20 JCGD CC[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737381 DWJZHWCPPDXBGY-DOWNOZBLSA-N 492.013 0.982 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H]3COc4ccccc4O3)CCO2)C1 1831235845 YOZDVTFAKXPWMJ-JLHGSKIFSA-N 468.934 0.927 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCC3)C2)C1 1832549377 KCSZCHKFKYZLGX-JTSKRJEESA-N 489.013 0.671 50 20 JCGD CC[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 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O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ncccc1F 1836023060 DCWDZFUOXMLHQD-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nc[nH]n1)CCO2 1836354013 UBSGOTMPTMGKDG-LFEYGZQNSA-N 458.425 0.760 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)C=CC3=O)CC2)CC1)[C@H](F)Br 1836414504 OGEQZRHUBKXEKQ-KRWDZBQOSA-N 459.316 0.174 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4occc4c3)C2)C1 1837459133 JEQACGWWBTZHTQ-XMMPIXPASA-N 479.493 0.815 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1837918473 SRMSXJKWHUUOFZ-HNNXBMFYSA-N 466.926 0.284 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(=O)nc3cccnn13)CCO2 1838501794 PYLLOZNSPHNQMI-OAQYLSRUSA-N 475.578 0.011 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839049019 FGZZVYCFFAMNDC-AEFFLSMTSA-N 470.299 0.419 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ccoc4c3)CCO2)C1 1839536438 FYAURUWRQHQYPC-DEOSSOPVSA-N 479.493 0.815 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839670182 UODVLQVPHCFXSN-ZWKOTPCHSA-N 463.318 0.254 50 20 JCGD CCOc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1OC 1840086400 PFSAENCJFGFTAU-VGSWGCGISA-N 470.950 0.693 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccccc1)CCO2 1840118240 RFIKGRBZBQLUCQ-RQTOMXEWSA-N 464.327 0.240 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)C2)C1 1840150580 NXTDKQLFUVOLHE-GCKMJXCFSA-N 477.986 0.857 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2c1 1840182949 XIGZQYWFAPTSDC-VWLOTQADSA-N 485.585 0.848 50 20 JCGD COc1ccc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185077 HTPKHVHYXROHOU-HSZRJFAPSA-N 462.547 0.447 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnccn3)CCO2)C1 1840484471 RKZKZLLXAMWGIU-UCAFPWNGSA-N 453.337 0.977 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840651286 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O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=S)NCCc3cccs3)cc2)CCN1 914595454 VSIIXTKOQAJLFI-UHFFFAOYSA-N 467.598 0.220 50 20 JCGD CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 914750394 HDAITSIBXQGSME-UHFFFAOYSA-N 457.512 0.943 50 20 JCGD COc1ccc(-n2nnc(C(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)c2C)cc1 915062555 VBJSXSUUGHJMOW-UHFFFAOYSA-N 472.527 0.974 50 20 JCGD CN(C)N(C(=O)CS(=O)(=O)Cc1ccc(Br)cc1)[C@H]1CCS(=O)(=O)C1 915830050 UJUVAYCDYIKCKO-AWEZNQCLSA-N 453.380 0.856 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(N3CCOCC3)CCCCC2)c1 915896576 GIUPMDJJFPQHBN-UHFFFAOYSA-N 467.592 0.916 50 20 JCGD C[C@H]1CN(CCCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C[C@@H](C)O1 916250081 VIFIYZGHSXXNGN-CALCHBBNSA-N 467.592 0.914 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)NCCNS(C)(=O)=O)cc2)cc1 916294203 DELHMFAFQKRCES-UHFFFAOYSA-N 497.599 0.309 50 20 JCGD O=C(NNC(=O)N1CCN(C(=O)COc2ccc(F)cc2)CC1)c1csc(N2CCOCC2)n1 918776768 ZJJQGTMLSRCEDY-UHFFFAOYSA-N 492.533 0.696 50 20 JCGD COc1ccc(NS(=O)(=O)c2cc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)ccc2C)cc1 919883772 CKRZMOLEHZOUIJ-INIZCTEOSA-N 496.567 0.936 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C2)C1 1778169924 GROZCRIQUIDBQW-HYBUGGRVSA-N 478.509 0.646 50 20 JCGD Cc1ccc(C(=O)C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779033845 FXQVOYUSOIQUTP-HSZRJFAPSA-N 451.483 0.320 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779376140 YPCCKTUJRMVLCQ-PSRXAIMNSA-N 499.568 0.568 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3=Cc4ccccc4NC(=O)C3)C2)C1 1779991024 PNWRPKURVWGZQC-DEOSSOPVSA-N 469.542 0.615 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCNC3=O)C2 1780713410 SEAFHDSFGAEKAU-UIAACRFSSA-N 472.373 0.990 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1781112300 WMHUINVLDHOUFI-VQIMIIECSA-N 457.413 0.770 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1782206912 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1839149102 TWJQVMSKLJSCID-GHTZIAJQSA-N 480.986 0.156 50 20 JCGD COCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200257 FCDXEQQWHYOANH-XJKSGUPXSA-N 450.261 0.582 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(O)c1OC 1839375798 MLJUXEWDRSZMLW-JLTOFOAXSA-N 458.895 0.079 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839652005 XTITVZABHFTVAS-BEFAXECRSA-N 471.352 0.745 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)C1 1840030418 LNWGAYFITUTGEH-NXEZDXNNSA-N 461.353 0.816 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1840031075 FIQIHNVVIYIYDX-GTNSWQLSSA-N 457.281 0.028 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1840031312 MDKNKMHZPONLBB-XIKOKIGWSA-N 455.309 0.034 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840032637 FYYPTEZXUVVAOQ-ORAYPTAESA-N 466.336 0.891 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1840035357 OCZARHGVCCNYFG-QRWLVFNGSA-N 484.395 0.572 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnnc4ccccc34)C2)C1 1840184511 RLOXJGVCJRBDFO-HSZRJFAPSA-N 470.530 0.073 50 20 JCGD COc1cscc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184600 WPHYLURXTHGETQ-HXUWFJFHSA-N 454.549 0.200 50 20 JCGD O=C(CCc1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840545775 IZFOEJJCEXUVTA-DEOSSOPVSA-N 470.306 0.208 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1840857166 LIGPNQLLHUZOAT-LQWHRVPQSA-N 473.904 0.864 50 20 JCGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCCNC(=N)N)NC(=O)OC(C)(C)C)C1 1842872797 HYJVFRYCBGINFQ-LSDHHAIUSA-N 489.017 0.600 50 20 JCGD C[C@H](C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1)N1C[C@H]2C[C@H]2C1 1845038916 IOBCVKQXDWRBBA-NRSPTQNISA-N 468.602 0.876 50 20 JCGD O=C1NC(=O)[C@@H](CC(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)N1 1845940289 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CCn1ccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810299973 VZHCKJOAHNFPQN-OXQOHEQNSA-N 462.514 0.930 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc(-n2ccnc2)ccn1 1811581243 AUZMJTONWJBGLW-HYBUGGRVSA-N 496.336 0.976 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1 1812388931 UWKDSENOYYEUTC-XPKDYRNWSA-N 469.336 0.661 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(C(N)=O)cc2)[C@H]1c1cccnc1 1813075138 ZKWRXWUKXRARIP-UGKGYDQZSA-N 466.542 0.873 50 20 JCGD CCN1CCC(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1814242041 JSZDVYZYGUMYSF-FYYLOGMGSA-N 464.375 0.813 50 20 JCGD CC(=O)Nc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815337086 LLQQLPXPXUHOLL-OAHLLOKOSA-N 479.327 0.716 50 20 JCGD O=C(COC(=O)C(F)(F)F)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356837 UECJLTAPNOQWDA-NSHDSACASA-N 471.222 0.154 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cccn2c(O)nnc12 1817965970 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CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnncc1C(=O)O)CC2 1826088016 NLQPDWVECZEYBP-SNVBAGLBSA-N 461.504 0.230 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050225 JHUGNORABOETCS-HXUWFJFHSA-N 469.307 0.405 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)N1CCN(C)CC1 1827052608 RLAZGMRHDKWOQD-AUSIDOKSSA-N 470.423 0.236 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC(=O)NC1)CCO2 1829960272 LOVGGAYRRRRRNW-OVOCXKRTSA-N 488.491 0.854 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=N)N)CC1)NC(=O)NCc1ccccc1 1830165416 DKSRTFODVMBCHD-HXUWFJFHSA-N 486.621 0.435 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1830535035 HFGGFKYONMXCAA-ACJLOTCBSA-N 458.309 0.187 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3cccn3C)C2)C1 1830545881 NUDIVZZXYHNGJK-KUHUBIRLSA-N 456.337 0.695 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2)CC1 1830720291 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NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnc4ccccn34)CC2)CC1 1835348939 HTCPWCDGDGUDMS-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC#N)CCO2)C1 1835354760 ADCGPVBQNULYKG-MGPUTAFESA-N 458.943 0.879 50 20 JCGD COc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835737866 JOLZYIUNRBGTKB-UHFFFAOYSA-N 481.557 0.588 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnc4s3)C2)C1 1835930201 AWLUSLYSYIYEIX-HSZRJFAPSA-N 481.339 0.360 50 20 JCGD Cc1cccc(Cl)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835932106 OCGQZUJDNGALEM-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3scnc3C3CC3)C2)C1 1835935305 NUKZGQLWDWYCQR-JOCHJYFZSA-N 471.344 0.084 50 20 JCGD Cc1ccc2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)ccc2c1 1835937082 NSYFLMXMSQLNII-SANMLTNESA-N 489.337 0.607 50 20 JCGD O=C(c1cn2cccnc2n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1836893611 CNPUSNYPHNIIIP-CXAGYDPISA-N 456.272 0.490 50 20 JCGD Cc1cnc2c(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Br)C4)C3)cnn2c1 1836949232 DRJUDAMLKHHNKB-RDTXWAMCSA-N 470.299 0.798 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1837482676 ZFDPCEQUZRULMT-OXJNMPFZSA-N 451.600 0.585 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839155230 OTQNKOUOKYZSJC-QZTJIDSGSA-N 453.367 0.052 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201929 NUZXLSRNSACDBA-WMZOPIPTSA-N 470.299 0.419 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840103557 HBTMSIVIGVSVAS-BEFAXECRSA-N 460.369 0.486 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1 1840153001 AQBUXYDKUIMHKX-HOIFWPIMSA-N 467.950 0.960 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C)cc3-n3nccn3)C2)C1 1840153956 GLIYKJBATIRUSH-XMSQKQJNSA-N 477.949 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Oc1cccnc1)CCO2 1840451673 SDAAIHCYDCKVOP-CJKYEQCSSA-N 498.540 0.439 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1Cl 1840732730 SRMZONNGYKWJGL-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1F 1843010807 FTKSSTRWWGTKBA-UHFFFAOYSA-N 460.242 0.793 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1CN(C(=O)OCc3ccccc3)C1)C2 1844265315 QCQMGVKZUKHSKK-UHFFFAOYSA-N 492.536 0.771 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)C[C@H]2C1 1846105261 JTEUHEILWICWBJ-BVZFJXPGSA-N 483.374 0.831 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1 726249804 MJGUZRIFNGZLOK-UHFFFAOYSA-N 479.584 0.909 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1 728203509 KHKAIWAPRWUDBN-YOEHRIQHSA-N 463.516 0.415 50 20 JCGD Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728845025 CMGCJTFYSTXQBK-GOSISDBHSA-N 453.482 0.758 50 20 JCGD O=C(CCNC(=O)NNC(=O)c1ccc(Br)cc1Cl)N[C@H]1CCS(=O)(=O)C1 728956312 QXKALZWIGSGDFV-JTQLQIEISA-N 481.756 0.740 50 20 JCGD CC[C@H](NC(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)c1cccc(S(N)(=O)=O)c1 729231786 YIAWBDCXJNRIEP-INIZCTEOSA-N 454.530 0.833 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H](C)CSC)c(=O)n2Cc1ccccc1 731340823 MIRKDBRJHOKENM-AWEZNQCLSA-N 458.544 0.574 50 20 JCGD Cc1ccc(S(=O)(=O)N2Cc3ccccc3C[C@@H]2C(=O)NNC(=O)C(=O)NC(C)C)cc1 744446706 KMACAGVTBWRQEB-LJQANCHMSA-N 458.540 0.783 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C 744446756 MRHNCYSQOBCQNU-UKRRQHHQSA-N 454.549 0.838 50 20 JCGD O=C(COC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1)NNC(=O)c1cccs1 747292389 RFBZBDWIWIIBFD-UHFFFAOYSA-N 451.526 0.597 50 20 JCGD Cc1ccc(OCC(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 748807658 QJOYQJLBKDULBJ-UHFFFAOYSA-N 455.471 0.887 50 20 JCGD CCOc1ccc(S(=O)(=O)NCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)cc1OCC 798114542 RGBCPWJXQSYRCV-AWEZNQCLSA-N 463.578 0.255 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C[C@@H](C)O1 912919322 LXPVHAGONDISDR-CHWSQXEVSA-N 482.481 0.510 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(OC)cc(OC)c2)cc1 913531811 RXXRATXRXBAVFN-UHFFFAOYSA-N 465.484 0.620 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)NC)o2)c1 915063265 WOWDQLHQNRUWQO-UHFFFAOYSA-N 458.518 0.293 50 20 JCGD CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(S(=O)(=O)N2CCNCC2)cc1 916306001 GKEVUBFPMQNKFM-UHFFFAOYSA-N 493.611 0.685 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 916558736 HBAYHSKELAENAR-UHFFFAOYSA-N 485.526 0.727 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C=C1CCCC1)c(=O)n2Cc1ccccc1 918015890 ARMYMLOUJCAKJP-UHFFFAOYSA-N 480.525 0.702 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)CS(=O)(=O)N1CCN(c2cccc(C)c2)CC1 920424785 HAANUKJAFDLNHH-UHFFFAOYSA-N 476.555 0.682 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)CN1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 920424828 KGKQTTAETXLBDW-UHFFFAOYSA-N 476.555 0.536 50 20 JCGD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)C1CCN(c2ncccn2)CC1 1318319403 UORUOAUZQFSWAX-UHFFFAOYSA-N 494.599 0.166 50 20 JCGD Cn1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C(F)(F)F)c1 1779030223 KRRJOEUTEQIWBM-HXUWFJFHSA-N 480.447 0.800 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccnc2C(N)=O)C1 1779937260 YUVJBTVZFZHXOP-XEKQOVJPSA-N 468.352 0.734 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccc(F)cc1 1780915280 OOPQUBKSZBWIKE-YKSBVNFPSA-N 498.515 0.145 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1)NC(=O)NCc1ccccc1 1780970127 RWKICNGBDPHAQQ-PRSVDJLGSA-N 481.557 0.599 50 20 JCGD COc1cc(C)c(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1OC 1781891205 VSHHVMWJODMBMW-XMMPIXPASA-N 468.315 0.449 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](Cl)COC)C2 1782069488 XRXNCCYEPNNQAI-WOIUINJBSA-N 495.013 0.450 50 20 JCGD C[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)Oc1ccccc1 1782878783 ITBHEQLDXJMXHG-KOSHJBKYSA-N 452.316 0.668 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)n4[nH]cnc4n3)CCO2)C1 1783341487 FIUNXRGKDLFWTR-PIGZYNQJSA-N 453.297 0.035 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1783614878 GIWCLKAXTYAQGW-PTDBIEIZSA-N 475.970 0.440 50 20 JCGD N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)c1cccc(Cl)c1 1786984297 ABKLJZRRTZLWSY-LRGNLBRXSA-N 471.750 0.313 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1788225889 UMKKRQNIWVSGFL-KUSYAZKWSA-N 477.961 0.915 50 20 JCGD Cc1cccn2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cnccc5C(=O)NN)C[C@@H]43)c12 1790508145 RURDWYSKWKVESY-YSSFQJQWSA-N 477.525 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3cnn4C)C[C@@H]21 1791290986 HMEUPZZATLQVCH-QSFXBCCZSA-N 456.547 0.540 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CCOCC1 1792975257 OZKFRBDIYDRBGE-YVSFHVDLSA-N 489.997 0.497 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)nn1-c1ccccc1F 1792976703 KCCVGVWSZVGAFS-OESLAJAZSA-N 466.897 0.823 50 20 JCGD C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792978685 MNYZLVJYAAMUQR-CWQOZTLDSA-N 471.982 0.873 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@@H]1CC(=O)N(Cc2cccs2)C1 1793972928 FCUAZPNRLBIXHZ-BEHLRCOKSA-N 455.964 0.286 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1(OC)CN(C(=O)OC(C)(C)C)C1 1797155549 VNBRPHYDCRCLMM-DFGXFYAUSA-N 489.997 0.856 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-n3cccn3)cc1)C2 1797753141 VBEBXMPJOHIGEH-UPHUGPLXSA-N 475.509 0.388 50 20 JCGD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)c(O)n1 1798655220 PXPPSCQIJWKXRK-HATOLVCRSA-N 496.568 0.645 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(OC2CCOCC2)n1)c1ccc(B(O)O)cc1 1799061953 ZSRUCJBIRKZALB-ACDBMABISA-N 479.342 0.885 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)n1 1799349778 KYIWBHOPNPSBRR-AYRXBEOTSA-N 459.316 0.567 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2 1799383445 ZDDCYOXLWODFCI-SHJAMOMRSA-N 499.432 0.899 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(C(F)(F)F)n1)C2 1801010693 QGGWIXGIWVUOFR-VTEUUUEMSA-N 471.480 0.606 50 20 JCGD O=C(COc1cccnc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804332895 HQCKFQYCPVCYDC-AUSIDOKSSA-N 460.299 0.555 50 20 JCGD COCCOCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1806757848 QUBKKQYSJATIMY-YCYMQERHSA-N 470.530 0.884 50 20 JCGD O=C([C@@H](O)CCl)N1CCC2(CCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)CC1 1807089829 OKQWCMPGNMKRAS-CJNGLKHVSA-N 452.939 0.824 50 20 JCGD Cc1noc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1807525831 QVCOMYSVVDOVAC-QRWLVFNGSA-N 464.486 0.334 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccn(C(F)F)c1=O 1810604028 WBGCMBLVSDTDIA-FXAWDEMLSA-N 496.279 0.952 50 20 JCGD COc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1 1810807763 CIFNUIJYKIUTDX-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD CC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1812621031 IHXLQZMXMVDCII-XUZZJYLKSA-N 495.584 0.570 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3nn[nH]c3c1)CC2)c1ccc(B(O)O)cc1 1815348836 ZAPWACYZAGOICJ-CQSZACIVSA-N 462.300 0.634 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1 1817473170 JNQHVVUPFFEKJQ-IBGZPJMESA-N 497.342 0.508 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1nnc3ccccc31)CC2 1826082830 DIJTZHWOAKACOU-ZDUSSCGKSA-N 470.559 0.873 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2 1826085984 JNXBWUJQDVAJEQ-VIFPVBQESA-N 450.481 0.373 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525599 SQKUBOWPWANNJK-IERDGZPVSA-N 469.922 0.003 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)c1ccc(OC)cc1)CCO2 1830220215 HUPQZFXUDSJXFX-UEXGIBASSA-N 456.923 0.439 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1cccc(C#N)c1)CCO2 1830463137 VKUJNWNGVLNSMP-DEOSSOPVSA-N 471.558 0.320 50 20 JCGD Cc1nn(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1831867358 POFMRNRDKUURPD-JTSKRJEESA-N 499.996 0.931 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1833307890 MDHBDVOEOWKBLU-GOSISDBHSA-N 455.309 0.036 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(=O)nc4sccn34)CC2)CC1)[C@H](O)CCl 1833312175 IJWSRLJIVOQOJS-MRXNPFEDSA-N 467.979 0.541 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCCCN3C)CC2)CC1 1833318417 ICFFQRARQYYBNS-HXUWFJFHSA-N 450.628 0.415 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1N(C)C)CCO2 1833661035 IXFKUEFHCDWDSN-FXZATJRASA-N 497.556 0.352 50 20 JCGD Cc1nscc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834042353 OVXLLDZLKPGLAB-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)/C=C/c3cccc(O)c3)CC2)CC1)c1ccc(B(O)O)cc1 1834799090 NQYBYLPGXMIPKR-RUDMXATFSA-N 477.370 0.971 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3C=CCN3)CC2)CC1 1835051728 SPUKGCUTEUKYHD-FQNOVECQSA-N 455.563 0.220 50 20 JCGD Cc1ccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1835160483 COMMOVRGSAUCIR-DEOSSOPVSA-N 483.525 0.143 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc2cccnc2[nH]1 1835581103 ZRRFHGGWWNQMRK-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cc(O)n1 1835736931 KSUVNGBFJWOKQJ-UHFFFAOYSA-N 481.557 0.593 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1835926612 VBDCNOSQERPMMH-AVRWGWEMSA-N 482.342 0.249 50 20 JCGD O=C(c1ccc2cnccc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835936895 IGEODQGXUCDFCU-VWLOTQADSA-N 475.310 0.298 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1 1837327446 RESACDODLIVAIA-HBEAFANVSA-N 463.918 0.732 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSCc3[nH]cnc3C)CCO2)C1 1837332678 AIFBTPDKZKBZQC-KXBFYZLASA-N 460.984 0.662 50 20 JCGD Cc1cccc(C)c1SCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837705787 HAPAAQNIQKAXKU-VWLOTQADSA-N 498.410 0.846 50 20 JCGD Cc1nc(N)sc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837892774 HPPQOXBXDIKAAK-UHFFFAOYSA-N 472.376 0.640 50 20 JCGD CN1CCC(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)CC1 1839197513 ZQKCMJAPIHXNQR-WMZOPIPTSA-N 450.349 0.865 50 20 JCGD O=C(c1[nH]nc2ncccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198756 ARZBDMDRSSOQAX-DYVFJYSZSA-N 456.272 0.718 50 20 JCGD CCOc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nn1 1839201922 NPJZNLDNYPOXEV-PBHICJAKSA-N 461.288 0.636 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)c(F)cc1F)CCO2 1839287616 ORMYJUDIKLGWPJ-JOCHJYFZSA-N 478.232 0.168 50 20 JCGD C[C@H](NC=O)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839743917 DOVWDFWZDQXBLM-SJBPYACQSA-N 462.453 0.463 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1840033348 AYGQEBWHRVDIJR-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC=CC[C@H]3C(=O)OC)C2)C1 1840156108 NNSSUQGKDZNLPF-VWXURSGXSA-N 458.939 0.452 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(NC(C)=O)cc3)C2)C1 1840156816 UZYDFVDUKVBPFO-RXVVDRJESA-N 453.923 0.969 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C3CCCCC3)C2)C1 1840185140 KDFNSKWQZYWBJM-YIEPXFBBSA-N 450.580 0.952 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2n1 1840185995 XZYINBHMDFUTAY-QHCPKHFHSA-N 488.545 0.015 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(NC(C)=O)c3)CCO2)C1 1840730940 SDQVTDRSCPHFAG-RXVVDRJESA-N 453.923 0.969 50 20 JCGD C[S@@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841348439 RIQMLSBIKLNLLB-YNMHVIMOSA-N 466.000 0.451 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2)C(=O)C(=O)O 1845810505 BWBWXPUKCVQKDD-OAHLLOKOSA-N 466.332 0.739 50 20 JCGD CCCCn1c(=O)[nH]c(=O)c2c1nc(CCC(=O)NNc1nnc(C)c(=O)[nH]1)n2CC(C)C 11547895 OGBLFBPMTABXDK-UHFFFAOYSA-N 459.511 0.205 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)Cc3nc4ccccc4n3C)cnc21 727098979 LZGLVJBCLXGSEN-UHFFFAOYSA-N 473.291 0.169 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1 728345781 QWYMOEHNWRIRFZ-FZMZJTMJSA-N 475.376 0.680 50 20 JCGD COc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1S(=O)(=O)N(C)C 728845019 FCHAFEKEPUUAET-UHFFFAOYSA-N 462.532 0.413 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccc(F)cc2)c1 729276225 ZSXHZDBVHRIGQE-JTQLQIEISA-N 492.938 0.979 50 20 JCGD CCNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)c1 761158119 VHXHDOVBGHDYCF-UHFFFAOYSA-N 454.530 0.605 50 20 JCGD CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1OCC 798148967 AQKBXIOZAYTKHW-UHFFFAOYSA-N 465.484 0.952 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)NC)cc2)cc1 906411115 NHEPUEPEHYVNKI-CYBMUJFWSA-N 457.530 0.770 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CN2C(=O)N[C@@]3(C[C@H](C)CC(C)(C)C3)C2=O)C[C@@H](C)O1 912919303 LNNCMWLYKGELAF-LUDNOHBGSA-N 451.568 0.770 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)C[C@H](C)O1 912920153 WHLVAYQARFXGOC-STQMWFEESA-N 477.381 0.374 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)Cn2cnc3ccccc32)cc1 913495872 ZXRKAIPXGBCGOC-UHFFFAOYSA-N 459.484 0.339 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccc3[nH]ncc13)c(=O)n2Cc1ccccc1 915193777 UGIKRTPKPSWISB-UHFFFAOYSA-N 486.492 0.765 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2ccc(C(=O)NCC(=O)O)cc2)cc1 916104905 BPYNLZWEYFLWJE-ZDUSSCGKSA-N 465.484 0.677 50 20 JCGD Cn1nc(C(=O)NNC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)c2ccccc2c1=O 916508791 DMCIPFBFWLLYDZ-IBGZPJMESA-N 450.499 0.951 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCN(C(C)=O)CC3)c2)cc1 919836560 YAIDYOFHFKBNRW-UHFFFAOYSA-N 488.566 0.942 50 20 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@H]1c1cccnc1 1808417503 ZTHVIIIGCSRURY-DXGXISDISA-N 477.529 0.903 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)c2ccco2)[nH]n1)c1ccc(B(O)O)cc1 1817471415 MXIZWLRWCOMTDQ-QGZVFWFLSA-N 465.275 0.418 50 20 JCGD C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCS(=O)(=O)CC1)CC2 1820160572 PPKSZLIWISZUIA-CYBMUJFWSA-N 474.681 0.637 50 20 JCGD O=C(CN1CCCCC1=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822299944 NTTOAWMKQMMVFK-SFHVURJKSA-N 453.308 0.408 50 20 JCGD O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)CC1 1827269351 PKZNNNVSBXVSIG-HZPDHXFCSA-N 458.968 0.671 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1829160180 JHMNDTGJTHLZNY-KRWDZBQOSA-N 455.280 0.545 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1830358676 QMYOJQAGXWQFOH-PEBXRYMYSA-N 482.965 0.714 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n1 1830535486 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cn(C)cn3)CC2)CC1 1834286573 NMXYRONBOZEXGH-JVWAILMASA-N 468.562 0.739 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1834800084 USGXNYJVMYHNNQ-UHFFFAOYSA-N 471.388 0.936 50 20 JCGD CCn1nc(C)cc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834983025 LHTPTHCNGZJCSV-UHFFFAOYSA-N 467.379 0.390 50 20 JCGD Cc1ccccc1OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1835155502 ULWBDVWKWBHVJO-HSZRJFAPSA-N 462.547 0.203 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cc3F)C2)C1 1835926600 UMALSHJKRSBMFR-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)N3CCN(C)CC3)CC2)CC1 1836372901 LAGVRQIPQISHNI-YLJYHZDGSA-N 458.047 0.448 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1)[C@@H](F)Br 1836412323 DTDIPPDNRUVHEZ-OAHLLOKOSA-N 484.330 0.293 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(O)nn3)CC2)CC1 1837368355 VHXVRHUUDZXKAO-UHFFFAOYSA-N 469.502 0.107 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cccc1Cl)CCO2 1838869619 IOVQHASSORETIP-JOCHJYFZSA-N 491.907 0.861 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)N(C)C(=O)OC(C)(C)C 1839075219 WSYWRBZLZBDJDZ-SIFCLUCFSA-N 463.959 0.298 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1 1839202631 LWHKVDQKYDPURT-JTDSTZFVSA-N 459.312 0.737 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1839682016 IJAIBADEBRBJDJ-CXAGYDPISA-N 451.314 0.789 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)CSC(=N)N)C2)C1 1839743553 YABJYAYSPXYWRI-LFEYGZQNSA-N 479.509 0.955 50 20 JCGD COCCn1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1 1840032736 IYVJEFKLJUTCFC-KDOFPFPSSA-N 459.341 0.383 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3sc4nccnc4c3N)C2)C1 1840152039 VKMBAFLBHXSHJW-BLVKFPJESA-N 469.951 0.597 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3COc4ccccc4O3)C2)C1 1840182849 WNQGCMUYWYDKDT-HOYKHHGWSA-N 490.557 0.046 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)s3)C2)C1 1840183631 QHUARZSCSWWJPE-LJQANCHMSA-N 458.968 0.845 50 20 JCGD COc1cscc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184599 WPHYLURXTHGETQ-FQEVSTJZSA-N 454.549 0.200 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)CCO2 1840747299 NMHOMIZJRPXKRF-VWLOTQADSA-N 490.325 0.140 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)CCO2 1840945693 BAFPZNHHMJXNOE-QRWLVFNGSA-N 493.960 0.656 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841681305 VUIPZBNLACWJGP-UHFFFAOYSA-N 472.590 0.698 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011351 UOAMTXXDYGHKOU-KRWDZBQOSA-N 493.316 0.828 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)c1cnc[nH]1)C2 1843428636 GZDAGULZDCIMIQ-SFHVURJKSA-N 497.361 0.043 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846186439 QWTZMOWIFFAWFI-GOSISDBHSA-N 471.363 0.831 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1 725873064 JWTGDHNFMVFVTA-UHFFFAOYSA-N 465.557 0.615 50 20 JCGD C[C@H](NC(=O)c1cccs1)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 728213649 FBHLMAVILIFMQM-AWEZNQCLSA-N 451.574 0.946 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1cccc(COCC(F)(F)C(F)F)c1 728510836 WJPLTLIDPDFUEX-VIFPVBQESA-N 465.447 0.351 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)N1CCOCC1)n2C 745992279 YNPVIPUTRTTXMZ-UHFFFAOYSA-N 466.564 0.609 50 20 JCGD CC/C=C(/C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CCOC)n(Cc2ccccc2)c1=O 747150203 YXNJZUOBGKEANJ-PXNMLYILSA-N 468.514 0.558 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1 749487019 KOLLXUBQDHSTGQ-INIZCTEOSA-N 459.480 0.885 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)COc2cccc(N3CCCC3=O)c2)ccc1Cl 751391114 FAIQOSMQLODMTH-UHFFFAOYSA-N 466.903 0.954 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc([N+](=O)[O-])cn1C)c(=O)n2Cc1ccccc1 759416675 XBLXENUQTOXMOF-UHFFFAOYSA-N 494.468 0.136 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)n1 760963968 IXAJYYTYQGJIRC-UHFFFAOYSA-N 458.493 0.388 50 20 JCGD O=C(NNC(=O)[C@@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)c1ccc2c(c1)OCCO2 794411826 DZSMBISRIIVHGB-HOCLYGCPSA-N 481.914 0.696 50 20 JCGD O=C(CS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1ccc(-n2cnnn2)cc1 916144771 LZSVESRUDHPTGI-UHFFFAOYSA-N 465.289 0.660 50 20 JCGD O=C(NCc1cccnc1-n1ccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916416185 LKVVSOSWZFUKAR-UHFFFAOYSA-N 485.526 0.432 50 20 JCGD CNS(=O)(=O)c1cccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 916485603 CHNVZVQTUHEEDI-UHFFFAOYSA-N 483.572 0.054 50 20 JCGD O=C(CC(F)(F)F)NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1 918364034 ICNQSPNRZGPLRA-UHFFFAOYSA-N 451.423 0.958 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)cc1 919836553 XUUDKRQWPCJCMI-UHFFFAOYSA-N 460.512 0.210 50 20 JCGD COc1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1O 920427214 SBXLZZGVKJUCEC-UHFFFAOYSA-N 463.512 0.816 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc2nc(CO)[nH]c2c1 1778512338 QTDJDFYGXXPMHM-CBGDNZLLSA-N 450.923 0.782 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3noc4ccccc34)CCO2)C1 1779031210 NQCNNRMIHPAAKF-HSZRJFAPSA-N 464.482 0.513 50 20 JCGD CN1CCc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)ccc21 1779032575 UQLWKQSPALDHDH-XMMPIXPASA-N 464.526 0.435 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCO2)C1 1779036559 AUSCGQGJTHYUQZ-QFIPXVFZSA-N 494.468 0.227 50 20 JCGD Cc1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)cn2[nH]cnc(=O)c12 1780021710 NDEWHPGMJYPHKZ-KPZWWZAWSA-N 452.309 0.558 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C2)C1 1780037037 FHBKERNPQFTOIU-XMMPIXPASA-N 481.557 0.387 50 20 JCGD O=C1CSc2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)cc2N1 1781360216 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Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)n(-c2cccc(=O)n2C)n1 1800757446 ZFDGSNRXQGKMOK-ZTENYAIWSA-N 492.374 0.866 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1C[C@](C)(O)CN1C(=O)OC(C)(C)C)C2 1802339761 LIMXMCKTPXLSCY-IKJLZNBSSA-N 495.621 0.758 50 20 JCGD CN1CCCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1803173397 ZUMUAVSJRXDINQ-ILWGZMRPSA-N 450.348 0.565 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@@H]1c1cccnc1 1803997372 DCIVCSZFEUOEKR-LJHODMEESA-N 459.469 0.774 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H](CNC(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1 1804007461 UXBRZHSLVYCGDX-GDBMZVCRSA-N 453.201 0.981 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1806341043 VRBFOTJQUQGOIB-VQIMIIECSA-N 460.137 0.866 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(=O)OC(C)(C)C 1806722507 WDMJZSZCCQNUOW-SIKLNZKXSA-N 496.373 0.948 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377148 YQCMZXRCKBDSDK-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)n1cccc1C=O 1807389105 UVUCDUOFJADFMR-HCLVMJGWSA-N 474.326 0.956 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)CNC(N)=O)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807460397 BTBASXMUNXYJPV-DENIHFKCSA-N 496.572 0.102 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CSC(=N)N)[C@H]1c1cccnc1 1808414649 KYZWZHVQVIACHR-AXFCDHHRSA-N 470.559 0.848 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809980881 ZABIROLRYZQRHD-GOSISDBHSA-N 475.351 0.054 50 20 JCGD CN(C)c1ncc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)o1 1810300426 YJEJHDIVSQDYPW-DNVCBOLYSA-N 478.513 0.768 50 20 JCGD NC(=O)c1ccccc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1811279115 IQAYOXNPMOXYDX-GCJKJVERSA-N 472.310 0.494 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)no1 1813070983 OXFQTSHKLUOCCH-UZUQRXQVSA-N 485.545 0.786 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1814190888 CXOFTQLFZOARKV-FOIQADDNSA-N 492.627 0.321 50 20 JCGD Cc1ccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815336789 FCLKRQJYEGPNOV-QGZVFWFLSA-N 450.329 0.995 50 20 JCGD CCOC(CC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)OCC 1815348350 KXOYGVZXZVCNJK-HNNXBMFYSA-N 461.349 0.838 50 20 JCGD COc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)nn1C 1819403525 RBKOVVYBNVBZPV-MRXNPFEDSA-N 467.490 0.770 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2 1819796846 HMLSGBYFFZHXKB-QMMMGPOBSA-N 471.459 0.313 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1819834539 OPTTWMCESRVAGA-RYUDHWBXSA-N 481.542 0.658 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822416513 GIVDDNASMJJBRC-MAUKXSAKSA-N 484.561 0.988 50 20 JCGD CNC(=S)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1828929649 VSSOUSGQQXSGLY-GOSISDBHSA-N 475.619 0.402 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@H]43)C2)C1 1830731813 PWLOQMVYBJNGJG-DVZFXEOLSA-N 452.960 0.930 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)C1CC1 1830853673 SSKJZJHDMCAAQP-YVHKJVDXSA-N 489.997 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCCC1(F)F)CCO2 1831726807 UMSPLXOTGRMKOL-UZLBHIALSA-N 460.522 0.641 50 20 JCGD Cc1cnn(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)c1 1832549574 UZFDOFDHCKDSRF-HTAPYJJXSA-N 499.996 0.780 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)n1 1832764698 XMOUHXJTTAXTLD-VNSNFZHPSA-N 498.540 0.223 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc(F)nc1F 1833017895 FOACJHKWHRNYPY-UHFFFAOYSA-N 472.301 0.539 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1 1833615191 PICSCJMHWSIFAC-HRAATJIYSA-N 497.390 0.772 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)CCSC(=N)N)CC2)CC1 1834708410 VDLCZUBLFLGGRP-JFLMPSFJSA-N 490.634 0.709 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1 1834798947 IIBVVKWWJWMZCD-VQTJNVASSA-N 499.417 0.531 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834799880 KQCZSQZUGDVUMO-SFHVURJKSA-N 467.379 0.084 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1834823326 NPMIGMLFVWTKGK-SFHVURJKSA-N 485.360 0.611 50 20 JCGD CCn1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c2ccccc21 1835935793 RMRAQBWVXSKVIN-RUZDIDTESA-N 492.341 0.120 50 20 JCGD Cc1cc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1 1835941059 FFXPPGDPJBOLPO-VWLOTQADSA-N 466.343 0.675 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1835941845 RSTVNRNMSBUVPX-RCSZBHJWSA-N 490.365 0.558 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)c1cc(=O)nc2sccn12 1836076063 QVBRUBOKZUXOPV-INIZCTEOSA-N 467.979 0.541 50 20 JCGD CCCNC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836821187 XRESJCAVKAKRBL-UHFFFAOYSA-N 473.379 0.285 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c2cc(O)ccc2n1 1836826650 MQKMAOUDKICTFE-VWLOTQADSA-N 499.568 0.692 50 20 JCGD Cc1ccc(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1837199829 YUYLWYJXOKJIAI-UHFFFAOYSA-N 465.359 0.925 50 20 JCGD CCc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457932 XDXRELSWJLRNLH-HSZRJFAPSA-N 468.514 0.026 50 20 JCGD O=C(c1ccc(Cl)nn1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837838309 ZHGMZIIOECFKMC-SWLSCSKDSA-N 451.680 0.891 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN(C)C)C2)C1 1838528436 XTVGNZIFZCZSHF-JOCHJYFZSA-N 478.502 0.542 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cccc1Cl)CCO2 1838870377 PDXNCPKTNVPNNQ-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD Cc1c[nH]cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054144 IRJCYRNPHOENRF-RUZDIDTESA-N 498.584 0.739 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1839148120 NESYGEBJQJLXCQ-CKJXQJPGSA-N 452.939 0.674 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C2)C1 1839964754 BOCWMBPNDVRCEQ-FCEWJHQRSA-N 493.351 0.111 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)c[nH]1)CCO2 1840066010 CFKPZUKLFHKQES-PFRKPPGBSA-N 460.466 0.358 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(Cl)ccc4c3OCO4)C2)C1 1840184566 VOVIGNGOOISGCA-QFIPXVFZSA-N 496.948 0.512 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cnc3Cl)C2)C1 1840185644 RJYZEVBXZJTKRD-HXUWFJFHSA-N 471.917 0.317 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840740891 HCRLEFFOTGLHJX-JOCHJYFZSA-N 482.965 0.792 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2 1840949010 XHKYYOPYPNTICY-YADHBBJMSA-N 464.274 0.182 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CN1CCc3sccc3C1)C2 1844263465 HQZKXMRJUHTERW-UHFFFAOYSA-N 454.556 0.622 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846951961 UMNUKSOCXHEDAW-INIZCTEOSA-N 492.602 0.758 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2ccccc2)cc1 12985820 JKSVRUGZIWLSAY-UHFFFAOYSA-N 462.484 0.318 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)CNC2=NS(=O)(=O)c3ccccc32)c2ccccc2c1=O 17196201 OUMHUBNUYAVSTB-UHFFFAOYSA-N 468.495 0.477 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)cc2S1(=O)=O 728211120 HHVYPGHWDPQAFE-UHFFFAOYSA-N 494.551 0.675 50 20 JCGD Cc1nc2ncnn2c(C)c1CCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 728213306 JTWODNZFPUMKMS-UHFFFAOYSA-N 472.575 0.753 50 20 JCGD CCOC(=O)N1CCC[C@H](C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)C1 728213524 DLDGICHTXNWPME-INIZCTEOSA-N 453.565 0.934 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCCS(=O)(=O)N3CCCC3)cc2)CC1 728214595 BLCIXMRFRNJNRU-UHFFFAOYSA-N 473.621 0.272 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1 728333601 KCQKUGHIWYLYLE-PXNSSMCTSA-N 467.478 0.751 50 20 JCGD CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1 728502929 GGSGGNXBWWSPTL-JTQLQIEISA-N 469.335 0.370 50 20 JCGD Cc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1S(=O)(=O)N1CCOCC1 728845684 OKSUGAJCJNZYKH-UHFFFAOYSA-N 488.570 0.484 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCc3sccc3C2)c1 729276477 GBWPGOLQTFOMRZ-LBPRGKRZSA-N 486.597 0.194 50 20 JCGD COc1cc2c(cc1OC)CN(C(=O)CCCNC(=O)NNC(=O)CNC(=O)c1ccco1)CC2 731120093 ZTFCPYLLKNPUAZ-UHFFFAOYSA-N 487.513 0.722 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)s2)CC1)c1ccc(-n2cnnn2)cc1 807134383 AFNQANNFLNCQNZ-UHFFFAOYSA-N 496.962 0.738 50 20 JCGD O=C(CN1C(=O)NC2(CCCC2)C1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 912642883 DZTMBGSXLJKDOB-UHFFFAOYSA-N 463.516 0.097 50 20 JCGD CCOCCCC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 915639749 QAJGUZDQKAIVCK-INIZCTEOSA-N 457.549 0.917 50 20 JCGD CCOCCCNC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 915888775 YYBNSFDPSLLZGM-INIZCTEOSA-N 472.564 0.710 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)cc1 916247464 WZTFZLZVGNMPKH-UHFFFAOYSA-N 489.602 0.293 50 20 JCGD CC(C)[C@@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCN(C)CC1 916257910 FZBCLKGTPPRRSU-HXUWFJFHSA-N 480.635 0.687 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(-n3cncn3)nc2)c1 916395407 IWZDAJFHEMOEIL-UHFFFAOYSA-N 472.531 0.837 50 20 JCGD CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1 916486588 YOZDFBPHUXGJNH-UHFFFAOYSA-N 468.557 0.921 50 20 JCGD Cn1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc2c(=O)n3ccccc3nc21 917351883 KIFBCBLGWIPADH-KRWDZBQOSA-N 477.433 0.330 50 20 JCGD CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)C2=O 919885045 MIVSHCYTSORRRW-DMAKZNTKSA-N 471.580 0.421 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2N2CCOCC2)cc1OC 920212542 AQYYIXCOBRWUDZ-UHFFFAOYSA-N 464.500 0.263 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c2ccccc2c1=O 920239871 GKYXFHRRVCVJFN-OAHLLOKOSA-N 478.575 0.955 50 20 JCGD Cc1ccc(C)n1-c1c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cnn1C 920410351 XUQANUYVVNVGAT-SFHVURJKSA-N 453.455 0.972 50 20 JCGD Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nc2ccccc12 1777877858 VMGSCHAEJSPVSW-VWLOTQADSA-N 459.311 0.980 50 20 JCGD O=C(c1nc2c(=O)[nH]c3ccccc3n2n1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1778055583 LBAJOXSGKBEBBC-DJJJIMSYSA-N 493.293 0.705 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032129 BMUUMCRJJNKPCT-JOCHJYFZSA-N 488.932 0.890 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779376145 YPCCKTUJRMVLCQ-QSWVLOPZSA-N 499.568 0.568 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1nc(O)n2c1CCCC2 1779574328 GOMVDRRUOOUZAA-NTKDMRAZSA-N 482.346 0.046 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214742 YVRMMMMPJWMYAT-PMAPCBKXSA-N 461.563 0.736 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CO[Si](C)(C)C)C2 1782468375 FLIBOBRJIXSDCM-WOIUINJBSA-N 479.654 0.822 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2n1 1783937905 YJISKWACHMKQQJ-HSZRJFAPSA-N 456.547 0.768 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)CC1 1784095389 DSDPDLUYUMRDKT-XSLAGTTESA-N 489.013 0.119 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1784784120 DBEDNGBDCJNKES-OKYOBFRVSA-N 495.621 0.809 50 20 JCGD Cc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)n1 1785113963 AAMOAKNVXDSDOH-NYVOZVTQSA-N 451.332 0.296 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C2)C1 1785550306 LORSAQJMOIEEGO-GLJAUCNMSA-N 459.503 0.811 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn(-c4cccnc4)c3)[C@H]2C1 1785731857 ZMSDCERPKZPQGQ-VDGAXYAQSA-N 469.546 0.234 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1 1786606769 SMKWXJXBTLDSOM-IHPCNDPISA-N 494.614 0.121 50 20 JCGD CO[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccccc1 1786662025 VMEOJJGOYDOBBQ-QESAQDPVSA-N 452.316 0.347 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc4cnccc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786981048 MWOXJLJXWLUMDV-SSKFGXFMSA-N 460.299 0.217 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)COC4)C[C@@H]21)c1cccc(B(O)O)c1 1786983046 LVKLPNGCSRSPHQ-NYVOZVTQSA-N 450.300 0.304 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)ccc1C 1786984963 DHXJEPIRCXUKAX-RRPUWOKSSA-N 479.342 0.540 50 20 JCGD COC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1789654383 CKAREHMZBNOGQT-FQEVSTJZSA-N 453.304 0.265 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1 1789870776 VNTUJEBMKLQWDI-KBVVQZGUSA-N 472.373 0.811 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCN3C(=O)OC(C)(C)C)[C@H]2C1 1791083604 RVRQOSHZYFZWMM-OKYOBFRVSA-N 495.621 0.739 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1791236797 ZMTFLEBGWJDKAA-KGTKRSOYSA-N 499.568 0.856 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791287881 AHFABYYDFSIZMX-OWSLCNJRSA-N 483.610 0.500 50 20 JCGD O=C(CCOc1ccc(F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1792732458 OQDJNMKZZFPBKA-FAQVEIGNSA-N 456.279 0.178 50 20 JCGD Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1F 1793308236 YZIBBRQBLCLWKC-FAQVEIGNSA-N 469.517 0.969 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1794113810 GRRUENPEGKAIRC-QKGUJMCYSA-N 497.980 0.364 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1CCN(C)CC1 1795884783 HDVUQSUQKPBYRN-PNFLAOTCSA-N 457.579 0.396 50 20 JCGD Cc1nc(-c2ccccn2)sc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1796500259 AAZWKVCPNYWPOT-XEMDLRDOSA-N 492.366 0.710 50 20 JCGD Cn1c(=O)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)nc2ccccc21 1797520760 GVYXMBPYVTWROA-BCDXTJNWSA-N 460.299 0.179 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(C(F)(F)F)n1)C2 1797751592 KSNDWAVIFRIZAL-WDAIWFPHSA-N 484.460 0.677 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CO[Si](C)(C)C)[C@@H](O)C1 1797956382 STMVNNBZCUAHCD-OREBXVKISA-N 485.654 0.655 50 20 JCGD CC[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)NC(=O)OC(C)(C)C 1799366707 DKAGUTRLTYJCQQ-NZGUISNBSA-N 489.378 0.263 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)ccc1Cl 1799579147 BQJMVRVBKDIAOH-KSPBDQMDSA-N 461.881 0.995 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CC(=O)OC)NC(=O)OC(C)(C)C 1800802027 ZRRAEWWGFRWTRD-JRBZFYFNSA-N 491.969 0.286 50 20 JCGD COc1cccc(Cl)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1801798585 MKZQNABIHCTBCK-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD O=C(COc1ccc(O)cc1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1805246908 ITIQXWFQMZZBBO-UHFFFAOYSA-N 452.316 0.996 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CN2CCNC2=N)[C@@H]1c1cccnc1 1807112578 MFZHVESFNUIGOH-UNEWFSDZSA-N 451.369 0.958 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807363474 CEPVQXVXRGVBDS-LKUPVBHCSA-N 452.320 0.882 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)COc2cccnc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369130 BCJZFJXHNFXNKD-AUSIDOKSSA-N 460.299 0.555 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807615725 IJIQXEUZZOLQQT-FPOVZHCZSA-N 496.373 0.994 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn1 1807913209 SYHWLLVKGZYJCT-IPELMVKDSA-N 480.974 0.941 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1nc[nH]c1[N+](=O)[O-] 1808367331 DRQBUUAOOWLUIZ-QAPCUYQASA-N 464.247 0.026 50 20 JCGD O=C(Cn1cc(Cl)cn1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354642 OLQBOIMYPUQKJX-CQSZACIVSA-N 459.724 0.599 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(C)(C)C 1817470835 ZHZPAEFUIBHKKU-AZUAARDMSA-N 469.351 0.946 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)c2cccs2)[nH]n1)c1ccc(B(O)O)cc1 1817470901 LJYBQLYCFOXVRV-QGZVFWFLSA-N 481.343 0.887 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817478890 JVWGEWFDCSHJLM-QGZVFWFLSA-N 456.308 0.985 50 20 JCGD Cc1cc(NC(=O)CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)no1 1818093733 RLCTTXJHFKGLOL-QGZVFWFLSA-N 480.290 0.721 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnc2ncccn12 1818695463 TXXQVXGCCWJBQT-KRWDZBQOSA-N 459.275 0.752 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)no1 1827059755 UXDBYUGNKSJWPH-FQEVSTJZSA-N 482.346 0.925 50 20 JCGD Cc1ccc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1 1828272141 VUHWGTSPCVZROW-GOSISDBHSA-N 492.366 0.787 50 20 JCGD N=C(N)SCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551727 TUELMJIWNOGSQT-IIBYNOLFSA-N 498.005 0.665 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)c1cccc(Cl)c1 1830733556 PFBPAHYSXYJDSN-UEXGIBASSA-N 488.368 0.573 50 20 JCGD CN(CCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C(=O)OC(C)(C)C 1830738323 NDVBOSIBGRUWAB-HRAATJIYSA-N 477.986 0.690 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(C)[nH]3)CCO2)C1 1831857132 RWKIKPIACQGRBM-QFIPXVFZSA-N 487.469 0.935 50 20 JCGD O=C(c1ncc(Cl)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1833788606 OZUNGYRWTRZQHO-IAQYHMDHSA-N 451.680 0.891 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(Cl)c1)CCO2 1834186156 ZTLMEKVZNBSQHC-HXUWFJFHSA-N 453.927 0.178 50 20 JCGD CNc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834693257 IRGIGYUBXPZUBK-UHFFFAOYSA-N 464.375 0.907 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3CCSCC3)CC2)CC1)c1cccc(B(O)O)c1 1834801457 LOCBCZKNTPZXIR-UHFFFAOYSA-N 459.421 0.695 50 20 JCGD O=C(CSC1CCCC1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927568 TVYSJCSALZUBGC-QFIPXVFZSA-N 462.377 0.112 50 20 JCGD O=C(/C=C/c1ccsc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935622 VZRNTRXVVWUZBI-ZDUIWUOISA-N 456.329 0.211 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3occc3Br)C2)C1 1835936877 GZZZMFHBGOGKIJ-HXUWFJFHSA-N 493.119 0.106 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1 1835939889 MSEAFZYRKGGELG-NVQXNPDNSA-N 478.354 0.242 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1836473558 JEHZICDCDORIPF-GKCIPKSASA-N 498.404 0.565 50 20 JCGD CC(=O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836807104 FIJWRXBRWQHPQB-UHFFFAOYSA-N 459.547 0.913 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1 1837047272 NJKWQGQYWKIPBX-HNNXBMFYSA-N 473.368 0.710 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1 1837459271 AVEFUEBZTMWZHJ-QFIPXVFZSA-N 457.462 0.208 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)CC1 1837653759 OIFNMFAANNNTDM-UHFFFAOYSA-N 487.439 0.934 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)N(C)C(=O)OC(C)(C)C 1839075221 WSYWRBZLZBDJDZ-SXGZJXTBSA-N 463.959 0.298 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1839965246 RVNUMTAVWZEESI-DNVCBOLYSA-N 466.336 0.973 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1 1840152664 PFPPYHSLPJVJMO-YWZLYKJASA-N 466.926 0.065 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1C 1840182534 NAVTVGBHQYWNDC-DEOSSOPVSA-N 460.575 0.675 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(F)(F)F)c[nH]3)C2)C1 1840183986 MVYGNQYORMNAJI-IBGZPJMESA-N 475.468 0.477 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CNc4ccccc43)C2)C1 1840184253 XNPVEBHQXXZASP-WZONZLPQSA-N 459.547 0.025 50 20 JCGD O=C(C(Cl)Cl)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1840186501 NTJPTOYELYYCMJ-JEOXALJRSA-N 475.329 0.253 50 20 JCGD Cc1cc(F)ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187247 OYPRYSKWTQKOPZ-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187329 SPRCITFXJIDYFS-SBUREZEXSA-N 499.609 0.119 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1F 1840772686 JNUCZDCIXUMTCN-MAUKXSAKSA-N 466.890 0.834 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c([N+](=O)[O-])cc1O 1844264615 PQFOVNGVUWFSEQ-UHFFFAOYSA-N 470.442 0.438 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1 9930755 AZERHFNAJIMVPZ-LBPRGKRZSA-N 498.410 0.976 50 20 JCGD Cn1ncc2c(=O)n(CC(=O)NNC(=O)c3ccc(Cn4nnc(-c5ccccc5)n4)cc3)cnc21 11682841 JSNCPDMPSDFVNZ-UHFFFAOYSA-N 484.480 0.293 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(NC(C)=O)cc1 15879306 GSVSFMWGKLAKNH-UHFFFAOYSA-N 464.500 0.501 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNc1nnc(C)c(O)n1)n2C 23309686 RKCFAEQAMCMVSU-UHFFFAOYSA-N 462.536 0.879 50 20 JCGD COC(=O)N1CCC[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1 726717013 JUSLTXKIDKZWTK-HNNXBMFYSA-N 453.521 0.646 50 20 JCGD Cc1c(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nnn1-c1ccccc1 728331263 HNYZXACOUQKUCJ-LJQANCHMSA-N 451.439 0.649 50 20 JCGD CN(C)N(C(=O)c1ccc(S(=O)(=O)N(C)C)c(Br)c1)[C@H]1CCS(=O)(=O)C1 729170729 IKJSTOHOINQRIW-LBPRGKRZSA-N 468.395 0.805 50 20 JCGD N#Cc1ccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)cc1 747103220 AHTMDEXCKNVSAT-UHFFFAOYSA-N 453.484 0.795 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@H](C)O)cc1 772932103 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CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccncc1)CCO2)NC(=O)NCc1ccccc1 1780969821 KBLSCQLSHIUCTM-XMMPIXPASA-N 466.542 0.871 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1 1781769750 FIQRRFXOKYZJLI-NRFANRHFSA-N 457.223 0.171 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781900086 LJTMZMNFQDRZTQ-MBOZVWFJSA-N 467.169 0.667 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3Cc4ccccc4N3)C2)C1 1782839742 TZCPGBMWCCZJLU-WMZHIEFXSA-N 450.499 0.165 50 20 JCGD CC(=O)Nc1ccccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782982332 ASDAMDIQIJGBKE-RCZVLFRGSA-N 479.342 0.766 50 20 JCGD CN(CCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)C(=O)OC(C)(C)C 1785586288 QWMCBVQGAFQBQU-DEOSSOPVSA-N 489.378 0.457 50 20 JCGD Cc1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)no1 1789724637 GDBUYKACPAEDPX-UFYCRDLUSA-N 499.572 0.246 50 20 JCGD CN(C)[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccccc1Cl 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0.561 50 20 JCGD N=C1NCCN1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800436091 QKQGXHHCQSSDCV-ZMMAXQRCSA-N 478.391 0.422 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2C(=O)C=CC2=O)cc1 1801868586 ZDXNVSWTXZCNDD-DOHHPOSVSA-N 461.902 0.573 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1 1807357415 GJXQVAMWQOIHCW-KXBFYZLASA-N 469.578 0.984 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807370578 HAMWAMKDUQEXOB-FPOVZHCZSA-N 463.347 0.363 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1=O 1807375029 KSTDUPMLNHPITD-JTSKRJEESA-N 498.304 0.530 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C/N=C/c2ccco2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376957 YRIVERDSRAGVOR-QPMQWSBHSA-N 460.299 0.793 50 20 JCGD CC(=O)NCC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808416844 SCJAEZTVTANYPX-ZNNHERQJSA-N 453.503 0.358 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1808714887 IUYFZRYRCRULIV-QUCCMNQESA-N 462.319 0.567 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809973916 MENBHACHROVPAW-UHFFFAOYSA-N 452.320 0.340 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810294360 JQYVLIRRBUEBPO-QMMLZNLJSA-N 465.558 0.884 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815228584 ISIJLRBQQYIOCC-DYVFJYSZSA-N 462.337 0.076 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[nH]n1)c1cccc(B(O)O)c1 1817476889 GHWJZLNDOHMBHR-POAQFYNOSA-N 479.346 0.796 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2nc3ncccn3n2)n[nH]1 1818618751 QTPSVZWJHPFMLU-OAHLLOKOSA-N 475.473 0.466 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@H]3ON=C(c4ccccc4)O3)sc2C1)c1ccc(B(O)O)cc1 1819586631 NEKYVYLYOGRWPR-KSFYIVLOSA-N 492.322 0.783 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cccc([N+](=O)[O-])c2=O)n[nH]1 1821739069 XFFOHDHNXBUNQH-HNNXBMFYSA-N 488.505 0.545 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822410408 IYDWZNPFJQHRSB-ZFWWWQNUSA-N 456.569 0.456 50 20 JCGD O=C(Cn1ccnc1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828547949 BTVLVEZKJOXJCD-XXBNENTESA-N 489.960 0.935 50 20 JCGD Cc1nn[nH]c1C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829031098 ZMZMMGOPPYTVOY-VGOFRKELSA-N 490.948 0.779 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C#N)cc3)CCO2)C1 1829902613 UJFSMZUCJIVYTC-QMFOPCRCSA-N 492.536 0.691 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@@H]1O)CCO2 1830828962 YGFRHPXTJVQTKS-OPHFCASCSA-N 488.585 0.112 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1 1831114030 VGHXQPIUKHLHSP-IBGZPJMESA-N 468.319 0.174 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)O1 1831575976 AKPFTHPIFUZZAM-XGHQBKJUSA-N 496.358 0.557 50 20 JCGD CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)N(CC)CC 1831668359 RVLJVBYVIHPUSE-KIXFTAQDSA-N 490.605 0.697 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832724027 KCJYBLIXIUCGSB-DYESRHJHSA-N 452.939 0.675 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1832888883 SRYBRSDIEXXHJE-JOCHJYFZSA-N 466.604 0.819 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)C1 1833308866 BGQNKMVMFLZTFC-IEBWSBKVSA-N 485.390 0.141 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c2ccccc21 1833310107 ITQSBPDXMUROPW-FQEVSTJZSA-N 477.993 0.511 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn(C(C)(C)C)n1)CCO2 1833590231 HTDKRZSEAAKTHU-QFIPXVFZSA-N 464.567 0.081 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801535 ULVWTJKTJJRCIJ-SFHVURJKSA-N 480.374 0.414 50 20 JCGD CN1CCCn2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCBr)CCO4)C3)cc2C1 1834825192 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CC(C)(C)OC(=O)NCCOCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1839139061 NBDFBEZXFQGFTA-HNAYVOBHSA-N 467.922 0.519 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839479566 SKYURBIXQGFBHS-XMMPIXPASA-N 499.572 0.019 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc[nH]n3)CCO2)C1 1839722099 UYOCREIJOFSSSZ-QFIPXVFZSA-N 487.469 0.556 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1839966150 VXFKSPWTGVCJQO-OXJNMPFZSA-N 480.363 0.902 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCCC(=O)OC(C)(C)C)C2)C1 1840182543 NITWIMMXANNCNY-QHCPKHFHSA-N 484.594 0.328 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)C(F)(F)F)CCO2)C1 1840204940 WSZRDJNJAFYTMR-CABCVRRESA-N 464.268 0.358 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C13CCC(CC1)CC3)CCO2 1840542443 XCSOLRGUBPRVNX-FXLJNVFASA-N 456.348 0.407 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840897328 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PLUPETOFJDHXTH-UHFFFAOYSA-N 450.521 0.208 50 20 JCGD Cc1ccccc1[C@H](CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)NC(N)=O 728323637 OZOKERSOKGBGJY-MAUKXSAKSA-N 456.455 0.625 50 20 JCGD CN(C)C(=O)COc1ccccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 746198487 ARURQKUYBZBESN-GOSISDBHSA-N 457.439 0.298 50 20 JCGD C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cccc4cccnc34)CC2)C[C@H](C)O1 747460509 WYPTWQCJKNRVER-HOTGVXAUSA-N 476.559 0.561 50 20 JCGD CCCn1c(CCC(=O)NNC(=O)CNC(=O)c2cccs2)nc2cc(S(N)(=O)=O)ccc21 751208481 FFMVVSPHLFIKFE-UHFFFAOYSA-N 492.583 0.665 50 20 JCGD C[C@@H]1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CNC(=O)c3ccco3)c2)C[C@@H](C)O1 751211151 CWFVQCIJLJPTEY-ZIAGYGMSSA-N 464.500 0.269 50 20 JCGD Cc1ccccc1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(S(N)(=O)=O)cc2)CC1 751789917 OUOAEWRSCDSXLJ-UHFFFAOYSA-N 480.568 0.504 50 20 JCGD C[C@H]1CCCN([C@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 916450446 OPNGNJFXGBYUOW-DLBZAZTESA-N 467.592 0.772 50 20 JCGD COCCOc1ncccc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 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C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCNC4=O)C[C@@H]21 1783967809 XNLOGOVBFQDNJD-WSMBLCCSSA-N 482.379 0.641 50 20 JCGD O=C(Cc1ccc2c(c1)CCC2)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785044569 HMMWNSWVMMOHHM-XWGVYQGASA-N 462.355 0.691 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)C1CCN(Cc2ccccn2)CC1 1785385009 VURRLXWMBLORLN-VMXMFDLUSA-N 464.994 0.873 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)C1 1787506511 AYEQSSTVNARWOH-XOEWHZDYSA-N 487.557 0.689 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(Cl)n3)[C@H]2C1 1788874150 RYBYQTSGRVYVQI-IOMCNPASSA-N 473.921 0.857 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789923368 JBXKCAWQSQDFQX-CUOUOBHDSA-N 468.320 0.500 50 20 JCGD O=C(Cc1ccc(F)cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790978375 BFZUFGGNWCOEQM-LRQRDZAKSA-N 458.270 0.481 50 20 JCGD 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCO3)C2 1796446261 QGRUAYHJMIRBOS-DQNPHBRESA-N 479.537 0.888 50 20 JCGD COc1ccc2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)ccc2c1 1797001428 JRSZRVABFXZMAT-FEJSZKPUSA-N 475.310 0.440 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1CNc2ccccc2O1 1797677092 BMRWAGIBPPTGBD-IPPNXFFKSA-N 459.547 0.212 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)C1=O 1799350128 RGFNOSHBULWCQL-GDGVSTKUSA-N 454.252 0.715 50 20 JCGD Cc1noc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN(C)NC(=O)NCc2ccccc2)n1 1799871698 WNQIBEVALCOZHI-REPLKXPHSA-N 469.546 0.905 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1800320055 YYNIEFWYGRDGCA-ABPHAOMWSA-N 450.845 0.333 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCNC(=O)C1 1801070175 YQESHFUHSSMYEY-PUPWTTRCSA-N 458.465 0.988 50 20 JCGD O=C(Cc1cnc2ccccn12)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1803099292 NRSHFVAKVODXGX-NLFFAJNJSA-N 483.337 0.971 50 20 JCGD Cc1nc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(=O)[nH]c1C 1807369434 JTTLJGOHXXNXPK-GHTZIAJQSA-N 475.314 0.095 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)s1 1807371194 QWUHITQANDLFLN-UTKZUKDTSA-N 465.344 0.484 50 20 JCGD Cc1cnn(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1 1807664852 HYGKNHIQAPUVHA-LAUBAEHRSA-N 462.514 0.605 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCNC(=O)C2)[C@H]1c1cccnc1 1808417454 ZCWALNGTMFRTDW-YQOJXIOUSA-N 479.541 0.748 50 20 JCGD Cc1[nH]nc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1F 1810297810 DUPFPYDXTWTEKN-LIRRHRJNSA-N 466.477 0.884 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1810324974 LDLOVORFYNIZSQ-SGXKBVARSA-N 468.562 0.751 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc(Cl)nn1 1810681866 WVWLIBKEHTZVRL-OXQOHEQNSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnn2c1OCCC2 1812117436 IWUBVYGMOURCBB-WIYYLYMNSA-N 475.314 0.374 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3c3cccnc3)(C1)C2 1813074818 TUJKOPQLCIWTQX-OWKDJDKLSA-N 471.558 0.804 50 20 JCGD COc1ccnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1OC 1815360372 GZRBXMCBDVMXTD-CQSZACIVSA-N 482.327 0.775 50 20 JCGD COc1ccnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1 1815360651 LFLOCRGPKDZPEI-CQSZACIVSA-N 452.301 0.766 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cccc(=O)n1O 1816146597 NOMAZEWIYWKQAQ-INIZCTEOSA-N 451.248 0.108 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cncn2)n[nH]1 1817608313 KZRKBPXKYRFLFG-WJNWYLSZSA-N 452.479 0.828 50 20 JCGD C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1 1817816636 JQUNFHJXNASUCV-KWQFWETISA-N 464.284 0.625 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc(Cl)cn1)CC2 1819794835 FMVLDOCJFQSDLD-LLVKDONJSA-N 474.934 0.918 50 20 JCGD Cc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cn1 1819795814 SWRWLGGGYFUGJU-LLVKDONJSA-N 452.500 0.780 50 20 JCGD COc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)nn1C 1820376368 UPDQXUMENBETJX-INIZCTEOSA-N 467.490 0.770 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@@H](O)CCl)CC3)C1 1822721650 NFKXULNDRILEFT-XCCSTKFXSA-N 488.994 0.883 50 20 JCGD CNc1nsnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1823741132 QEPFFLYECIYVTF-KRWDZBQOSA-N 457.365 0.807 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)no1 1827659739 CURVZWPLLSVLKM-FQEVSTJZSA-N 482.346 0.925 50 20 JCGD NC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829056503 ZLICOEZNGDLEBS-OXJNMPFZSA-N 469.901 0.641 50 20 JCGD O=C(C(Cl)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCN2C(=O)OCc1ccccc1 1829206347 RAFXMGULUJNUQW-PNLZDCPESA-N 499.395 0.965 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1830450306 QASHPNFITGGDPD-AVRWGWEMSA-N 482.342 0.249 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1830539583 ILQPJGFZVNVOFI-XOBRGWDASA-N 498.378 0.118 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1830539826 IXJHAOAXVHINLD-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(OC)c1OC 1830719697 HWWVJMZIWBSVTB-HZXAIQCSSA-N 498.960 0.782 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1 1832586171 VFZVPAKWJYRMTR-LAUBAEHRSA-N 455.939 0.733 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnc3)CCO2)C1 1832677020 YNZVBYLATOVBRR-OINMWHHXSA-N 484.513 0.051 50 20 JCGD COc1cccc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1834049200 BCNRQBOSHCRELX-UHFFFAOYSA-N 481.557 0.588 50 20 JCGD O=C(c1cnccc1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1834108674 HDIVHNICZFYORH-PBHICJAKSA-N 451.829 0.770 50 20 JCGD CN[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)C(=O)O 1834742500 PESPRFJJEPUCKS-DZGCQCFKSA-N 451.337 0.311 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(C)n1C 1834798342 JSHPZCRWAVDSPV-UHFFFAOYSA-N 466.391 0.821 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4cncn4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798542 IZDWJKOBOCSATQ-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCC(F)(F)C3)CC2)CC1)c1cccc(B(O)O)c1 1834800541 KJWOCSBQQFWNSV-KRWDZBQOSA-N 463.334 0.987 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CCc3cccnc3)CC2)CC1 1834886082 SFKZLCSOJMFXFQ-UHFFFAOYSA-N 479.585 0.898 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCC(=O)N1)CCO2 1835128537 ZJMYHJGEOPWERQ-ZGOLIUOYSA-N 474.464 0.607 50 20 JCGD CCn1nc(C)cc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835736714 FBFYTPKXTXQXKF-UHFFFAOYSA-N 482.589 0.709 50 20 JCGD CN(C)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737202 WAXYECDSXCKSPX-UHFFFAOYSA-N 494.600 0.645 50 20 JCGD O=C(Cc1cncnc1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837196699 UFFXRNSDCJWCLH-UHFFFAOYSA-N 452.320 0.011 50 20 JCGD COc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1C 1837921123 BWWOAYLMGAXUGR-UHFFFAOYSA-N 470.335 0.035 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc4ncnn4c3)CC2)CC1 1837921124 CGBNRONWZZVYJP-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837949752 YRDHSWOXUDIRDY-PIGZYNQJSA-N 457.281 0.028 50 20 JCGD O=C(Cn1ccncc1=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1838648800 JNYLVAJVPVGOCO-KRWDZBQOSA-N 459.316 0.932 50 20 JCGD C[C@@H]1C[C@]1(C)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054354 VOFFHQHGIRSIHN-BTZRARBUSA-N 487.601 0.835 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1839717948 SUBURMMVIYREQE-QRWLVFNGSA-N 470.910 0.620 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1839802163 NLWGPPHUVVXSKR-NRJQMVOHSA-N 496.402 0.961 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)[C@@H]3SC(=N)NC3=O)C2)C1 1839964650 YBKNFWNHBRHCIE-OXRQTFEDSA-N 491.408 0.419 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1840033042 RAHDHDFYDQYCCL-SZNDQCEHSA-N 495.374 0.730 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1840071923 NRGSHZKIUCAJOU-PBFVBANWSA-N 493.960 0.738 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(OC)nc3)C2)C1 1840151179 XBXFQQABBRQNEA-UWJYYQICSA-N 455.939 0.733 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)C(=O)OC(C)(C)C)C2)C1 1840151667 KBLSWBFVSQXXMF-QRWLVFNGSA-N 463.959 0.564 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CCCO4)C2)C1 1840186718 CYCTVQKHEOJTFP-XMMPIXPASA-N 474.558 0.455 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)CC2)CC1 1841351039 FIBKIQZBHHXAIE-IBGZPJMESA-N 454.999 0.512 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCNC3=O)C1 1842562692 DDZWOZZJAVBKNU-AWEZNQCLSA-N 480.953 0.576 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014054 SPAZBOPWMCWPCM-MSOLQXFVSA-N 475.326 0.531 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@]13C[C@H]1CCN3C(=O)OC(C)(C)C)C2 1846385834 BPNYTDJQKFDTMM-MWTRTKDXSA-N 463.579 0.962 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C[C@H]2C[C@H]21 1847081777 YVNGOPZSPZYKGW-OLMNPRSZSA-N 484.557 0.900 50 20 JCGD O=C(NCc1ccccc1CN1CCOCC1)NNC(=O)c1csc(N2CCOCC2)n1 9872398 RDOCUZZDLUTUJK-UHFFFAOYSA-N 460.560 0.956 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)COc3ccc(C#N)cc3)c2)CC1 15888634 PCMPIACETVWAIQ-UHFFFAOYSA-N 485.522 0.251 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1F 21190665 NDRAYZWUGDZHET-INIZCTEOSA-N 451.476 0.829 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)OCCO2)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1 22991429 STLPHCQGKRDLJO-INIZCTEOSA-N 461.496 0.990 50 20 JCGD O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)C1CCN(c2ccc3nncn3n2)CC1 728210133 UPKWUMDOTBGQDV-UHFFFAOYSA-N 456.532 0.925 50 20 JCGD O=C(CCS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)C1CCN(c2ncccn2)CC1 728844750 CATLQCHJVBVHBP-UHFFFAOYSA-N 475.527 0.476 50 20 JCGD CCN1C(=O)c2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2S1(=O)=O 728846792 RJXUYHRZCKXHFY-UHFFFAOYSA-N 458.500 0.319 50 20 JCGD Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(Br)cc2Cl)cn1C 728870208 WVYACFYARLEBHF-UHFFFAOYSA-N 464.729 0.884 50 20 JCGD CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728890621 YAXXXSUMCZPPOO-UHFFFAOYSA-N 450.496 0.592 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CN(C)C(C)C)N(S(C)(=O)=O)CC2 742787465 XZKPOFXXLYZRGU-INIZCTEOSA-N 456.565 0.440 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1 752859562 UMRDERHUBBEQRD-UHFFFAOYSA-N 465.557 0.903 50 20 JCGD O=C(NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)N[C@@H]1CCS(=O)(=O)C1 915880232 BFZPODUFUPKXLA-OAHLLOKOSA-N 455.496 0.576 50 20 JCGD CCOC(=O)N[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)CC(C)C 916631135 KYJWVHRIRVZHFP-MRXNPFEDSA-N 485.611 0.805 50 20 JCGD CCn1c(SCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nnc1-c1ccccc1C 919884409 IQYDBBCIOBCEMO-CYBMUJFWSA-N 452.562 0.883 50 20 JCGD O=C(NNS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-])N[C@H]1CCS(=O)(=O)C1 919961257 YSGPGQAWFSGFQD-QMMMGPOBSA-N 457.284 0.037 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1778324674 OSZIMJIIDADGOD-PNHOKKKMSA-N 463.934 0.765 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)ccn1 1778400381 HWUKUKNVDRTLQP-HYBUGGRVSA-N 480.330 0.161 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2c1 1778502225 IOYTXYOPWRLGQU-XMMPIXPASA-N 463.299 0.614 50 20 JCGD O=C(C[C@H]1CNc2ccccc2O1)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1778934173 UKLVQPIZNOGPHJ-CYFREDJKSA-N 465.315 0.073 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779031710 WRKOJSZBEBGAJX-RUZDIDTESA-N 495.536 0.800 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nonc3c1)C2 1779373146 GKZDBGUSNJKIKS-AUSIDOKSSA-N 479.497 0.663 50 20 JCGD N#Cc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1Cl 1780190273 SETKZWKTLRAALX-JOCHJYFZSA-N 468.901 0.967 50 20 JCGD N#Cc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1Cl 1780191736 LFCZNPSWHFTAJT-JOCHJYFZSA-N 453.691 0.649 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1780287082 QKDFSRFZDHSPGV-DEOSSOPVSA-N 460.299 0.514 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780776907 IFNNGRLHJVRCBF-SRCQZFHVSA-N 451.337 0.564 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1780858865 SJAMJQUBBFLQRH-QFIPXVFZSA-N 458.707 0.786 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nn1 1780969016 SBXFHLZIFZIMAX-DEOSSOPVSA-N 497.556 0.275 50 20 JCGD COc1ccc(C2(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)CCC2)cc1 1781209034 OSZYGBUOGFHGSE-RUZDIDTESA-N 478.354 0.940 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H](O)Cc1ccccc1 1781894416 IKEYLAAEURRHRR-SGIRGMQISA-N 466.343 0.098 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1782099976 FHKVFHAQMNKMRP-JOCHJYFZSA-N 469.259 0.046 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)CCO2 1783354501 BSDLEVLLSXCXBX-GPMSIDNRSA-N 470.368 0.460 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1 1783397941 XKPUAQDDPHBBPB-IBUSPFOHSA-N 476.534 0.475 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1783554859 UFZZWLQSMXUJRC-LRGYGIHKSA-N 481.557 0.284 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCO3)C[C@@H]21)[C@@H](O)CCl 1784092584 NFXQFJLXAVLOCE-SXYSDOLCSA-N 465.978 0.467 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)C(C)(C)O 1784097473 ZOFQOVUMHGQRNS-ARKGTOAJSA-N 477.986 0.230 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784097533 AOVOGFHIPLNCJY-UHMOLFJZSA-N 489.378 0.121 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CS(=O)(=O)C4)[C@H]2C1 1787152410 OLOPBDLPCMGXFN-MEDZGJRSSA-N 489.392 0.605 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4CN3)C[C@@H]21 1787509169 XIZFXTMSGYKPQS-JXUDCGJUSA-N 492.580 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)OCO4)[C@H]2C1 1787808489 DVZCCBQHTXLBNO-VHFSOBRXSA-N 467.482 0.321 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc2c(c1)CCCC2=O 1788001097 WEBNKAFPTSZWNI-APTRMMRNSA-N 476.338 0.793 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788148008 USCQMOFUULDDGR-INIZCTEOSA-N 487.325 0.723 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1O 1788609788 KBACVMFAIBRJSW-DCPHZVHLSA-N 483.525 0.697 50 20 JCGD CC1=NN(c2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)cc2)C(=O)C1 1789625354 JDXJMFAMLHZICV-KANFNMMFSA-N 462.934 0.992 50 20 JCGD CCOc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1789664181 PGJMNGPQCLUVOO-NYVOZVTQSA-N 452.316 0.672 50 20 JCGD COC(=O)NCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1791475144 OWOYUFXVWAQJHM-AJNGGQMLSA-N 476.958 0.454 50 20 JCGD COc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1791948778 BEQALLIVXLFKRV-ZRCAFCQKSA-N 456.279 0.421 50 20 JCGD Cc1cn(CC(=O)Nc2ccc(C3(NC(=O)c4ccc(B(O)O)cc4)CCC3)cc2)c(=O)nc1O 1792225243 KEFPNPPKKWYNJS-UHFFFAOYSA-N 476.298 0.385 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnccn1 1793137620 XEFNJCXFMKLYLG-USGNIVHTSA-N 469.454 0.756 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1[C@H](C)OCCN1C(=O)OC(C)(C)C 1793487695 DDIPEUYYYIJZJS-MCEUPANISA-N 489.997 0.854 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796368087 CBHNLUKLJJQMRU-KHMAMNHCSA-N 499.989 0.438 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnn1-c1ccccc1 1796739015 PETIEVSAQWLZQA-FAQVEIGNSA-N 454.531 0.449 50 20 JCGD Cc1nc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)c2s1 1796866940 QTXDVEYJEDGFMG-CWPLJXCYSA-N 465.340 0.802 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC1(F)F)NC(=O)NCc1ccccc1 1797161139 AGXMFMWBAYBJAP-SFNKJDCFSA-N 465.501 0.577 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)C2 1797748716 XCJUXXOQWGVXKZ-LCWQOBGYSA-N 485.491 0.970 50 20 JCGD CCn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c2ccccc21 1797750466 GVMCRJLIDCWIRF-YVWYUNDQSA-N 477.525 0.572 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/C(=O)NCc1ccco1 1797893429 LQINDRQDONOQQH-ZKPVWFECSA-N 454.321 0.825 50 20 JCGD Cc1cc2nnc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](C)Br)c(C)n2n1 1800757856 RTMNKNABXJBPMI-VFFTVRQLSA-N 451.325 0.728 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3cccc(F)c3)n1)C2 1800973996 JWJWZTCATHOMMR-DLTLXFJOSA-N 451.886 0.863 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccn(Cc3ccc(F)cc3)c1=O)C2 1800974154 NHVWDAPPYFRNMJ-UKBAYJJMSA-N 492.935 0.888 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@](C)(O)CC(=O)O 1801002818 JDSOVHHIPIGWBX-ZTKXOMSMSA-N 491.969 0.324 50 20 JCGD CN(C)c1cncc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1 1804850460 PCISJOGCZRLEJL-AUSIDOKSSA-N 473.342 0.856 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC2(CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)C1 1806756823 MNBWUBJCIVZSJA-HOTGVXAUSA-N 488.029 0.943 50 20 JCGD COc1nccnc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807369657 RHVMSLTXQJUETR-YLJYHZDGSA-N 461.287 0.193 50 20 JCGD O=C1CCc2ccc(C(=O)N3CC[C@H](CNC(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)nc2N1 1807370682 IKFRXICMUIMWOZ-XXBNENTESA-N 499.336 0.675 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807373883 DDZGMFWMFXOUME-UYAOXDASSA-N 462.319 0.567 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc2ncccn2n1 1809765229 SZHAPHBGRZSODA-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC2(CCCN(C(=O)CC[C@@H](N)C(N)=O)C2)CC1 1809826067 FSDKGDUEUJPWEO-GOSISDBHSA-N 489.529 0.958 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1 1809973192 YWRDLXSKGHCYLG-UHFFFAOYSA-N 477.370 0.950 50 20 JCGD N=C(N)SCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303622 UCBPSPYTOYFGOT-DYVFJYSZSA-N 456.532 0.026 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccnc(Cl)n1 1810765936 IORCJNIRXDNIPH-QFBILLFUSA-N 465.706 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1 1813099442 SVYTYUJDEMDADE-SUMWQHHRSA-N 493.446 0.078 50 20 JCGD CC(C)N(C)CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1813599190 NURVPJYSGPPYBV-UTKZUKDTSA-N 453.547 0.740 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(C)(C)C 1817470837 ZHZPAEFUIBHKKU-ICSRJNTNSA-N 469.351 0.946 50 20 JCGD Cc1nnc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)s1 1817471122 FDRUTKADNYSTPO-INIZCTEOSA-N 454.321 0.798 50 20 JCGD O=C(/C=C\C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)NC1CC1 1817471993 AQUQALFGEOKSFZ-RXQFDZFGSA-N 451.292 0.230 50 20 JCGD Cc1nccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)n1 1817740953 LLBJDAGZDCZGJZ-NSHDSACASA-N 452.500 0.780 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793635 QWPUFKXCGJOJGS-GHMZBOCLSA-N 480.572 0.048 50 20 JCGD COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)nn1 1819797930 ORQWWIRPGDWYSM-JTQLQIEISA-N 468.499 0.480 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)Cc2cnccn2)CC1 1824304439 CPQYOPJYFHEAGR-HXUWFJFHSA-N 451.531 0.951 50 20 JCGD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827058045 POXBEDRGDGFDIV-QGZVFWFLSA-N 455.280 0.545 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)CC1 1828180069 NZXAKFHOBJOCDW-QGZVFWFLSA-N 456.551 0.731 50 20 JCGD C[C@H](NC=O)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc2ccccc2)C1 1828551023 GEYAJAWIKIRQCG-CECAUBDESA-N 480.949 0.173 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)CC1 1830199425 AQJFWRBJQPUGRP-MIGGDPJFSA-N 458.563 0.463 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](C)CBr)CCO4)c(C)n2n1 1830538873 SPYYCZPJGDITFK-XCLFUZPHSA-N 495.378 0.842 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1830574651 KGDYJIQJPXVCRJ-IIBYNOLFSA-N 489.642 0.180 50 20 JCGD O=C(CCc1ccc2c(c1)OCO2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830723526 PCHGWVSBLJDGIQ-HRAATJIYSA-N 454.907 0.404 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2c1 1830731901 RQPMDJSFOFOPQX-RXVVDRJESA-N 451.907 0.846 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccno3)C2)C1 1832549417 NLGAWLYZHYWQPP-XOBRGWDASA-N 472.926 0.877 50 20 JCGD CN(C)c1cncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1 1833365211 OLWRBFUCRXLSCB-QAPCUYQASA-N 459.316 0.908 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CN3CCN(C)CC3)CC2)CC1 1835479768 MFABQPGOLFHDOG-QGZVFWFLSA-N 472.472 0.836 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccn4ccnc4c3)CC2)CC1 1835573658 KQSVLRUIKARKIA-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD Cn1ccc2cccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c21 1835930548 MSCWFZPEWKANGZ-RUZDIDTESA-N 477.326 0.242 50 20 JCGD O=C(c1cccc(C(F)(F)F)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939664 WWIIIYVOVHHOBJ-QFIPXVFZSA-N 492.259 0.769 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1 1835990721 AIYQEUKSVKDVQG-APWZRJJASA-N 457.369 0.983 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1837254638 GCOLWBKEDGSNMA-UHFFFAOYSA-N 494.357 0.646 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837319032 IBVBERCAWXVRME-HUUCEWRRSA-N 465.252 0.785 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnsn3)C2)C1 1838526763 BZMBYEVWCNHCED-HXUWFJFHSA-N 491.482 0.755 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3CS(C)(=O)=O)C2)C1 1839143538 ZORMHKGUTQKUPR-JXFKEZNVSA-N 473.979 0.714 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)C1=O 1839200297 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CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1846117386 BFTYERUNQJIOCD-KRWDZBQOSA-N 484.557 0.759 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)C2=COCC2)C1 1846708685 GWXILBCKLJHTNL-FQEVSTJZSA-N 499.373 0.310 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCCN1C(=O)c2ccccc2C1=O 1848090561 FGUKRYHRRCJAIN-OALUTQOASA-N 469.542 0.638 50 20 JCGD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)[nH]1 725741523 PDNLMDBEFAQHCT-UHFFFAOYSA-N 457.468 0.134 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)c1 728527489 KYMJJKJVLNUJEO-WDEREUQCSA-N 474.333 0.254 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCN2CCN(C(C)=O)CC2)cc1 729318215 JHCLNECHWRCMBK-HKWRFOASSA-N 493.568 0.621 50 20 JCGD O=C(COC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)NNC(=O)c1ccc([N+](=O)[O-])cc1 749290725 UISDDTDLERLDMH-CQSZACIVSA-N 482.496 0.814 50 20 JCGD CCN1CCC[C@@H]1CNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 884003594 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451.527 0.830 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2 1798439520 DXVDNUVYMLLOLS-XYVMCAHJSA-N 468.558 0.728 50 20 JCGD CCOC(=O)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1F 1798534021 LYKBOLAHJSAPDI-VTEUUUEMSA-N 499.499 0.518 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccccc1C(=O)OCCO 1798565138 GCSUZLHFIOBTCI-NOXHYTERSA-N 473.295 0.729 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2ncccc12 1799977243 JVZYZRGZUIMBKR-HBCWATKFSA-N 461.482 0.145 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800436413 HFGMKEGCQVIWHT-BMQTXXJKSA-N 495.418 0.955 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801009075 OOMNMOMLULMBLR-GGXPGOJBSA-N 469.583 0.110 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)CC3)C2 1801013246 YOAVJUVGRXWARR-FAQVEIGNSA-N 457.531 0.148 50 20 JCGD COc1ccc(Cl)c(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1F 1801080119 UKQJXZQNSUELIU-YEZVWNJWSA-N 490.724 0.613 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCNC(=O)C1)NC(=O)NCc1ccccc1 1802450537 JGQDFROHGIROAP-HAGHYFMRSA-N 470.574 0.497 50 20 JCGD CN1CCCC[C@H]1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1803173354 ZLHNOBOORBXQAQ-BAGYTPMASA-N 450.348 0.565 50 20 JCGD Cc1noc(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804246447 ZNZGGPWOLCRHLU-XXBNENTESA-N 462.315 0.929 50 20 JCGD Cc1noc(C)c1CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365380 XJQIWHGXBPNAPR-CVDCTZTESA-N 462.315 0.929 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2COc3ccccc3O2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369199 CEZRBZXQLVBRQF-IGKWTDBASA-N 487.321 0.921 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373833 CGLHMWYTGRMBFL-UGKGYDQZSA-N 477.330 0.238 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376341 VLBZWGIERJQLKO-BEFAXECRSA-N 464.247 0.026 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1 1807377038 ZIBNNUPHDXKWFF-AVRDEDQJSA-N 475.314 0.584 50 20 JCGD COCc1oncc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1808824250 XHMSCLGOXSTGGM-IIBYNOLFSA-N 458.519 0.909 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810507893 XIRPDAXHHXVGDZ-PERKRYKHSA-N 466.347 0.386 50 20 JCGD Cc1nn2cc(CC(=O)N[C@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)nc2s1 1815336755 CGRNCQRVBOVZDF-AWEZNQCLSA-N 496.383 0.704 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362015 YSRQTHUTSAFLOF-BBRMVZONSA-N 466.328 0.911 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnncc2C(=O)O)[nH]n1)c1cccc(B(O)O)c1 1817476589 LIZDPKXTISOMRY-KRWDZBQOSA-N 464.247 0.197 50 20 JCGD O=C(COC(=O)C(F)(F)F)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819313359 HVIRTDALDGIOFG-CQSZACIVSA-N 468.197 0.501 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3c4c(nn3C)CCC4)sc2C1 1824244590 AJYGUESUOXTBFN-LBPRGKRZSA-N 459.576 0.964 50 20 JCGD CN1CCCn2nc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3ccc(B(O)O)cc3)CC4)cc2C1 1824381638 IBWXBCRYAMDUQX-INIZCTEOSA-N 494.386 0.395 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1824529152 YZWFKABGHXFJJC-WMZOPIPTSA-N 458.625 0.660 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccnnc2O)CC1 1828924152 JTPFTCOJXFYOGA-SFHVURJKSA-N 453.503 0.728 50 20 JCGD COCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCN2C(=O)OCc1ccccc1 1829000882 NERAJSMHXYRGQT-VWLOTQADSA-N 495.341 0.079 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1Cl 1830107826 BINXSIVNXPYQNY-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD O=C(CCCc1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830693965 MZAUAYRQNIZSGJ-VWLOTQADSA-N 484.333 0.598 50 20 JCGD O=C(c1ncsc1Br)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728556 UPKMZVSCTMOZKL-MEBBXXQBSA-N 468.757 0.575 50 20 JCGD O=C(c1cncc(C(F)(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732582 SZBFYFSTLIBOEF-RHSMWYFYSA-N 451.829 0.770 50 20 JCGD O=C(c1cnn(Cc2ccccc2)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732977 ZHSCUJKFACIBKN-UGKGYDQZSA-N 462.934 0.601 50 20 JCGD O=C(CCc1cnc2[nH]ccc2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830737021 CKPUDPXUKKCJAQ-UTKZUKDTSA-N 450.923 0.552 50 20 JCGD CC(C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833674586 DNIJZFFOVDWHQF-UHFFFAOYSA-N 460.579 0.685 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3C(=O)CNC3=O)CC2)CC1 1833678013 QAJSLRYLSTXZMJ-LJQANCHMSA-N 462.378 0.346 50 20 JCGD Cc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834797481 NCVGIEWXQOOUOR-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cnc4ccccn34)CC2)CC1)c1ccc(B(O)O)cc1 1834797737 ANIOTBBBJYAHTA-UHFFFAOYSA-N 489.385 0.442 50 20 JCGD CCn1nccc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797831 BKPICWJZIKSKKM-UHFFFAOYSA-N 453.352 0.082 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cccs3)CC2)CC1)c1cccc(B(O)O)c1 1834801010 HFUHHSRQKGOYKW-UHFFFAOYSA-N 455.389 0.856 50 20 JCGD O=C(CCc1ccc[nH]1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834830386 PLJVOKNIYYSMRQ-UHFFFAOYSA-N 452.364 0.513 50 20 JCGD O=C(Cc1cccnc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834878637 QYNHHKUAUFPGDI-UHFFFAOYSA-N 450.348 0.189 50 20 JCGD CC[C@@H](NC)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835118374 VKABQZRZLDROFT-BWJYWGHISA-N 459.595 0.690 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2c1 1835936966 MIAQRLUPEDLJIF-RUZDIDTESA-N 493.325 0.240 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1n[nH]c2cccc(F)c12 1836496590 OWUULRVEVKPVGG-UHFFFAOYSA-N 493.348 0.881 50 20 JCGD O=C(COC(=O)C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837318906 DNWWSPLXNSLPDA-GWCFXTLKSA-N 465.194 0.239 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1 1837460011 ZFGYHMXZHIIDGS-FQEVSTJZSA-N 463.878 0.315 50 20 JCGD Cc1cccc2c(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)n[nH]c12 1837460034 QXGAWEGVAMKEDH-XMMPIXPASA-N 493.524 0.254 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(F)cc3)C2)C1 1837461273 SCZJCSHYXQTYRS-DEOSSOPVSA-N 485.516 0.527 50 20 JCGD Cc1ccn(C)c1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921268 RXJXLTFRYLRTLF-UHFFFAOYSA-N 453.348 0.939 50 20 JCGD COCCOCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528056 CBSIJTJBEYXCGQ-JOCHJYFZSA-N 495.485 0.253 50 20 JCGD CN1CCCn2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)cc2C1 1839622475 HBXCAQRFDKKITF-QFBILLFUSA-N 488.358 0.479 50 20 JCGD O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2 1839636709 PGJQQNSERFEAPY-FUHIMQAGSA-N 483.338 0.900 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccc(C)c34)C2)C1 1840155280 VWMLIZFICOYZIC-LAUBAEHRSA-N 450.923 0.967 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CSC3CCCC3)C2)C1 1840182973 XZMREMFLDCDUPW-NRFANRHFSA-N 456.609 0.492 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc2c1OCCO2 1840183797 AXHYPSBDCMVBIL-XMMPIXPASA-N 490.557 0.209 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1C 1840185974 UYAKTGXRVPSVEF-XMMPIXPASA-N 476.574 0.376 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2 1840256779 BVGZEZVBUHDIMY-RDGATRHJSA-N 464.327 0.166 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2 1840861751 UVGOTXDNWSPCQN-HSZRJFAPSA-N 476.549 0.687 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1ccccc1)CCO2 1840902740 ICDZLDITYBTZIX-SGXKBVARSA-N 467.950 0.515 50 20 JCGD O=C(c1ccc2nnc(Br)n2c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010971 AWTREXNWTYBEBO-UHFFFAOYSA-N 484.119 0.302 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cnc3ncccn23)C1)NC(=O)NCc1ccccc1 1843762457 AICCJLXWMIRYSC-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD O=C(CN1CCCN(S(=O)(=O)c2ccc(F)cc2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 15102444 UQQOPEDETCUFAB-UHFFFAOYSA-N 479.490 0.892 50 20 JCGD O=C(NNC(=O)c1cn(Cc2ccccc2)nn1)c1cccc(S(=O)(=O)N2CCOCC2)c1 26255932 UJEWIARYAVTYJM-UHFFFAOYSA-N 470.511 0.422 50 20 JCGD N=C(N)NCCC[C@@H](C(=O)CCl)N(C(=O)[C@H]1CCCN1)[C@@H](Cc1ccccc1)C(N)=O 642813670 OXRBJXFBCZXJMM-IKGGRYGDSA-N 450.971 0.103 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2nnc(O)c3ccccc23)C1 728202472 HWVQBHKGUGCAEE-ZDUSSCGKSA-N 473.515 0.537 50 20 JCGD O=C1NC(=O)c2ccccc2/C1=C\NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 783679939 PCBCZXQKCZVECT-QGOAFFKASA-N 456.480 0.253 50 20 JCGD C=CCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 834829414 AKJFLGWYRDMPCP-SFHVURJKSA-N 475.479 0.295 50 20 JCGD COc1ccc(C(=O)NCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1OC 913391842 ICUIQYPIRYLGDA-UHFFFAOYSA-N 469.542 0.793 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)cc1 914559622 RXGILFVRJKUOSP-UHFFFAOYSA-N 496.615 0.912 50 20 JCGD C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)c1csc(N2CCOCC2)n1 914831494 MQYYZPJPXMVGLW-JOCHJYFZSA-N 484.538 0.740 50 20 JCGD COc1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1O 916369258 CJPISFPYQYMXKW-UHFFFAOYSA-N 464.500 0.566 50 20 JCGD O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)CCN1 916392258 SQPJQMVOQMSQCV-UHFFFAOYSA-N 463.292 0.493 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3cccnc3N3CCOCC3)nc2)CC1 916399906 FVVPCGNLWTZEDP-UHFFFAOYSA-N 490.590 0.076 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NCCC(=O)N2CCN(C)CC2)c2ccccc2c1=O 916434547 JNYRYVOSKCAMII-UHFFFAOYSA-N 457.535 0.305 50 20 JCGD NC(=O)[C@H]1CCCN(c2ccc(CNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)C1 918002158 SPKDABGKPWPDIE-KRWDZBQOSA-N 463.502 0.508 50 20 JCGD O=C(COC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O)NNC(=O)c1ccccc1 919649868 SPECAIUMTRXXSE-INIZCTEOSA-N 487.490 0.628 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(NS(C)(=O)=O)cc2F)c1 919954803 UZGGWMJFEXFITO-UHFFFAOYSA-N 494.548 0.071 50 20 JCGD O=C(NCCc1cccs1)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1 920832859 IHLKQVRKPTUFNF-UHFFFAOYSA-N 474.586 0.504 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2n[nH]cc2c1 1777861021 ONJMNRNLKXBOSF-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCOC1=O)C2 1778091271 UFYMDNRBHODVTG-QZICUBQQSA-N 488.545 0.477 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ncccc3Br)C2)C1 1779655041 XHABIJIXKUIQBZ-LJQANCHMSA-N 468.352 0.661 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1780785091 JNVJXPLDWQETNM-GXYOHSSGSA-N 477.986 0.376 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)/C=C/c3cnccn3)CCO2)C1)NC(=O)NCc1ccccc1 1780970466 UJZFMGCMBVVCJD-LAUDKDLHSA-N 493.568 0.666 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnn1C)CCO2)NC(=O)NCc1ccccc1 1780970622 YRZHLLZBVVGCES-QHCPKHFHSA-N 469.546 0.210 50 20 JCGD CC[C@H](CC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)NC(=O)OC(C)(C)C 1781363520 XJYOKLJURLGDSF-HXOBKFHXSA-N 483.610 0.883 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](COC)NC(C)=O)C2 1781901484 OZDFLVYXOGOXOA-WFXMFSGNSA-N 462.385 0.825 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(-n4cncn4)c3)C2)C1 1782018491 BAYJJOAEBCEFOP-QFIPXVFZSA-N 455.519 0.084 50 20 JCGD CCNC(=S)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1782646958 ZRAQQVUCZCWDQR-OAQYLSRUSA-N 493.542 0.448 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)CCO2)C1 1783533792 JFMPJWDGWYUXDU-ODXCJYRJSA-N 489.330 0.798 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1C 1784843987 UNDBTKMDZFYOOA-ZJOUEHCJSA-N 460.575 0.899 50 20 JCGD Cn1ncc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)cccc21 1786979841 SXUCBLMAARWVBE-BUKVSMQUSA-N 462.315 0.160 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccc(Cl)cc4n3)C[C@@H]21)c1cccc(B(O)O)c1 1786983354 OSBFOTUVJMJECP-QSFXBCCZSA-N 482.733 0.575 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccccn3)[C@H]2C1 1787110820 MSTMXWMHLRAWRB-XXBMCBDCSA-N 452.515 0.738 50 20 JCGD CC(C)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCNC4=O)[C@H]2C1 1788256495 OTEAGDHHCPWIII-ZQIUZPCESA-N 451.955 0.875 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1n[nH]c2c1CCc1ncccc1-2 1789181367 HDEVQGKWVJGPST-HZCDGDGTSA-N 459.934 0.763 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1OC 1789542663 SOSZNHDZLVHZNJ-XERREHJYSA-N 483.525 0.609 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1791019221 HQZAAAFQBZQMGY-VIQHNZTISA-N 471.982 0.823 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(=O)CN3C(=O)OC(C)(C)C)C[C@@H]21 1791248835 AXTAFYMOBPFXNV-HILJTLORSA-N 487.981 0.798 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1 1791289417 YSMGLJIAURXFOT-IHPCNDPISA-N 494.614 0.121 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C 1792884723 WOJDZRLVTFVJRN-NIFZNCRKSA-N 478.384 0.493 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(C)c(C)[nH]c1=O 1794311550 UVTXEJQZQXQAFG-CCWDJLKJSA-N 499.480 0.737 50 20 JCGD COc1ccc(COCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cc1 1796446407 UTSUTQVOWBTVDX-UJDJVAOOSA-N 497.552 0.935 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)ccc21 1799347544 PQPWXIMBHODTOT-VZAMPYOESA-N 469.311 0.771 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(S(C)(=O)=O)ccc1F 1799862447 JUWQDPMKNVLOET-RBNVPPIJSA-N 462.927 0.686 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)C(=O)C(=O)O 1801330868 MHYUJINPHHKMSE-BTTYYORXSA-N 476.442 0.315 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)CSC1=S 1802106639 HSATVJNQECZQLL-ORXSELOVSA-N 450.380 0.220 50 20 JCGD Cc1nnc(CCC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1 1804558386 CGFVZHGMIMHFHJ-AVRDEDQJSA-N 479.371 0.874 50 20 JCGD COc1ncccc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1805600273 QGZOSTHTLRTOIQ-WIYYLYMNSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2c(c1)CNC2=O 1810038038 WRFWAXDEHKUBNA-CVDCTZTESA-N 484.321 0.638 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCNC3=O)[C@H]1c1cccnc1 1813031055 PKFWOALHENPSFV-BXWFABGCSA-N 474.949 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1 1813075040 ZIDZHEFRPZOWCQ-VGSWGCGISA-N 469.546 0.753 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1 1813188505 XBJCPFTZVJUEBI-QTQZEZTPSA-N 466.542 0.951 50 20 JCGD COc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n(C)n1 1815337040 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O=C(c1cnn2ccncc12)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059024 DJGPFCCDZMDQCG-NRFANRHFSA-N 461.331 0.956 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cc(O)nc(O)c2)CC1 1827426368 RNTHBQCYKMIVOP-LJQANCHMSA-N 453.304 0.720 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1827692737 YRCBYDUSEBKADB-QRWLVFNGSA-N 458.563 0.785 50 20 JCGD O=C(C1CC(O)C1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548209 FQIVZVBRZAYKPN-LDSCCMFQSA-N 479.961 0.809 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)N1C[C@H]2C[C@H]2C1 1828810603 TYQGESGQBGGRRJ-CPDIYIAASA-N 453.392 0.940 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1830734987 BQFCVVIDLLNEDW-OMPKRAJASA-N 480.871 0.199 50 20 JCGD COC(=O)N(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)Cc1ccccc1 1830739039 XBWJWWHFPWLKRE-AVRDEDQJSA-N 483.949 0.311 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1 1832209192 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O=C(NC1CCN(C2CCN(C(=O)CS[C@@H]3CCCCO3)CC2)CC1)c1cccc(B(O)O)c1 1834800920 APYDDWSEASCFKT-HSZRJFAPSA-N 489.447 0.811 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1)c1cc2n(n1)CCCNC2=O 1835515676 MVDWEKKJJGBQTN-KRWDZBQOSA-N 454.934 0.736 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCSC(=N)N)CCO2)C1 1835643638 HKULEASSGIYJAU-MLGOLLRUSA-N 451.387 0.491 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1C 1835933886 FXZRBFWIHFPCBT-RUZDIDTESA-N 466.343 0.296 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)c2c1 1836920965 HGEPTBVVBXXSMV-NQIIRXRSSA-N 451.907 0.846 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)c3cccs3)C2)C1 1837457518 HUDKHCLPUVBNRS-CRTIWDKESA-N 499.549 0.256 50 20 JCGD CC#CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1837612866 OGQFDDUCJOBLSA-RPLLCQBOSA-N 490.365 0.634 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)n1ccccc1=O 1837715217 COGJVYXJVIMXBT-UTKZUKDTSA-N 451.596 0.717 50 20 JCGD O=C(CC[C@H]1CCOC1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922131 PHOKPVGGFKTFEZ-SFHVURJKSA-N 458.364 0.795 50 20 JCGD O=C(c1cc(C(F)(F)F)ccn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838081381 FYQRPUDQLPYXFY-PBHICJAKSA-N 451.829 0.770 50 20 JCGD CSc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838287389 JULNCQMSJPBMBI-OAQYLSRUSA-N 465.576 0.247 50 20 JCGD Cc1n[nH]cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1838677124 RQWALJQUVAIZLG-HRAATJIYSA-N 485.969 0.920 50 20 JCGD CCCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1839012398 DOENCDFGJSSYKY-RUZDIDTESA-N 482.342 0.539 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1839129329 QCDXZWQSURJIAS-HOIFWPIMSA-N 489.997 0.690 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199665 ZJJBIXZKXQWGCW-AEFFLSMTSA-N 470.299 0.578 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)c(F)c1)CCO2 1839271031 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CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)NC1CCCC1 744052638 MMNNDEBCSTWQAV-VWILAXROSA-N 472.589 0.653 50 20 JCGD COc1cc(Cl)ccc1C(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1 798164399 KLQUGDQXSWMENU-UHFFFAOYSA-N 489.959 0.993 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)/C(=C\c2cccc(F)c2)n2nnnc2C)n1 818196448 XKHUWQLLPJQBQU-VIZOYTHASA-N 459.463 0.817 50 20 JCGD O=C(COC(=O)c1ccc(=O)n(Cc2ccccc2)n1)NNC(=O)[C@@H]1COc2ccccc2O1 847184486 CRWDZZVYZPYVEJ-IBGZPJMESA-N 464.434 0.436 50 20 JCGD CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1=O 860439614 BTIIRCFXRBMENZ-UHFFFAOYSA-N 459.532 0.979 50 20 JCGD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3ccccc3OC)C2=O)cc1 863998996 IPHSFWXZJYZCFW-QFIPXVFZSA-N 456.455 0.697 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 912852182 RDVFEWURPIMYQM-UHFFFAOYSA-N 453.546 0.336 50 20 JCGD Cn1nc(SCC(=O)NN=C2C(=O)Nc3ccc(-c4ccccc4)cc32)c(=O)n(C)c1=O 915957804 WAEVKENZMURUQD-UHFFFAOYSA-N 450.480 0.711 50 20 JCGD O=C1CC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](Br)Cc2ccccc2)CCO3)=NN1 1778942912 NGWUGYXECUEGNJ-YWZLYKJASA-N 463.332 0.698 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3cc(F)cc(F)c3)CCO2)C1 1779030500 AZMKSSMMKCGETQ-QFIPXVFZSA-N 459.453 0.650 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)CCO2 1779295872 DPUKUNZGLYKGMP-HSZRJFAPSA-N 489.649 0.703 50 20 JCGD O=C(c1n[nH]cc1I)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1779542685 AOIIZYJHRLXQBO-IINYFYTJSA-N 468.679 0.058 50 20 JCGD COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)nn1C 1780242831 POQPHFZUMZVUPR-TUWUPGADSA-N 485.545 0.690 50 20 JCGD Cc1ccc(O)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1780325962 RELDMTLGZVXMHF-ZJSXRUAMSA-N 452.316 0.822 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncc(N(C)C)c1)C2 1782209552 ZEQNXOKXEWPOOF-AUSIDOKSSA-N 460.579 0.648 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782789321 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CO[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)c1ccccc1 1786984681 YIAWPBDYFVRHDU-JKLQHZFJSA-N 452.316 0.347 50 20 JCGD CC[C@H](NC(N)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21 1787408219 DPUIBWOWXQJGTP-UHEFJODHSA-N 491.501 0.560 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C)nc3O)C[C@@H]21 1787508733 QAVVTQHNMOYJMP-YKNBRYRPSA-N 468.514 0.823 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ncccn3)C[C@@H]21 1787509187 XZWMFHMBVWVHFF-HRZAHRDASA-N 485.570 0.682 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)nc4n[nH]cc34)C[C@@H]21 1788610224 KTLUYDIOKLEONS-GOPGUHFVSA-N 498.931 0.517 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc[n+]([O-])cc3)[C@H]2C1)NC(=O)NCc1ccccc1 1789096611 CRXUJQYCPQERHC-FKBYEOEOSA-N 496.568 0.260 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)[C@H]2C1 1789935827 KSZCMOKOOOSUJT-NNXHMXCWSA-N 477.986 0.496 50 20 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CCCC(=O)N[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1797923689 VNTUVIRNXFPOTA-PELSGRBUSA-N 460.535 0.015 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H]1CCCCO1)C2)NC(=O)NCc1ccccc1 1799095314 NFMVCCWXPMHJQY-OOICKAIWSA-N 487.601 0.881 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc(-c3ccccc3)o1)C2 1801011279 GDPCBPSERILDKM-HGKCTWBKSA-N 456.503 0.313 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCn1nc(C)cc1C 1801246366 HMOZEQHIANLHSE-JBUXMVGSSA-N 469.546 0.614 50 20 JCGD CN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1801468367 VQJXRKYVCNDWMD-JJTUDDRGSA-N 489.013 0.986 50 20 JCGD COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1804976551 PTZDEKOBMLVQIT-HNAYVOBHSA-N 476.497 0.512 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2ncn(C)n2)[C@H]1c1cccnc1 1805323200 TWHHDZASCXQGOH-AENKRZKSSA-N 463.502 0.664 50 20 JCGD 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O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(O)c([N+](=O)[O-])c1 1823224456 XQSQFTWUDVNRFB-AWEZNQCLSA-N 482.283 0.976 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4c3OCCC4)sc2C1 1824000368 YUPGVPSIGJOZKG-NSHDSACASA-N 482.526 0.660 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@](C)(O)C(F)(F)F)CC2 1826084068 ZAUXDOMPUBVBPA-XXFAHNHDSA-N 451.471 0.741 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)CC1 1827678769 RVVLHPMQSMOLJA-LJQANCHMSA-N 485.651 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)ncn2)CC1 1828923739 WJLGLHGKERAKIY-SFHVURJKSA-N 453.503 0.728 50 20 JCGD NC[C@H](N)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc2ccccc2)C1 1829055920 DYPMYGUMYYWHQU-YRNRMSPPSA-N 455.918 0.259 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830353696 JVFMVYSVECISKO-KBXCAEBGSA-N 453.989 0.036 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1830538661 LYZGYLQENHRJTC-ORAYPTAESA-N 482.335 0.536 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)C1 1830726572 QUNCBRVHUWWCTK-IERDGZPVSA-N 473.954 0.220 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3csnn3)CCO2)C1 1831750465 ASKWNYNIZWBJJL-HXUWFJFHSA-N 491.482 0.755 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)CCO2)C1 1832430751 AAKBYOZASFDFQC-OXQOHEQNSA-N 473.885 0.987 50 20 JCGD Cn1nncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1833236701 QHTBOCRHUAQOBH-DYESRHJHSA-N 492.374 0.891 50 20 JCGD Cc1noc(C)c1CC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833729475 MFHPCULZMJDRBS-UHFFFAOYSA-N 483.573 0.718 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1ccnc1 1834798154 XHCRLVITSWVFGK-QGZVFWFLSA-N 453.352 0.009 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnnc4ccccc34)CC2)CC1)c1cccc(B(O)O)c1 1834800189 XVDPJBDFHCGQHS-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834826700 TZLFRGWLRUYLRM-LJQANCHMSA-N 457.369 0.821 50 20 JCGD Nc1n[nH]c(CCC(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)n1 1835665457 KPQIWXMCZNYKBT-UHFFFAOYSA-N 456.389 0.676 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3c3ccc(F)cc3)C2)C1 1835926297 LRGBNBNBPKAYNU-OTNCWRBYSA-N 482.317 0.379 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc(F)c3F)C2)C1 1835941187 KHRBAYDKPNKQER-QFIPXVFZSA-N 478.232 0.168 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc[nH]c3[N+](=O)[O-])CCO2)C1 1836508334 WAGUHZMJNZLXIT-MEDUHNTESA-N 460.285 0.561 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]cc3[N+](=O)[O-])CCO2)C1 1837792893 LZGAFQYLTHXJFE-MEDUHNTESA-N 460.285 0.419 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921175 JAUJUJCVDSMXFW-OINMWHHXSA-N 487.362 0.508 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)no3)CCO2)C1 1838102155 ZIYLTBMYDGXYMA-RBZFPXEDSA-N 488.925 0.582 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnn4cccnc34)CC2)CC1 1838309799 MZXJZKYSIVGYNR-UHFFFAOYSA-N 492.540 0.654 50 20 JCGD CN1CCN(C2(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@](C)(Cl)CCl)C4)C3)CC2)CC1 1839107576 RWLYDGVNFYBUNL-PMACEKPBSA-N 477.433 0.459 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1 1839200537 MIOAGIPWOHCEHJ-HACGYAERSA-N 452.321 0.438 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)cnc2c1 1839200619 LIOAAGIJSFHYEX-OXJNMPFZSA-N 497.321 0.763 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1839666047 MIQQPHNBECKJQZ-QYWGDWMGSA-N 497.390 0.687 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839670465 JSSGFRVEYDRSDT-ACJLOTCBSA-N 473.324 0.191 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)C2)C1 1840150631 NXTDKQLFUVOLHE-ZOCZFRKYSA-N 477.986 0.857 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(F)cc3)C2)C1 1840183482 HBPKNMQCXZDTKP-JOCHJYFZSA-N 450.511 0.198 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@H]2CN(Cc3ccccc3)CCO2)C1 1843924406 YKLJVRIPUSRCBF-JOCHJYFZSA-N 463.343 0.084 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)cc1 9931055 PMOBDTXRSGESPH-SFHVURJKSA-N 493.563 0.563 50 20 JCGD Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C 27204229 UPJKUDQQSLADGE-CYBMUJFWSA-N 476.921 0.709 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC[C@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)s1 27804245 FZHJIIGHIYOKSI-HNNXBMFYSA-N 475.556 0.894 50 20 JCGD O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1 109338642 VHWQBOXTLHIIBH-UHFFFAOYSA-N 484.542 0.856 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Nc1ccccn1)c(=O)n2Cc1ccccc1 726875123 LENSQKUOHQCVPI-UHFFFAOYSA-N 462.470 0.676 50 20 JCGD CN1CCN(C[C@@H](NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2ccccc2)CC1 727945766 MJCDWAWRQFETAB-HXUWFJFHSA-N 463.542 0.866 50 20 JCGD Cc1cc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)ccc1F 729276102 WZUYOSAKRBESRY-LBPRGKRZSA-N 472.520 0.634 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O 730782934 ZGQXJLDILIKXSN-CQSZACIVSA-N 475.479 0.556 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)COc2ccccc2O)c1 730836298 PZIUWDWTNKJIQF-UHFFFAOYSA-N 478.527 0.379 50 20 JCGD NS(=O)(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccccc3F)CC2)cc1 732923066 KXDRVRIVZQEEFC-UHFFFAOYSA-N 484.531 0.335 50 20 JCGD Cc1ccc(S(=O)(=O)N2Cc3ccccc3C[C@H]2C(=O)NNC(=O)C(=O)NC(C)C)cc1 744446705 KMACAGVTBWRQEB-IBGZPJMESA-N 458.540 0.783 50 20 JCGD CN(C)S(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 811588124 YFGBAFAGOPDCJS-QGZVFWFLSA-N 497.913 0.735 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1csc(N2CCOCC2)n1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 912852202 PSIIZTYGQJBITM-VNHYZAJKSA-N 481.600 0.648 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@@H]1COc2ccccc2C1 916635907 IHCPDQDGWQKVOJ-IBGZPJMESA-N 488.566 0.974 50 20 JCGD COc1cc(C(=O)NNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc(OC)c1OC 918001564 QCSMRCOEMMWGPI-UHFFFAOYSA-N 495.533 0.736 50 20 JCGD O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1)N[C@H]1CCS(=O)(=O)C1 919886430 XDLSXRDYPJYLLH-HNNXBMFYSA-N 452.514 0.619 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc(N4CCNC4=O)c3)cc2)CC1 1321518930 IWVLYOFVGMDEFS-UHFFFAOYSA-N 458.544 0.909 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778090961 JDMSTNPEFOGBPO-GGGSDYILSA-N 472.546 0.325 50 20 JCGD C#CCO[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091332 ASUJWLCSXHPIBX-JETUKDQUSA-N 457.531 0.673 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034960 YOIJYXWRKACTIW-KSSFIOAISA-N 454.325 0.302 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCO2)C1 1779036558 AUSCGQGJTHYUQZ-JOCHJYFZSA-N 494.468 0.227 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2 1779200657 NGSDYWQKJBHFGW-ALYFQZSWSA-N 450.330 0.348 50 20 JCGD O=C(c1n[nH]cc1I)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2 1779544749 SWXFGNOWZJJIMW-GXFFZTMASA-N 456.643 0.992 50 20 JCGD O=C(c1n[nH]cc1I)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2 1779544763 SWXFGNOWZJJIMW-ZWNOBZJWSA-N 456.643 0.992 50 20 JCGD COc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1780378324 DWWKGKNUJWVAHQ-ZJSXRUAMSA-N 452.316 0.816 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(OC)c1 1780534779 LYDXFEAMFMODMS-QHCPKHFHSA-N 454.288 0.141 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc([N+](=O)[O-])o1)C2 1782210169 IFZZLWUHRXQNPF-FOIQADDNSA-N 451.480 0.688 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1Cc3ccccc3O1)C2 1782214081 BOTJMXYYBYKRGT-YOSAUDMPSA-N 458.559 0.877 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782545047 LLCLVIRWWFKQTP-ZDWFVDTJSA-N 469.546 0.345 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)CC[C@@H](N)C(N)=O)CCO2)C1 1782864505 NFLBLTVNVWGAGU-JSBFAPMUSA-N 461.469 0.294 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1783712288 NSQIVGCDWLBBCX-QVKFZJNVSA-N 455.556 0.103 50 20 JCGD CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C[C@@H]21 1783849716 GJDGMHBVBPJZMC-ULQDDVLXSA-N 464.028 0.903 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)CCO2 1783936198 RWZVDIANANOCBX-UZUQRXQVSA-N 481.594 0.446 50 20 JCGD CSCC[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1783972615 ZNLNIUDVHIEKLI-DWWSDUFCSA-N 451.549 0.064 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccnc(C(F)F)c1 1785520423 KUBVUKRPNNSKLZ-IEZWGBDMSA-N 459.258 0.606 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1785552007 VXPMKZNAKWVOQS-UPWIVDSGSA-N 465.271 0.432 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789925994 KXUJVRGZLCUPRO-YTFOTSKYSA-N 467.288 0.151 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)C[C@@H]21 1790964061 RCQSEYBKFQYJQP-MWTISTBLSA-N 484.395 0.610 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1792249326 HCNYHJGRHLIPMT-OQRYQMPQSA-N 494.552 0.097 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C[C@H]2C[C@H]21 1792983125 FGHUILVPRAPYDU-ZUHGMRDBSA-N 457.955 0.574 50 20 JCGD COc1ccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c(OC)c1OC 1793088839 VCVCZTBZTHURQB-DMSOZEQRSA-N 468.934 0.915 50 20 JCGD Cc1nn2cc(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)nc2s1 1793662518 LYAUYOGAKWIAGH-DJBIQUGXSA-N 460.329 0.922 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCNC2=O 1795348564 JPAQWTUSMITSLK-SSJPOKSSSA-N 466.502 0.012 50 20 JCGD Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1F 1795737717 LXNCJXHDUZHNMN-BBIADKPPSA-N 454.307 0.650 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2 1796443779 JQGHZLBHCIHIES-DAJIKEEBSA-N 458.346 0.946 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc2c(c1)[C@@H](C1CCOCC1)C(=O)N2 1797327852 ZMVHVSFFQRZDBQ-FNCFORQESA-N 491.972 0.952 50 20 JCGD COCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799346545 CJWZJDFOEZINPB-OCVGTWLNSA-N 455.321 0.336 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](c1ccccc1Cl)N(C)C 1800312705 LZCNXNNQDAXCHT-FHTPNYMGSA-N 480.009 0.905 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1800807908 BYKUTVGUMWVESJ-DXUDUQDWSA-N 494.358 0.637 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801012400 CXLBDZMMDDRQEF-VTEUUUEMSA-N 465.482 0.619 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(F)c(F)c(Cl)c1 1801830054 YNFJDLBCEAHHIG-HBCWATKFSA-N 464.661 0.815 50 20 JCGD Cn1c(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cccc1=O 1805309048 QRIGJEQHVZRXSE-XMSQKQJNSA-N 460.299 0.094 50 20 JCGD O=C([C@H](O)CCl)N1CCC2(CCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)CC1 1807089830 OKQWCMPGNMKRAS-CZUORRHYSA-N 452.939 0.824 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361448 ANYYGVNODVPLJU-OFNKIYASSA-N 450.348 0.567 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807363814 QJYJACRALFQDLE-WMZHIEFXSA-N 487.325 0.748 50 20 JCGD CN(C)c1cncc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1807369316 FZGLMWDIQUGLCY-WMZHIEFXSA-N 473.342 0.856 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374571 ZZRDOTFFJLZWIG-GCJKJVERSA-N 470.298 0.666 50 20 JCGD CN[C@H](CC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1)C(=O)O 1808414046 DPPBVXLULHFSBH-SCLZEDSOSA-N 483.529 0.284 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810507851 JXUOWLMCVQKSLL-QLVMHMETSA-N 481.557 0.705 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1 1813071616 UWUJFCLCOQLZNP-KBXCAEBGSA-N 455.462 0.570 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361946 VRYQVWLKOIPEON-WBVHZDCISA-N 458.349 0.354 50 20 JCGD CCn1nc(C)cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1816712937 YYSPTHDYYJSAFZ-OAHLLOKOSA-N 453.333 0.887 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3cn[nH]c3cn2)[nH]n1)c1ccc(B(O)O)cc1 1817472360 RRATYGOJPRZSJK-IBGZPJMESA-N 459.275 0.981 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCCC[C@H]2c2cc(NC(=O)C(Cl)Cl)n[nH]2)n(C)c1=O 1822417644 HNHOBQGNHIMXMH-NSHDSACASA-N 497.343 0.653 50 20 JCGD C[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2)n1cccn1 1826858334 CXNJVBSWFOMJJM-RYUDHWBXSA-N 454.516 0.825 50 20 JCGD O=C(Cn1cccn1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551979 YQNLTPZSSJRAKY-AUSIDOKSSA-N 489.960 0.935 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725734 RJFXWPSEUBKDPT-VGSWGCGISA-N 478.933 0.556 50 20 JCGD O=C(C1=NO[C@H](c2ccccc2)C1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731683 NSZJLHWBJUDTER-LVCYWYKZSA-N 451.907 0.560 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)n(C)n3)CCO2)C1 1830955314 KPIHHMQDXSUZJQ-APWZRJJASA-N 457.369 0.901 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C1CCC(C(F)(F)F)CC1)CCO2 1832143766 UWEFNMKSUUJYNI-CWZMJNCASA-N 498.307 0.805 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1C(N)=O)CCO2 1833311015 BONFZBBDLAFFOW-FQEVSTJZSA-N 450.568 0.102 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1833991761 RWPSMMCFJZCYFU-LJQANCHMSA-N 487.022 0.411 50 20 JCGD Cc1c(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cnn1C 1834279403 MDGMTMCVULBBMA-UHFFFAOYSA-N 468.562 0.226 50 20 JCGD COc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834509474 DTOFJSRDLJRXHP-UHFFFAOYSA-N 479.386 0.803 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cc(=O)n2[nH]cnc2n1 1834797186 FYHXRMODVOUMBB-HNNXBMFYSA-N 484.330 0.293 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)o1 1834798495 BZCILPSENVFXTF-UHFFFAOYSA-N 482.346 0.417 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799338 YAVUQJAXVGRJJJ-LJQANCHMSA-N 478.402 0.825 50 20 JCGD C[C@@H]1CCc2c(C(=O)N3CCC(N4CCC(NC(=O)c5cccc(B(O)O)c5)CC4)CC3)n[nH]c21 1834799921 DYNAFLXEIOQGFE-MRXNPFEDSA-N 479.390 0.638 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCC4)CC2)CC1 1835738060 RVWKBHRUKPSWMP-UHFFFAOYSA-N 494.600 0.717 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)Cn3cncn3)CC2)CC1 1835807698 DAZYCHJHFHGFJK-LMZJGYQHSA-N 497.604 0.620 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835833565 RWTLSWACWKMGKN-UHFFFAOYSA-N 461.444 0.403 50 20 JCGD Cc1csc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835935183 FPXOBAYVQJKBDO-HSZRJFAPSA-N 472.372 0.439 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1836255413 AXASAZCSLAUYEQ-LIRRHRJNSA-N 474.967 0.316 50 20 JCGD Cc1cn(CC(=O)N2CCC(N3CCC(NC(=O)[C@H](F)Br)CC3)CC2)c(=O)nc1O 1836414290 CDILWLLSWZSGRK-INIZCTEOSA-N 488.358 0.519 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1838418455 ADTHDLGDRRTDGO-DYVFJYSZSA-N 489.323 0.517 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)ccc1F)CCO2 1838858487 KFHFDPOFOZCDMN-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(C(F)(F)F)c1)CCO2 1838935740 LDPHGQMUIDXSNW-QFIPXVFZSA-N 492.259 0.769 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)cc1 1838965734 FGYCBWILTXKDNM-MSIOFZDNSA-N 483.525 0.899 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839152105 ODBFDLZBKBGCRH-KPOBHBOGSA-N 498.404 0.565 50 20 JCGD O=C1Cc2cccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)c2N1 1839202315 AILWPWGVGAJXSL-LPHOPBHVSA-N 470.295 0.942 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(F)c1 1840074533 YFVLNWMXQZSHOV-UVXPNCNTSA-N 498.316 0.298 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840183644 QYCFFFHHJLKJIQ-HSZRJFAPSA-N 462.547 0.067 50 20 JCGD O=C(c1nc2c(=O)[nH]c3ccccc3n2n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840188481 MJJFCIXNNNTWDF-FQEVSTJZSA-N 495.323 0.445 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1840889924 QDUVKKVVGLMWEH-MHECFPHRSA-N 452.316 0.240 50 20 JCGD CNC(=S)NCCC(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1 1841924646 KZDPXNVPFJGUIZ-ZDUSSCGKSA-N 462.016 0.806 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(-c3ccc(O)nn3)cc1)C2 1844265085 UBFGORMHJCYJFX-UHFFFAOYSA-N 473.493 0.979 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCC(=O)N1CCCC1)C2)NC(=O)NCc1ccccc1 1845038259 KTLLPPKLUHYPAY-UHFFFAOYSA-N 484.601 0.939 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1847154648 CYMOEKYEMIGSHY-UHFFFAOYSA-N 459.352 0.734 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1)C1CC1 1847349168 WPVUXHFNODZHKN-OALUTQOASA-N 457.336 0.581 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1ccc(Br)cn1 1848244294 LLCPALXTHOBGIO-HOTGVXAUSA-N 452.353 0.961 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N(C)C)cc2)c2ccccc2c1=O 16095557 WMQYJMFELRWBLE-UHFFFAOYSA-N 493.567 0.680 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc2c(c1)CCC2)NNC(=O)c1ccc([N+](=O)[O-])cc1 725997482 MCJCNAGOTFPPIR-UXHICEINSA-N 496.476 0.663 50 20 JCGD CN(C(=O)CN1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1)C1CCCCC1 728594563 UYHNUMDLEDEKBQ-UHFFFAOYSA-N 469.550 0.425 50 20 JCGD Cc1nc(C)c(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)s1 731123738 LUOYFZIKWMIDQI-UHFFFAOYSA-N 467.573 0.968 50 20 JCGD O=C(CNC(=O)c1ccco1)NN=Cc1cccc(C=NNC(=O)CNC(=O)c2ccco2)c1 750944067 QXAKXIMKSYTLGN-UHFFFAOYSA-N 464.438 0.633 50 20 JCGD O=C(NNC(=O)[C@]12CCC(=O)N1CCS2)c1cccc(S(=O)(=O)NCc2ccccc2)c1 887840481 GKXAMDOHDDXLOB-OAQYLSRUSA-N 474.564 0.992 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)c1 912924859 UUKWZMLLDUACLA-HUUCEWRRSA-N 454.549 0.204 50 20 JCGD CS(=O)(=O)NCCC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 914463060 LLGURQDRTOQRHI-UHFFFAOYSA-N 474.948 0.841 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)c2ccccc2c1=O 915901536 JLDHADDUGVBFHO-UHFFFAOYSA-N 463.542 0.695 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@@H](Cc3ccccc3)N(C)C)nc2)CC1 915901726 YWGRMDJEITVJLT-LJQANCHMSA-N 475.619 0.817 50 20 JCGD COCc1ccccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916425891 YZHNYFNRTYNYIB-UHFFFAOYSA-N 462.528 0.998 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2cc(Br)c[nH]2)CC1 918002470 LQZABDAVEZWAQP-UHFFFAOYSA-N 473.328 0.801 50 20 JCGD COc1cccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1OC 918233946 WYJMIQUSEJYHSX-UHFFFAOYSA-N 464.548 0.861 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc4ccccc4cc3O)c2)CCN1 918781361 WUGQPOOJVWSDHY-UHFFFAOYSA-N 468.491 0.741 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O)N[C@H]1CCS(=O)(=O)C1 919885678 QDUDOZLJOHYZRM-HNNXBMFYSA-N 456.480 0.614 50 20 JCGD CCOc1ccccc1OS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919887140 ZPZCISINVRWEJW-OAHLLOKOSA-N 497.551 0.984 50 20 JCGD CC[C@@H](C)C(=O)NNS(=O)(=O)c1cc(S(=O)(=O)NNC(=O)[C@H](C)CC)c(OC)cc1F 921295629 RJEYZQGOSWABHK-GHMZBOCLSA-N 482.556 0.546 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@@H]1CCCCO1)C2 1779371318 OQOZAYLMBRWCIO-XKDCRVNJSA-N 459.547 0.772 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)n1ccccc1=O 1779372717 ZKOHTGVKMFVKDY-LSRZYVKLSA-N 482.541 0.236 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3csc4c3c(=O)n(C)c(=O)n4C)C2)C1 1780924408 KYDJRDWVEHJPED-SPLOXXLWSA-N 482.990 0.689 50 20 JCGD COc1ccc(COCC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1783936946 BJDARTIRXIXZLB-HSZRJFAPSA-N 462.547 0.415 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CSc3ccncc3)[C@H]2C1 1785159977 WGNVAVUECVFQRF-JVPBZIDWSA-N 470.555 0.466 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1 1789232225 ZBQSAEMVGKJBJV-HZCDGDGTSA-N 454.911 0.854 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(C#N)c1 1789839624 NBNDHDXMRKVTDS-TZYHBYERSA-N 477.326 0.083 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791290809 NVKAZJQBRWMPRA-ZWOKBUDYSA-N 462.595 0.993 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3CNc4ccccc4O3)C[C@@H]21 1791291125 MVVSPCYMVQCMSR-NTLWEQJWSA-N 473.574 0.602 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(C)c(O)nc3=O)[C@H]2C1 1792132484 UXKHIWCISYLWPD-XQLPTFJDSA-N 471.352 0.411 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792982686 MCMQNDNCVWKUJF-IXXKSVCMSA-N 457.955 0.575 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@H]1CC(=O)N(Cc2cccs2)C1 1793972933 FCUAZPNRLBIXHZ-BHUQQCALSA-N 455.964 0.286 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CCCC3=O)C2)c1cccc(B(O)O)c1 1795739249 WQSWFYMIFGMHOE-BBIADKPPSA-N 462.311 0.402 50 20 JCGD Cc1cnoc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798400999 AKCCAHJVIPALAV-OPVJXMOQSA-N 470.530 0.532 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccoc2cn1 1799879394 GIBMITHPSXWKOM-HBCWATKFSA-N 450.455 0.343 50 20 JCGD C[C@](O)(C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(F)(F)F 1803994008 KJHVRUYJNDWSOJ-RISOHXOYSA-N 480.447 0.713 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1804199447 XYDASUSSWHRDMN-LNLFQRSKSA-N 456.996 0.835 50 20 JCGD Cc1cc(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1C 1807365887 PRAJVSLFVGLNJV-WMZHIEFXSA-N 461.331 0.366 50 20 JCGD CCn1nc(C)cc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807370847 LNDZZGWWECVUOO-SIKLNZKXSA-N 461.331 0.920 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2cscn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371690 XWWHHGDTUZXWLC-DYESRHJHSA-N 450.329 0.780 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373771 GASPULVUKSYBAE-YSIASYRMSA-N 457.361 0.195 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1 1809234811 CJSPKYKHKPKZOM-LPHOPBHVSA-N 465.518 0.212 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)[C@H](N)c3ccccn3)C2)CC1 1809790515 AZOJXIAKLYBLMD-LJQANCHMSA-N 451.531 0.625 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1 1810301707 AIKYKFMWBGVZIJ-ACJLOTCBSA-N 479.457 0.345 50 20 JCGD CN1CCN(CCC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1810303947 XYKUNTNIMWPZHV-WMZHIEFXSA-N 494.600 0.037 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc(Cl)ncn1 1811122958 JNXUSYPOIVWQHK-JXFKEZNVSA-N 465.706 0.838 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1)NC(=O)NCc1ccccc1 1815779497 GLSSWPDYPNOODQ-INIZCTEOSA-N 497.585 0.693 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476937 IAEFTWBDMCBDHL-IBGZPJMESA-N 450.308 0.978 50 20 JCGD COCCn1nccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1817590310 OQQCCVKLXMZHDJ-GFCCVEGCSA-N 484.542 0.524 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CNC(=O)OC(C)(C)C)CC2 1826082993 HLRITWUKNSTMSY-TZMCWYRMSA-N 498.606 0.314 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057401 DPRVDFSVRADRPY-LAUBAEHRSA-N 465.363 0.890 50 20 JCGD CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCN2C(=O)OCc1ccccc1 1829000848 MBPHUIPKTIOPIE-XMMPIXPASA-N 465.315 0.452 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1Cl 1830108329 OJVVILWOLYTXQR-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H]4Sc5ccccc5[C@H]43)C2)C1 1830731814 PWLOQMVYBJNGJG-OKRWTYQPSA-N 452.960 0.930 50 20 JCGD O=C([C@@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832252334 YIDAPSWHYCZLGD-PELKAZGASA-N 483.184 0.489 50 20 JCGD Cc1noc(C)c1CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1833068713 PAVFULKARBPESD-QFIPXVFZSA-N 465.551 0.053 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(O)C(F)(F)F)CC2)CC1 1833641964 RRKYNERPMJIBHI-LJQANCHMSA-N 465.517 0.244 50 20 JCGD CC(=O)c1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n[nH]1 1834066522 WOKHRXWICDKPRK-UHFFFAOYSA-N 482.545 0.110 50 20 JCGD CC(C)n1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834801297 XEBOGJRULOVZKU-UHFFFAOYSA-N 467.379 0.643 50 20 JCGD Cn1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c2cccnc21 1834801317 XZEITRCDALUPKN-UHFFFAOYSA-N 489.385 0.752 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801413 HIZQRGQTIYCJQZ-KRWDZBQOSA-N 467.379 0.318 50 20 JCGD CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1834973419 ZMMLAJQNPLATBN-AWEZNQCLSA-N 450.931 0.015 50 20 JCGD COc1cc(C)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835931661 WRNOXHQZDVSHHC-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD O=C(c1nc2ccc(C(F)(F)F)cn2n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836289922 OUNNODUWTCZAQF-SCLBCKFNSA-N 491.854 0.418 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1csc3c1CCCO3)CCO2 1836387638 QTDGOGSDNZOAEQ-HSZRJFAPSA-N 486.355 0.137 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CNC(=O)C(F)(F)F)CC2)CC1)[C@H](F)Br 1836414643 VQGAKBHBABHRFA-ZDUSSCGKSA-N 475.281 0.927 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cnccc3[nH]1)CCO2 1837106343 RRADDVRAIFNFTN-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD CSc1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459141 KAMBVYBMPNEMRE-QFIPXVFZSA-N 486.554 0.186 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3)C2)C1 1837460353 CNJLDTBEKTUNDV-FHAGJXEFSA-N 479.537 0.559 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1837498996 BZECCUOMKWZRHD-ZYSHUDEJSA-N 483.345 0.174 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1cnccn1)CCO2 1837605558 BIBPOIRJGMDBTF-QYWGDWMGSA-N 467.954 0.459 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)NCc1ccco1 1837637414 MABYFZYDVFSQAO-YADGQWAMSA-N 484.347 0.693 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1839144491 BQAQCVILMDUOJN-ZHRRBRCNSA-N 464.950 0.814 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1F 1839468069 LLEXZPYAQBYMRI-JXFKEZNVSA-N 461.893 0.701 50 20 JCGD Cc1cccn2ncc(C(=O)N3CCO[C@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)c12 1839612886 ZIJZTADQMOUFCE-QHCPKHFHSA-N 472.546 0.086 50 20 JCGD O=C1C[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)CN1 1839872377 WWGKZFFPBWIEKS-SVMVAKDDSA-N 494.386 0.585 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1839964732 AZPGBIQKGJCWNX-LIRRHRJNSA-N 466.336 0.973 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840035071 FPOJKULVFUVGQY-CKMMYEAESA-N 484.347 0.996 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1840155487 DFIUAJWEEXXDQW-PJFSTRORSA-N 494.898 0.854 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185227 MQIPDGHZIQDHDT-JPYJTQIMSA-N 461.563 0.090 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)ccc(Cl)c1F)CCO2 1840751878 KFIOCVVTLBPZSY-QFIPXVFZSA-N 494.687 0.682 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2 1843416436 KHCZQCONRIZETQ-LZJBYSIYSA-N 454.531 0.725 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C1(N3CCN(C)CC3)CC1)C2 1843416752 WIRDZDMFHDTDBF-KOEQRZSOSA-N 455.563 0.104 50 20 JCGD COc1ccc(CCC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c(OC)c1 1845928598 MDWIEYVJLHTBGH-UHFFFAOYSA-N 452.316 0.833 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1 1847262909 OCGZUOUMBZODDZ-FQPAOGJPSA-N 468.558 0.393 50 20 JCGD CN1CCC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN(C)NC(=O)NCc2ccccc2)CC1 1847306419 YLFJPTQBPZQSQG-SFTDATJTSA-N 456.591 0.876 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)Cc1ccc(F)cc1 15765435 ORNOCEVMZMNEME-UHFFFAOYSA-N 451.476 0.859 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c2)CC1 15794933 LMDRXRXJYVMVSN-FQEVSTJZSA-N 488.522 0.140 50 20 JCGD C[S@](=O)Cc1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 25961068 GYONWIXWIWPJNX-JGCGQSQUSA-N 493.607 0.980 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cccnc3)CC2)o1 728851836 XQAAMGNOIVCGRW-UHFFFAOYSA-N 464.500 0.642 50 20 JCGD O=C(CCNS(=O)(=O)c1cccc(Cl)c1)NNC(=O)C1CCN(c2ncccn2)CC1 728889829 QRXZNZUAOXKYHI-UHFFFAOYSA-N 466.951 0.862 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)C1CCN(c2ncccn2)CC1 729049008 KAYLNKABLQGXBJ-UHFFFAOYSA-N 480.573 0.762 50 20 JCGD CCOc1ccc(-c2nnc(S)n2CCC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1 729275714 QQIKEXBNSGLLMO-LLVKDONJSA-N 456.550 0.108 50 20 JCGD CC(C)(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 788006147 SZRPJVUMPKVWJM-GOSISDBHSA-N 491.522 0.908 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)c1 845947035 JLVLJDYFNOJAJF-UHFFFAOYSA-N 461.496 0.870 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2CN(CC(C)C)CCO2)cc1 915922737 AWXGPOXBBUKMKJ-KRWDZBQOSA-N 455.581 0.303 50 20 JCGD O=C(NC[C@@H]1CCS(=O)(=O)C1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 916375065 FRGCYNMCNHJZKV-INIZCTEOSA-N 469.527 0.767 50 20 JCGD O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)[C@H]1COc2ccccc2O1 920339548 JBBNCSKQBAGTQR-MRXNPFEDSA-N 450.429 0.251 50 20 JCGD CC(=NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1 920385484 ZFVWUQCNRXEYOH-INIZCTEOSA-N 486.572 0.382 50 20 JCGD COCCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl 920863043 TVGAGWZOLUXWHY-UHFFFAOYSA-N 469.347 0.995 50 20 JCGD COc1ccc(CCC(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1 921072137 WCBSCJLHSFJMPL-UHFFFAOYSA-N 478.513 0.802 50 20 JCGD O=C(/C=C\c1nccs1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1520838438 MLRLCCKQJOOUIV-FPLPWBNLSA-N 450.542 0.957 50 20 JCGD Cn1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c(C(F)F)n1 1778357483 YXJCVRLIJDVLLU-VGOFRKELSA-N 476.289 0.479 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2 1779029725 XQMDMZDOSWYWQU-MWTRTKDXSA-N 453.499 0.527 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779033736 CPOLHQCGXWBJIK-DEOSSOPVSA-N 481.509 0.158 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)N2CCOCC2)C1 1779410699 QSXIWQADPVPGRX-VVWQDTPRSA-N 462.385 0.182 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](N)Cc1cccnc1)CCO2 1780097793 KKYIFUWYJBXDSU-RDPSFJRHSA-N 497.508 0.929 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)n1cncn1)CCO2 1780099074 RGNUJLLIJTUEND-LHSJRXKWSA-N 472.458 0.816 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ccoc4cn3)C2)C1 1782189167 DDMLIJMEAVYAHZ-JOCHJYFZSA-N 450.455 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3cccc(O)c3)C2)C1 1783274685 JEILNDKKNCFSJU-OIUIXCLQSA-N 451.483 0.548 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)COCCOCCOCCOC)C2)C1 1783685345 AHSHGELJDHHEKE-YLJYHZDGSA-N 450.960 0.530 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc([N+](=O)[O-])o3)[C@H]2C1 1784219474 DAPPEZOSHOEVPB-SVPPULJMSA-N 463.491 0.554 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)c1ccccc1 1786978626 FPRKQYDJBLWMBT-JKLQHZFJSA-N 495.341 0.057 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)cc4nn[nH]c34)[C@H]2C1 1789283216 OAJYAAOTYISEDM-PBQZTSCYSA-N 498.931 0.517 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)cccc3F)[C@H]2C1 1789441333 KHRWLRDONXKJQQ-QITLCBANSA-N 459.453 0.870 50 20 JCGD CC(C)N(C)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789728187 YNWSZNXXJAXWKX-FKBYEOEOSA-N 488.633 0.653 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C[C@@H]21 1789865692 CFNAUZUREJMLGM-FNCVKVGOSA-N 457.318 0.247 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@H](N)C(N)=O)C[C@@H]21 1790694197 FWZCCXMMXPDYSI-KNTDACPZSA-N 475.496 0.444 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc(F)c3F)[C@H]2C1 1790983565 QCTCQGBOYRIZTH-BQFCYCMXSA-N 452.502 0.860 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21)C(Cl)Cl 1791296657 RITUSRFZBUNXDA-DRZSPHRISA-N 461.371 0.675 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C1 1791330028 OPSKWVOVQOIJGH-SLARRSDRSA-N 463.934 0.872 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(C(F)(F)F)(C1)C2 1793476857 YONJZEIJUDCCBY-OSWFJYAVSA-N 467.448 0.621 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1793600109 UILVQIJRKRPSAU-AXVVYFOYSA-N 481.594 0.418 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3occc3c1O)C2)c1ccc(B(O)O)cc1 1795736266 UDAKGBCLDKSCLO-YVWYUNDQSA-N 450.256 0.335 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cn1 1796439585 NVIJEFCXNATRGR-WVNFENISSA-N 454.487 0.427 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cn2ccc(Br)cc2n1 1797314960 HVHWOLIOBJWBSA-VAECKANCSA-N 471.739 0.900 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)N1CCOCC1 1798485599 HYIASSJMUKYWHH-ULQWZQFMSA-N 474.986 0.407 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCNC3=O)C2 1799275790 BWKUHMQGAKDRKY-CVGJEZRXSA-N 458.346 0.456 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]12C[C@@H]1CCN2C(=O)OC(C)(C)C 1800773076 AVXMDGDBOVMIQU-NVHIMHAJSA-N 493.605 0.349 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccc(C(F)(F)F)cc3n1)C2 1801013082 USVYIUIMUOQJHQ-VTEUUUEMSA-N 496.490 0.929 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1801891695 UTUYYVXSVSRDGC-HULAXLKRSA-N 483.374 0.875 50 20 JCGD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n(C)n1 1805641691 SWABCYKWCLORBX-UZLBHIALSA-N 462.514 0.755 50 20 JCGD CCn1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1805905686 OULYVLDPEMMUGE-OXQOHEQNSA-N 462.514 0.930 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807359642 KTPQQMWVQWEEOT-SIKLNZKXSA-N 461.331 0.745 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1807361032 DTZNZRKOXIXPMC-FXAWDEMLSA-N 465.294 0.576 50 20 JCGD Cn1c(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cccc1=O 1807362280 JZBAMHLKVSGODC-AVRDEDQJSA-N 460.299 0.094 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc3c(c2)CCNCC3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807367205 RPXACQUZLGTMAA-PXDATVDWSA-N 499.380 0.478 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ncn(C)n2)[C@H]1c1cccnc1 1808414867 NDDQEFQIXBISST-RMEHUUNGSA-N 463.502 0.664 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc2cn[nH]c2cn1 1810084912 LTOJSERQLFBXSB-VGSWGCGISA-N 470.298 0.666 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1 1810302243 GYYPLKJPBKBTTF-OXQOHEQNSA-N 485.508 0.756 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C(=O)C(O)O)[C@H]1c1cccnc1 1811357769 AQVSZAQBLIDVRS-KDOFPFPSSA-N 458.427 0.545 50 20 JCGD CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1812659653 VTTJGHHVFBXJAP-JSWBHJQKSA-N 467.530 0.748 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1 1814876680 XOGYRHKLGLXDCZ-IHRRRGAJSA-N 486.957 0.770 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1 1817179934 PNWGRHMUAWZBGJ-GOSISDBHSA-N 470.534 0.436 50 20 JCGD COCc1oncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1818354337 ALJYVKQGMBTAGF-QGZVFWFLSA-N 453.264 0.844 50 20 JCGD Cc1nc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)no1 1819793361 MHEDPGNEWSHERI-JTQLQIEISA-N 456.488 0.302 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)Cn3nccn3)sc2C1)NC(=O)NCc1ccccc1 1823116266 VBZBRSRDKQKVIG-MRXNPFEDSA-N 497.585 0.693 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)CCl)CC1 1824182406 AMYDUXRODWXKQT-SJORKVTESA-N 450.001 0.631 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055713 IZOQDCVIRDEIJP-JXFKEZNVSA-N 464.393 0.280 50 20 JCGD C[C@@H](Br)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(O)O)C2)C1 1829330645 NFPJEMYJRRLNRI-JLTOFOAXSA-N 484.347 0.533 50 20 JCGD O=C(c1nnc(-c2ccccc2)o1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732178 VRTGMEFCEIIDAU-YWZLYKJASA-N 450.879 0.406 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn(C)c3=O)CCO2)C1 1831881612 ZVAPUFDMTUZWOP-IFXJQAMLSA-N 456.337 0.486 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)CC2)CC1)[C@H](O)CCl 1833312114 KDYMLSQNISBZPW-NHCUHLMSSA-N 461.994 0.924 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CC(N)=O)CC2)CC1 1833521327 VHSZLWRQUJCDGA-SCQWWOTGSA-N 473.578 0.204 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1sc(C)nc1C)CCO2 1834074250 QICZRMYATFSNQC-IBUSPFOHSA-N 488.570 0.964 50 20 JCGD Cc1ncsc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797425 JVCQFPPVYDXPRS-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD Cc1cc(C)nc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834936014 HLDCICADFNWCCO-UHFFFAOYSA-N 464.375 0.877 50 20 JCGD O=C(CCc1ccc2c(c1)OCO2)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1835177520 AZPTXHLEOSUFBJ-IERDGZPVSA-N 454.907 0.404 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnn4ccccc34)CC2)CC1 1835309625 UMBFGRIKMSPAQN-UHFFFAOYSA-N 469.590 0.893 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(CN(C(=O)CCC#N)CCO2)C1)NC(=O)NCc1ccccc1 1835359053 UYFBRNPOGGCTFK-QHCPKHFHSA-N 472.546 0.093 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)CO[Si](C)(C)C)CC3)CC2)CC1 1835510841 JAJVWVUDUDRHOP-UHFFFAOYSA-N 481.714 0.574 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1 1835845800 WBILNHUZBIYOOV-GUYCJALGSA-N 461.401 0.493 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncn3C)C2)C1 1838528097 FKFXMIOCWRNQCE-QFIPXVFZSA-N 487.469 0.637 50 20 JCGD N#CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1839363026 DICXTMFMJWEIPL-DEOSSOPVSA-N 478.509 0.135 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1 1840033284 ZWSDEFDITMBDJN-KZULUSFZSA-N 452.309 0.811 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1 1840075520 NQVABSDQRMQASI-GGXQVSFTSA-N 492.548 0.677 50 20 JCGD CCSc1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183241 VJNOLUIUKICAEY-QFIPXVFZSA-N 479.603 0.637 50 20 JCGD Cc1cc(Cl)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840697871 XVDSOYHTKBJKGB-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3CC(=O)C3)CCO2)C1 1840831232 BVJIQRIXBQZHRD-HRAATJIYSA-N 473.954 0.554 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840869392 WKMHSBHSCLIUON-LAUBAEHRSA-N 450.923 0.552 50 20 JCGD CCN1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)CC1 1840927952 IQZIAAGKUXTWLA-FXVMGJAWSA-N 488.589 0.309 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2 1844263513 MCIXYSFZQWLHTP-UHFFFAOYSA-N 476.493 0.188 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CCCn2c(O)nc3ccccc32)C1 1845012352 CSRXZFQIKXSKLN-UHFFFAOYSA-N 462.315 0.719 50 20 JCGD COCCOCCOCCOCC(=O)N1CC2(CCCN2C(=O)[C@H](C)Br)C1 1846179604 NSJRJTUKWWSFMX-HNNXBMFYSA-N 451.358 0.669 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@](C)(O)CN2C(=O)OC(C)(C)C)C1 1846231370 QAGDVENFUXSXLZ-AOMKIAJQSA-N 481.594 0.323 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cl)COC)C1 1846365827 XOMYJYRTDAYJGP-UONOGXRCSA-N 461.943 0.900 50 20 JCGD O=C(Cn1cc(Br)c(=O)[nH]c1=O)NNC(=O)c1ccc(COc2ccccc2)o1 24464384 MQLQKOKOUOTMMC-UHFFFAOYSA-N 463.244 0.932 50 20 JCGD Cc1ccc(-c2noc(CN3CCN(C(=O)NNC(=O)CNC(=O)c4ccco4)CC3)n2)cc1 725870156 BCKFSPDJWCBQTK-UHFFFAOYSA-N 467.486 0.926 50 20 JCGD COc1ccc(CN2C[C@@H](C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)CC2=O)cc1 726522491 MPGITUTVQIYDFB-AWEZNQCLSA-N 480.930 0.806 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)Cn1c(=O)oc2cc(S(=O)(=O)N(C)C)ccc21 728705618 YIVFMQXQIFIGRO-UHFFFAOYSA-N 482.902 0.968 50 20 JCGD COCCCNC(=O)[C@H](C)N1CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1 728941865 CSDZHPDZCIESGE-LBPRGKRZSA-N 459.345 0.290 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)NCc2ccccn2)c(Cl)cc1Cl)C(=O)NC1CC1 747151479 UTKOVYLJMJSSQG-UHFFFAOYSA-N 486.337 0.907 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2S(=O)(=O)c2cccs2)c1 749160638 MMHSABRAEIURCD-OAHLLOKOSA-N 486.597 0.613 50 20 JCGD COc1ccc(C(=O)NNC(=O)C[C@@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)cn1 761416154 OFBCIVHECNGUDM-MRXNPFEDSA-N 478.527 0.818 50 20 JCGD O=C(COC(=O)CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)[C@@H]1COc2ccccc2O1 825436276 INPDWXJLHOSBCG-KRWDZBQOSA-N 499.448 0.164 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1 916561906 IANQKPFHWKJOPQ-UHFFFAOYSA-N 475.527 0.716 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)COc2ccccc2C#N)CC1 918138098 KHVDZHFKSZVXRI-UHFFFAOYSA-N 460.491 0.347 50 20 JCGD CC1(C)NC(=O)N(CC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1=O 920425986 AIGRNWSLDWLCQW-UHFFFAOYSA-N 462.470 0.480 50 20 JCGD Cc1c([C@H](C)NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cnn1C 1248703709 FKUAGDDDLAXOQD-HNNXBMFYSA-N 478.575 0.774 50 20 JCGD NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2)C1 1321931653 QDJOYOZXNFIGPC-OAHLLOKOSA-N 458.544 0.756 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778092449 BVODQVKICYMVHU-YNEHVPKMSA-N 472.546 0.674 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cnc(Cl)s3)CCO2)C1 1779032834 XOSGPXQVXOXSRW-GOSISDBHSA-N 450.908 0.552 50 20 JCGD CSc1ncccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779912285 XXPDVTOCMUGWLC-AUSIDOKSSA-N 469.372 0.925 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1782707460 PLFDJIQXEYVXAQ-ICOFYABRSA-N 463.491 0.512 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1nn(-c3ccccc3)c3c1COC3)CCO2 1783933898 LHTDSHJJYFVIDQ-VWLOTQADSA-N 496.568 0.719 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783940103 QLXJKXNSOQHRRF-GBXCKJPGSA-N 491.564 0.076 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1 1785623835 PAJQZUOOPFRQNX-LRDNONRASA-N 493.964 0.693 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3sc4nccnc4c3N)[C@H]2C1 1786951818 YBBOMYJTNARQBE-CQDKDKBSSA-N 496.553 0.179 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)n4[nH]cnc4n3)[C@H]2C1 1786978859 DHHNSCVVHYDKAV-WVPLEHFKSA-N 457.318 0.247 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C[C@@H]21)c1cccc(B(O)O)c1 1786982682 CZKNAAUPNIMNDV-DEEVVMORSA-N 469.259 0.174 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)C[C@@H]21 1791057258 JVSFRSZMEIEHFU-JIQZXMICSA-N 461.382 0.552 50 20 JCGD Cc1nnc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)s1 1791288577 GZRDADGPDXLMGL-JYJNAYRXSA-N 452.581 0.132 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792983804 OTIVJDPUNLSMDV-DGADGQDISA-N 457.955 0.433 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CN(C(=O)OCc3ccccc3)C1)C2)[C@@H](O)CCl 1792984098 SGJJTWNOBTUPAG-RDGPPVDQSA-N 465.934 0.444 50 20 JCGD C#CCO[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1793345190 NTLZOHKMCOSSCC-NTNQKNOYSA-N 459.455 0.762 50 20 JCGD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1793489446 IUWNTIWJCUJOSM-SJRVDFGRSA-N 475.970 0.200 50 20 JCGD O=C(COc1cccc2ccccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793817159 ZVNHWRKXVQORIH-NXKWYNOOSA-N 474.322 0.802 50 20 JCGD Cn1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)cn1 1793882554 MAIQINRLOBCBFN-DFGXFYAUSA-N 469.970 0.684 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cncc(S(C)(=O)=O)c1 1794623816 KWJNMLAQKUUTNH-FWKYCFCSSA-N 486.554 0.871 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3=O)C2 1796441849 AGQFCJGPNFENNR-DWWIETNTSA-N 492.492 0.159 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)c([N+](=O)[O-])cn1 1796599635 SOJKKSFJGHHGFG-DHMDNZFNSA-N 483.485 0.635 50 20 JCGD COc1ccc([C@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797748740 ZDVPIEYVXNEUPW-WGVRVLLMSA-N 467.526 0.701 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OCCCO)cc1 1798545484 TXHLVYIAOFLZBZ-OPMZPASUSA-N 462.547 0.024 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCN(C)C2 1800125908 GDFUXAICSBAZBD-AFIMGQEJSA-N 468.396 0.953 50 20 JCGD COC(=O)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1801204964 KQSIYXVZDGCEQN-IVWMJMPLSA-N 464.431 0.079 50 20 JCGD COc1c(Cl)cccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1801803406 DSRBKICODWYUHN-CCWDJLKJSA-N 458.707 0.545 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CN2CCOC2=O)[C@H]1c1cccnc1 1803334531 LBNZFIJVYUPIQE-YQNFXTCNSA-N 481.513 0.674 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1806342777 LHUZCNFHZRUHMS-CGTJXYLNSA-N 455.353 0.523 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(Cl)ncn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361476 QFBKHLSMMCGPNG-OXQOHEQNSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccnc(Cl)n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375462 PEIAOENLJKGSBU-APWZRJJASA-N 465.706 0.838 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc(O)n1 1808334541 XZYAZSGRIWFFEM-AVRDEDQJSA-N 460.299 0.804 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CN2CCNC2=N)[C@H]1c1cccnc1 1808413392 ALMFZFNPOBFVII-SSZMOEMMSA-N 479.545 0.061 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](F)Br)[C@@H]1c1cccnc1 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O=C1Cc2cccc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)c2N1 1815348377 LTRZZMFFYATEKX-OAHLLOKOSA-N 476.323 0.857 50 20 JCGD COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n(C)n1 1817473438 UQIZBWMSCWWGQS-INIZCTEOSA-N 452.280 0.451 50 20 JCGD COc1ccnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1OC 1821794357 GWUUZXSWQJSRKI-CQSZACIVSA-N 482.327 0.775 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN(CCO)CCO)n[nH]1 1822026523 JHAYBCSLXRQCBU-KDOFPFPSSA-N 450.367 0.925 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1824462338 RKNKFVBTHNGOGG-AEFFLSMTSA-N 473.640 0.307 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(C(N)=O)cc3)sc2C1 1827501792 JHLCHQLXKNYASG-ZDUSSCGKSA-N 479.522 0.780 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1828132851 PCBYTIVXNWMRJX-DZGCQCFKSA-N 452.581 0.733 50 20 JCGD CCOC(=O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1828210662 RPCPESHLMXVURF-AWEZNQCLSA-N 459.333 0.638 50 20 JCGD CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1828887932 MSXUWYCUOVEOHF-DEOSSOPVSA-N 480.525 0.771 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)NC=O)CCN2C(=O)OCc1ccccc1 1829228090 QSURVYUNONVFIY-FHJLPGHOSA-N 494.976 0.827 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c(=O)[nH]c1C 1830534938 FHTLNYQHUFMESM-CWTRNNRKSA-N 471.352 0.488 50 20 JCGD O=C(CCCc1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830693400 BAHZAOYXKBRYGK-VWLOTQADSA-N 484.333 0.598 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)CCO2 1830834734 WRUFYRQMHRKETM-YTZAWJCFSA-N 494.539 0.898 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nccnc2C(N)=O)CC1 1831873436 KRALTWICEFTBPH-MRXNPFEDSA-N 459.551 0.182 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(Cl)c1 1832540214 ZSKCXDUFZHCWQB-QHCPKHFHSA-N 496.992 0.721 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1832840259 IYCWXANAXFAPLF-FGZHOGPDSA-N 457.380 0.905 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1scnc1C1CC1)CCO2 1833727407 GFQJVKBRFONAIW-QFIPXVFZSA-N 471.344 0.084 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccno1)CCO2)NC(=O)NCc1ccccc1 1834153425 QQDGJKWWXWNBRQ-QHCPKHFHSA-N 486.529 0.091 50 20 JCGD CCn1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)n1 1834405183 ZJQYUSBSMGSGLI-ZHNJOBQTSA-N 471.518 0.107 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C[C@H](N)c3cccnc3)CC2)CC1 1834765006 RRYWRHRERYTMEZ-NRFANRHFSA-N 473.622 0.416 50 20 JCGD CC(C)N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(C)C 1834787539 JICIOIBWZPAPCN-JOCHJYFZSA-N 487.649 0.893 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799342 YEDWCXYGRLNWDM-LJQANCHMSA-N 472.439 0.530 50 20 JCGD COc1cccc(OC)c1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836241202 FIZXPFRKWOFSPC-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD O=C([C@@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1)CCO2 1836485040 MUVGDIPVMRJNRB-QKLQHJQFSA-N 470.339 0.848 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)s3)C2)C1 1837456191 FDJVUYJQOOPUNN-HXUWFJFHSA-N 463.491 0.270 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CC[C@H](N)C(N)=O)CC2)CC1 1837883206 WGLAPGDTADLKSG-HOTGVXAUSA-N 461.401 0.751 50 20 JCGD COc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)c1 1837953455 VMYVGFQWYSELSK-VUEBRRCKSA-N 484.513 0.294 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](COC(C)=O)OC(C)=O)C2)C1 1839964756 BOCWMBPNDVRCEQ-TXPKVOOTSA-N 493.351 0.111 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1840034256 GGWNOERTHAXGOR-KZULUSFZSA-N 485.360 0.609 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1 1840156662 RZFJAAOUZNHIGL-YWZLYKJASA-N 463.959 0.611 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(Cl)c1)CCO2 1840709997 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PMIUJPZKECLTCL-UHFFFAOYSA-N 477.524 0.801 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)NNC(=O)c1cnn[nH]1 729456119 RNQWBXJYPSYMRB-SNVBAGLBSA-N 467.360 0.973 50 20 JCGD COC(=O)c1ccc(OCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 731284139 RBQOSDXFBKSRKL-UHFFFAOYSA-N 464.500 0.747 50 20 JCGD NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=O)NCc1cccc(C(F)(F)F)c1 742453382 HPYIKEIIEZKPQQ-UHFFFAOYSA-N 487.416 0.791 50 20 JCGD Cn1c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nc2ccccc21 915928258 HWLRVMZIHRWQFO-UHFFFAOYSA-N 472.527 0.738 50 20 JCGD O=C(NCCNS(=O)(=O)c1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916293817 IUKQYMPKBHWWSS-UHFFFAOYSA-N 495.583 0.394 50 20 JCGD CNC(=O)c1cccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1 916603318 KIXIABRDMBJJHR-UHFFFAOYSA-N 461.548 0.204 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(CC(=O)N(C)C)CC2)c1C 917230983 QJXQLDCIALPVGH-UMUMUWHJSA-N 473.574 0.995 50 20 JCGD CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 917917530 CDPWLMBBTDMFCR-UHFFFAOYSA-N 457.509 0.492 50 20 JCGD COc1ccc(S(=O)(=O)N2CCCCCC2)cc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886935 XWCFIMMXZWVYBV-AWEZNQCLSA-N 488.588 0.391 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 920435979 RZMSRXNLOCLRAL-CYBMUJFWSA-N 487.376 0.620 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCCNC3=O)C1 1778918498 HNDZYFRHQRHJBT-GQWAEJPESA-N 482.379 0.928 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)CC(=O)Nc3ccc(F)cc3)C2)C1 1780878674 OIKXXTJCCOTIRL-HSZRJFAPSA-N 484.488 0.297 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)C1 1781049777 UGHATKZFTWAFFA-VOMKJEOTSA-N 463.959 0.597 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnn(C)c2)C1 1782586165 JGILXISRLYAGBD-PZOAEKQQSA-N 469.546 0.611 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1783575033 BWOGWXJLLBLEGA-NTKDMRAZSA-N 487.362 0.209 50 20 JCGD O=C(CCN1C(=O)c2ccccc2C1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1785060472 OPEUYBVZDOQTKD-MGHWNKPDSA-N 463.918 0.252 50 20 JCGD O=C(CSc1ccncc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785159308 RGQPMYLZWZLIGV-VDGAXYAQSA-N 455.345 0.147 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786981122 UDBRZXQNJBKMBR-BUKVSMQUSA-N 496.329 0.248 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(N)=O)cc3)C[C@@H]21 1787508195 OKQSVINLFPYOTA-OZPLSILQSA-N 480.525 0.513 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610058 ZOILADMNQJVWEW-PKIAMQTDSA-N 454.325 0.062 50 20 JCGD Cc1ccc(O)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1789487965 CYQWAEFZGSSYFU-DCPHZVHLSA-N 453.499 0.606 50 20 JCGD COC(=O)CCCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1791353890 QWQBNLQFIZZUJJ-BZSNNMDCSA-N 454.568 0.463 50 20 JCGD COc1cc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(C)c1 1795736316 YFPKLFWNMJKUQM-OPMZPASUSA-N 452.316 0.509 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)ccc21 1796188983 JVBMKCMSQSZTPX-REPLKXPHSA-N 462.315 0.122 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn(C)cc2c1 1799911219 CJDZOMPNRVMESS-ZRNHTGQWSA-N 477.525 0.911 50 20 JCGD COCCOCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2 1800206895 YCHFQXNHOSBHBO-ACDBMABISA-N 486.610 0.084 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)c1ccccc1Cl 1801200316 DTUXEDAECVMIPC-RYMBOPBQSA-N 452.939 0.336 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Cl)COC 1802283538 OIOSZCAMTQRLGJ-RDGPPVDQSA-N 464.987 0.965 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1806340886 PLLVOACOSKVIQK-CZUORRHYSA-N 463.269 0.597 50 20 JCGD COc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc1 1807373795 AZSGYVWDUJLTJO-GCJKJVERSA-N 460.299 0.798 50 20 JCGD COCCn1nccc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808638587 UZCWYMCCNBMTHX-DYESRHJHSA-N 492.540 0.556 50 20 JCGD O=C(C#CC1(O)CCCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810326667 GUUIBDSJKRZZGB-XUZZJYLKSA-N 475.354 0.780 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1810514658 OCGDBTVHPQXTMU-TVTNDZMWSA-N 460.579 0.765 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1ccnn1 1812397244 FIDMRLXWZVIWCI-ALKREAHSSA-N 463.502 0.252 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](C)Br)[C@@H]1c1cccnc1 1812866067 GOIWIRMXWFZCDG-ZGMNHVEMSA-N 457.325 0.935 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C1CCC3(CC1)OCCO3)CC2)c1ccc(B(O)O)cc1 1815348128 FBUGNSAVQCOWCJ-KRWDZBQOSA-N 485.371 0.982 50 20 JCGD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)n1cccc1C=O 1815354508 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CN1CCN(C2(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1830252032 SZNJFNVCHBEWPF-QFIPXVFZSA-N 497.644 0.698 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1 1830535577 QMEJLFVYUJEOLI-YWZLYKJASA-N 480.363 0.919 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1 1830539085 AKNLFOGVMLQYCB-JXXFODFXSA-N 470.364 0.897 50 20 JCGD O=C(CN1CCc2sccc2C1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726327 QBPZECQIYLIWEV-JXFKEZNVSA-N 457.980 0.162 50 20 JCGD COc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccc1[N+](=O)[O-] 1830733288 HUSVUKZTWSFQEF-UZLBHIALSA-N 471.894 0.202 50 20 JCGD O=C(c1cc2cccnc2nc1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830736073 RGDQPXMTOJBKHG-MGPUTAFESA-N 450.879 0.005 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832723888 HQHFVDYBVJBFNH-YWZLYKJASA-N 483.363 0.299 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1832760260 GKDACLOIHVLYOS-PXNSSMCTSA-N 455.870 0.975 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccon3)CCO2)C1 1834482935 GHQYDLSGDFELCM-YWZLYKJASA-N 472.926 0.877 50 20 JCGD CN[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)C(=O)O 1834742510 PESPRFJJEPUCKS-ZFWWWQNUSA-N 451.337 0.311 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCc3ccc(F)nc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797332 DKHRNMOZGXEEKY-UHFFFAOYSA-N 482.365 0.719 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)CC1)c1cccc(B(O)O)c1 1834799781 AWQLODJMAPQXQD-DEOSSOPVSA-N 493.369 0.392 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C3CCOCC3)CC2)CC1 1835737119 ZAJUGKCHIRONPU-UHFFFAOYSA-N 458.563 0.297 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)n1ccccc1=O 1835737848 HEDLJZALCMVYTM-QGZVFWFLSA-N 495.584 0.293 50 20 JCGD CC(C)(C)Oc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939159 HFNXBWWAAQJQBJ-AREMUKBSSA-N 496.369 0.928 50 20 JCGD CCn1nc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cc1C 1835991762 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1839351787 QLBZCMRPRUJFEY-DJJJIMSYSA-N 454.321 0.639 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ncccc3[nH]1)CCO2 1839492883 PBYMKWHQSPPQAI-BATDETSNSA-N 493.524 0.767 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1 1840033293 ABBOJINJIDHCCF-YZMFZURSSA-N 462.341 0.755 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncn3-c3ccncc3)C2)C1 1840150890 SOHPUEFRKWZAPQ-LAUBAEHRSA-N 463.922 0.591 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(Cl)nc3n[nH]cc23)C1 1843205441 VIBHPZCZOGOHEA-UHFFFAOYSA-N 454.878 0.741 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1 9931454 UKGZDJQFPUBRLT-LBPRGKRZSA-N 473.479 0.961 50 20 JCGD C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728367505 HGQDJGGMBXQRLX-PXAZEXFGSA-N 467.438 0.212 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(CCNC(=O)NNC(=O)CNC(=O)c2ccco2)s1 729229266 ZJHSENLHJLZTOG-UHFFFAOYSA-N 471.561 0.675 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1 729273982 DVACYUQASWXURT-VIFPVBQESA-N 473.305 0.993 50 20 JCGD COc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)cc1 729275990 UUXAHKDUAVGWLR-ZDUSSCGKSA-N 484.556 0.503 50 20 JCGD O=C(NCC1(N2CCCC2)CCOCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 729623434 LIMIVVBBKXYQLX-UHFFFAOYSA-N 495.602 0.297 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCSCC2)c2ccccc2c1=O 730673412 ULFIMRFWEZXQMH-UHFFFAOYSA-N 482.588 0.300 50 20 JCGD Cc1nc(O)c(C#N)c(C)c1CCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 742733997 JQBXVMZISQTNFC-GOSISDBHSA-N 454.439 0.739 50 20 JCGD CS(=O)(=O)N1CCN(CCNC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1 746512550 PVDBHSXQSLQGSY-UHFFFAOYSA-N 465.532 0.380 50 20 JCGD C[C@@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 750547846 KCWSSEHSOXFBHI-DFQSSKMNSA-N 455.559 0.910 50 20 JCGD O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)CNC(=O)c1ccco1 751205017 VFWIJSUMQQVDEP-UHFFFAOYSA-N 462.260 0.720 50 20 JCGD CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 874061734 XYUOAPQMVCOMJT-UHFFFAOYSA-N 487.581 0.498 50 20 JCGD Cn1c(=O)c2nc(Br)n(CC(=O)NNC(=O)c3cccc(Cl)c3)c2n(C)c1=O 913076711 UOSCRGUMKCJUST-UHFFFAOYSA-N 469.683 0.311 50 20 JCGD CCOc1cc(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)cc(OCC)c1OCC 913210548 BWPRKNPZGKFXDI-UHFFFAOYSA-N 485.497 0.903 50 20 JCGD O=C(NCc1nnc2n1CCCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915915454 KIBGSLYWQOVYEY-UHFFFAOYSA-N 477.547 0.170 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@H]1CCN2CCC[C@@H]2C1 916572915 GCQJWRCKOMJMLN-RBUKOAKNSA-N 479.603 0.597 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCc2cccs2)cc1 920861250 LIFDTYDQMLXRMQ-UHFFFAOYSA-N 453.546 0.900 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1cccc(N2CCOCC2)n1 1778267371 WAJYDGYAPRWTDE-JBYIUTFZSA-N 466.966 0.645 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1 1778623591 NEOMZUXYJKZDPA-JOCHJYFZSA-N 467.461 0.458 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)n3ccccc3=O)C2)C1 1779264390 CBMZXXYIHUSQMB-DMBQVZDGSA-N 468.514 0.373 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779277973 KRPYXDJDYWIGJD-WIEQDCTASA-N 472.970 0.639 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779291948 HSPWYHKEMBJXMT-YBGOQADZSA-N 465.359 0.995 50 20 JCGD CO[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559651 ZEXREAWZQHQJIC-DRMXPCRNSA-N 475.590 0.881 50 20 JCGD COc1nccnc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968263 CRXCCGDVYOSETO-XMMPIXPASA-N 497.556 0.275 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCC=CO1)CCO2)NC(=O)NCc1ccccc1 1780969026 SOCVXOOSRZJBNI-GBXCKJPGSA-N 471.558 0.855 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccncc3)C2)C1)NC(=O)NCc1ccccc1 1780991207 OCQKKYRCRZVIRF-RUZDIDTESA-N 480.569 0.800 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)N(C)C(=O)OC(C)(C)C 1781037948 KRMLZTDBTPWTMU-MWTRTKDXSA-N 475.351 0.065 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)[C@H]1SC(=N)NC1=O 1781229467 HZBONWLQRVRZIQ-SKZFOKARSA-N 451.376 0.855 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1782539255 DVNNYWRLQXBNGR-YZZKKUAISA-N 461.563 0.736 50 20 JCGD COc1ccc([C@@H](O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)cc1 1783768373 GNNGVMABXWPBAO-JTUKCZSHSA-N 497.552 0.842 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ncn4nc(N5CCOCC5)ccc34)CCO2)C1 1783875351 LYQHAFCAVBUYPY-ZHRRBRCNSA-N 492.964 0.263 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1 1784237636 YMNHRTCWSQNXMC-OZXSUGGESA-N 477.370 0.475 50 20 JCGD COc1cc(N2CCC(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)CC2)ncn1 1784242516 SIHVAAOWRJVEOV-XSLAGTTESA-N 481.981 0.281 50 20 JCGD 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C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CN2CCNC2=N)[C@H]1c1cccnc1 1807112574 MFZHVESFNUIGOH-UKPHBRMFSA-N 451.369 0.958 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364828 UKSOWCRTVIKPPF-RXVVDRJESA-N 470.298 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCN2CCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807367368 ZAJMFVDDSHUXCY-NZQKXSOJSA-N 450.348 0.567 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(=O)OC(C)(C)C 1807370694 IYDJIPRSEXUKRY-KNQAVFIVSA-N 496.373 0.948 50 20 JCGD Cn1ncc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1Cl 1807373853 DAODVGPFWXYGKR-QFBILLFUSA-N 467.722 0.782 50 20 JCGD C[C@](O)(C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(F)(F)F 1810294044 HTSHHARSYYUCHM-OWZDWXTDSA-N 480.447 0.713 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1810528840 BYSUTRROWCKHTB-XEPGCRMWSA-N 479.541 0.912 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)N1C[C@@H]2C[C@H]2C1 1813072190 BBPSZZAEFMFRLQ-MNOXEHBPSA-N 456.591 0.801 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](O)c3ccccc3)sc2C1)c1cccc(B(O)O)c1 1814370125 OIIOTCZGNMHWHS-LPHOPBHVSA-N 451.313 0.782 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3ncccn13)CC2)c1ccc(B(O)O)cc1 1815341228 SXPIFPBPAJLPNM-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4cccnc34)sc2C1 1818991647 MAXBVEUWHGOUTK-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD Cc1cnc2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3cccc(B(O)O)c3)CC4)cnn2c1 1819088223 KDKQAZFUUFALCI-OAHLLOKOSA-N 476.327 0.714 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)N1CCN(C)CC1 1819403938 OHCDYPQWTGSUKA-BEFAXECRSA-N 483.577 0.350 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCC(=O)N1)CC2)NC(=O)NCc1ccccc1 1822518236 HDCWWTDAUFEKIL-DOTOQJQBSA-N 499.597 0.680 50 20 JCGD CS(=O)(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1822970621 YIUKLEZPFNLJBT-OAHLLOKOSA-N 463.520 0.149 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CNC(=O)C(F)(F)F)sc2C1 1826146845 ZBDVLJBSKIIJHT-VIFPVBQESA-N 464.470 0.107 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)CCO2 1830418616 KXAOBQATBQFBEI-FBLLAGFSSA-N 482.317 0.379 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1830539126 BODPJLNCRYUVMI-LIRRHRJNSA-N 471.352 0.767 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830722357 AQIOCSITFRVQCY-PGRDOPGGSA-N 470.950 0.693 50 20 JCGD O=C(c1cc(-c2cc[nH]n2)n2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732428 XWHLUMWMHRWBFK-REWPJTCUSA-N 487.944 0.999 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1 1832151486 ATTJHLRAYHGUDZ-MRXNPFEDSA-N 451.597 0.890 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1)n1cnnn1 1832289374 TVBNQHZQNDMOFV-KSSFIOAISA-N 455.523 0.166 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnn3)C2)C1 1832549565 UXPXZCCVOTUSLY-KKSFZXQISA-N 483.953 0.679 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccsc3)CCO2)C1 1833143077 XSMIFNWACVTCMW-LAEWNIMASA-N 450.561 0.591 50 20 JCGD O=C(O)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)ncn1 1833490882 DTWHRZSFGVZUAM-KRWDZBQOSA-N 457.281 0.030 50 20 JCGD CCn1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1834414023 GGNQLKORNYLZBE-NJRDNMGOSA-N 471.518 0.107 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc(O)n1 1834798658 VSQMPWKHLXLLTB-UHFFFAOYSA-N 466.347 0.274 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1834819630 SGOUGMJJSFWCDG-INIZCTEOSA-N 460.285 0.033 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)COc1ccc(F)cc1)CCO2 1834967496 UJQLVMFOIWOXFE-QFIPXVFZSA-N 466.510 0.034 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3nc[nH]n3)CCO2)C1 1836347378 FVLUXHSLMPGCPN-ORAYPTAESA-N 472.930 0.007 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1 1836380811 HLSWTVXGMFSUGC-XLIONFOSSA-N 473.979 0.714 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3nc[nH]c3c1)CCO2 1836934939 ZGJJQATZZOPHMQ-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)s1 1837457092 VQLVKZAXMBPDNS-QHCPKHFHSA-N 487.582 0.758 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3OCC4)C2)C1 1837460023 ZKGZEFQNZOGNSH-DEOSSOPVSA-N 481.509 0.004 50 20 JCGD O=C(CCBr)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1837653732 NFKCVYRTAGOZCM-LJQANCHMSA-N 462.385 0.421 50 20 JCGD Cn1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(C(F)(F)F)n1 1837957902 RVJAIOYIHCWPRO-LRDDRELGSA-N 454.833 0.109 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(-n2nccn2)c1 1838631693 NQVXCOHAMJVUMU-XMMPIXPASA-N 499.572 0.019 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1 1838762219 FGLKCUFKRXTNQY-BMIGLBTASA-N 484.273 0.925 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)nn1 1838832039 CVSNVVPNIDGANJ-FZKQIMNGSA-N 457.325 0.729 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(OC)ccc3[N+](=O)[O-])C2)C1 1840152225 BIVXZUSYMUVXOH-ORAYPTAESA-N 472.882 0.322 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1 1840153749 AODFPQWHOOHFIL-DYESRHJHSA-N 463.922 0.591 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3COc4ccccc4O3)C2)C1 1840182852 WNQGCMUYWYDKDT-MHECFPHRSA-N 490.557 0.046 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185377 PDWSBFGMJHYBLN-JOCHJYFZSA-N 482.965 0.792 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1841767936 DSHGQCSXMBSMRD-UHFFFAOYSA-N 459.352 0.878 50 20 JCGD O=C(c1cc(=O)c(OCc2ccccc2)c[nH]1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010626 MFTYQYOSCKWKCT-UHFFFAOYSA-N 487.321 0.765 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)COc3cc(C)ccc3C)c2)CC1 15886074 MTSCRYYTKLCNMT-UHFFFAOYSA-N 488.566 0.996 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])c(O)c1 28581031 FXSQLUACPUMYBK-UHFFFAOYSA-N 478.483 0.715 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc(-n2cnnc2)cc1 725877966 OBRIPPVCXWIIEQ-UHFFFAOYSA-N 484.538 0.682 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cnc[nH]1)c(=O)n2Cc1ccccc1 725880081 WONVZLCBQIYBAW-UHFFFAOYSA-N 464.486 0.248 50 20 JCGD O=C(CN1CCN(CC(=O)N2CCCc3ccccc32)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 731356280 YIQCPFNVEJQPHD-UHFFFAOYSA-N 480.525 0.953 50 20 JCGD CN(C)C(=O)CN1C(=O)C(=NNC(=O)CN2CCCC2=O)c2cc(Br)ccc21 750934372 DXZJAANAXHHXEN-UHFFFAOYSA-N 450.293 0.327 50 20 JCGD Cc1cc(/C=C(/C#N)C(=O)N2CCN(C(=O)C(=O)N3CCOCC3)CC2)c(C)n1C[C@H]1CCCO1 798119094 ODOZUTLGMNFOTN-PHCAOYFPSA-N 483.569 0.721 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CCc2nc(O)c3cnn(C)c3n2)c2ccccc2c1=O 826808585 ZHKIJYLOFGLYFJ-UHFFFAOYSA-N 450.459 0.583 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@H]1CC(=O)N(C3CC3)C1)N(S(C)(=O)=O)CC2 886212482 XFCRJCADZXLWQW-WMLDXEAASA-N 494.570 0.111 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O 912848208 VOVHVAYXRURYKT-JOCHJYFZSA-N 484.538 0.443 50 20 JCGD O=C(CCCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)NNC(=O)[C@@H]1COc2ccccc2O1 915806213 JCTBWTIGCDKDQR-OALUTQOASA-N 484.465 0.132 50 20 JCGD C[C@@H](Sc1nncn1C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916306112 AUCGUIMLPQMOFU-CQSZACIVSA-N 482.588 0.097 50 20 JCGD COc1cc(CNC(=O)NNC(=O)COc2ccccc2C#N)ccc1OCC(=O)N(C)C 916641375 AJDWBEHGIMNDHA-UHFFFAOYSA-N 455.471 0.943 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN(C)c2ncnc3[nH]cnc23)c1 917901088 POIXWQALTIJTCW-UHFFFAOYSA-N 460.520 0.281 50 20 JCGD O=C(NNC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1)N[C@H]1CCS(=O)(=O)C1 919883434 CUVNMUHTSHTZTH-HNNXBMFYSA-N 452.514 0.619 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)c2ccccc2c1=O 920239656 AFAXHTLZCNQDHU-AWEZNQCLSA-N 464.548 0.565 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2c(c1)OCCO2 1778442973 KDRNRIXINKYNLH-RCZVLFRGSA-N 480.326 0.579 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1Cc2ccccc2O1 1778837721 YYBBPXNKWNXVLA-SGIRGMQISA-N 464.327 0.498 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3ncccc13)CCO2 1779030199 IXGBFLUNQQFNKS-XMMPIXPASA-N 460.494 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1noc3c1CCCC3)CCO2 1779030290 NSDNVWQCBMXTII-JOCHJYFZSA-N 454.487 0.309 50 20 JCGD C[C@H](CC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)NC(=O)OC(C)(C)C 1779030330 OALKUTFCDUTONI-IQMFZBJNSA-N 490.561 0.432 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)N1CSCSC1 1779031594 BULAPZQDSMMQEF-JLTOFOAXSA-N 480.616 0.172 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372545 LILIUDPPWFOUBZ-OMXJDXKCSA-N 482.545 0.103 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)Cc3cc[nH]n3)CCO2)C1)NC(=O)NCc1ccccc1 1780968500 LVRUCNDFLFXFDW-HSZRJFAPSA-N 469.546 0.128 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c(OC)c1F 1781950868 FDNLZCAJOVSGQV-JOCHJYFZSA-N 484.500 0.799 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1782158215 YMMOTKACSKQWEI-ZVVFGRKBSA-N 478.590 0.629 50 20 JCGD O=C1C[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)CN1 1783022318 KABDWNFYTFHHDR-XGHQBKJUSA-N 464.360 0.959 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1783934797 MWGCMSRMRKZSEM-HSZRJFAPSA-N 469.546 0.392 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)[C@H]2C1 1784195006 NBROMTCJDAVYIB-JCECYMMASA-N 489.997 0.856 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785348916 VANUBMHUKQMUCF-KSFYIVLOSA-N 469.583 0.493 50 20 JCGD Cc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)cn1 1785835239 PADAYWNFDQXONK-BVSLBCMMSA-N 495.584 0.725 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(O)n3)[C@H]2C1 1786044436 ROGCXNGYECVWHP-SAVYNJCVSA-N 454.487 0.515 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])C[C@@H]21)c1ccc(B(O)O)cc1 1786981839 BKYWTKKNXXKWLD-LDLMYSLFSA-N 479.298 0.581 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c[nH]c4ccccc34)C[C@@H]21)c1cccc(B(O)O)c1 1786984905 XDLHYLYMFKLRHJ-HYVJGQCMSA-N 461.327 0.684 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc(C)c1O 1786986590 NDMYQCKENWPGRF-YYWHXJBOSA-N 452.316 0.596 50 20 JCGD Cn1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1C(F)(F)F 1787642202 RPLZAHHYCDAGOU-CQDKDKBSSA-N 495.462 0.345 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)CN3CCOCC3)CCC2)cc1 1789522910 WPYXEGFKEGIWNB-UHFFFAOYSA-N 452.515 0.765 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1789654385 CKAREHMZBNOGQT-HXUWFJFHSA-N 453.304 0.265 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)[C@@H]2C1 1791027008 WQLNICPAXJIHOH-LSLQXUBYSA-N 471.982 0.679 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1791238634 ORJCNEJJVXVIJW-OYSTVDSJSA-N 464.563 0.095 50 20 JCGD COc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1 1791292514 WFHSDYPYEUAYOE-FNHZYXHNSA-N 450.511 0.801 50 20 JCGD CC(C)(C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccccn1 1791485759 JIDKKMNDWRFNQC-IHPCNDPISA-N 451.332 0.333 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCN(C)C3)C2 1792872310 YWOLYUBOVPNWES-ZXFNITATSA-N 468.396 0.953 50 20 JCGD COc1ccc(Cn2cc(CC(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)cn2)cc1 1792974764 BRKREVCKXYIACZ-BAYUQKDNSA-N 476.961 0.672 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCCNC(=O)OC(C)(C)C 1793637628 HVXDCJHTCZBBAO-UPHUGPLXSA-N 483.610 0.644 50 20 JCGD 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1778165962 HRETZMZNWIAHJA-VLIAUNLRSA-N 465.348 0.953 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1778780272 IWTQFGJNWCMLFC-YRVVQQKDSA-N 492.957 0.013 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)C#Cc3ccc(Cl)cc3)CCO2)C1 1779028281 BLLWLMNNFHJYLU-QHCPKHFHSA-N 467.913 0.834 50 20 JCGD Cn1cnc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1C(F)(F)F 1779030164 HIZCAAQBOVMMAE-IBGZPJMESA-N 481.435 0.195 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779037328 WFCXWKNVZQINSI-JOCHJYFZSA-N 486.460 0.798 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779310114 HYCBYLLVXFKSHY-QYWGDWMGSA-N 490.985 0.100 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374982 JHOBFEDYMDGNFX-LSRZYVKLSA-N 482.541 0.675 50 20 JCGD CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)nn1C 1779909662 BSMLDEDHNOKIGJ-AUSIDOKSSA-N 469.546 0.422 50 20 JCGD CSc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1O 1780151714 XYVBILMXDZFLQD-QFIPXVFZSA-N 456.329 0.551 50 20 JCGD Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c(O)n1 1780273586 XPRFECLDWXINEY-VWLOTQADSA-N 496.568 0.885 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2c(c1)C(=O)CC2 1781277906 WXHXDYQBOKLHPN-ZEQKJWHPSA-N 476.338 0.937 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCOCCOCCOCCOC)C2)C1 1781384076 YKJSAEXOPQFYEL-WIYYLYMNSA-N 464.987 0.920 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3ccccc3n1)C2 1782211948 HTOSDBUIVMXPCY-WZONZLPQSA-N 456.547 0.835 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(-n3cccn3)nc1)C2 1782212359 XDZHBQBPYSKMKX-NTKDMRAZSA-N 483.573 0.768 50 20 JCGD O=C(CCc1cnc2[nH]ccc2c1)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1783680018 OIGBJQJNTXTLPH-DEOSSOPVSA-N 462.315 0.319 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1 1783681335 ULVICESZBQPZOT-LJQANCHMSA-N 481.384 0.298 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)CCO2 1783875311 LPMQNSQWGJEINF-BXTJHSDWSA-N 463.959 0.610 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)CCO2 1783881570 SAQOURXOLCYMDV-KQDGPHEJSA-N 475.970 0.298 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1 1783884374 RPKGUHRUMJPKIJ-XFQAVAEZSA-N 457.955 0.987 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CCN4CCCC4)nc3)C[C@@H]21)[C@@H](O)CCl 1784090625 JLNVFVGPFOUPSH-VMXMFDLUSA-N 464.994 0.913 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CNC(=O)c3ccc(C)cc3)C2)C1 1785563484 DKKMFQGMBNQWKS-MJHSOURCSA-N 494.552 0.689 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785660671 RTSZDLXKOYVDSL-QFIPXVFZSA-N 450.511 0.580 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(OC(F)F)cn3)[C@H]2C1 1785745926 CWNWSCGQSOERTN-IWEFOYFVSA-N 490.467 0.589 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1786802184 ASJRUOMYBCZUQC-UHFFFAOYSA-N 463.259 0.919 50 20 JCGD CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc(C)n1 1786983055 MASRLZXQGZXVIG-HSQYWUDLSA-N 451.332 0.539 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4n[nH]cc4c3)C[C@@H]21 1788610146 GKPSSJSYFBQRGR-DCPHZVHLSA-N 463.498 0.469 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCc3cccnc3)C[C@@H]21 1788611301 RXGVMIYMENVKPF-YYWHXJBOSA-N 466.542 0.696 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1 1789520957 BIPYJKYUWBVMHO-IBGZPJMESA-N 468.514 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)[C@@H](O)N3CCOCC3)CCC2)cc1 1789521160 OPRVNRUXMLEHTM-JOCHJYFZSA-N 468.514 0.083 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc2ccncc12 1790355784 DVZARUIGPVPTBL-TZYHBYERSA-N 459.311 0.822 50 20 JCGD CCOc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1OC 1791152588 UGXSJTCSVRCANN-PTLVVNQVSA-N 496.369 0.610 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)C[C@@H]21 1791292980 DLPJHCOJWUMPIX-VTIKRNQZSA-N 483.569 0.249 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c(Cl)c1OC 1792685975 MKSMEYRRCUDQKN-VTEUUUEMSA-N 482.965 0.933 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1C(=O)Cc2ccccc2C1=O 1793053211 SPWDJYLBDWGSGL-NTNQKNOYSA-N 492.370 0.975 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)CC2)CC1 1793111511 LSPIBEPHUWZZRN-NRDMVMEKSA-N 469.026 0.947 50 20 JCGD C=CCCc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c(O)n1 1795737311 RMAWAMUVUDEGOQ-UPHUGPLXSA-N 465.315 0.103 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2 1796395389 YKKMVTBHKDWBOL-NIFZNCRKSA-N 478.384 0.899 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Cl)ccc2c1OCO2 1796938083 DXYDMCXBUGNVFR-KSPBDQMDSA-N 487.900 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2scnc2c1 1797495747 YWDWVNNQUPYGHB-HBCWATKFSA-N 466.523 0.812 50 20 JCGD Cn1c(=O)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)nc2ccccc21 1799346753 ABMQZRPIZFVLHT-YHYOWMERSA-N 467.295 0.827 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1800769755 PYOAOJMKUXLYSW-IXXKSVCMSA-N 457.955 0.575 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1802040876 OOULRNKSLGXRHC-CSFFLVESSA-N 455.914 0.062 50 20 JCGD O=C(COc1ccc(O)cc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1802888162 OTFDXIDVKJMBMS-CYFREDJKSA-N 475.310 0.866 50 20 JCGD Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)s1 1807539741 ZDHAJISXLKVCPJ-HRAATJIYSA-N 459.576 0.863 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1 1807933832 ASRYRGISVTVAHY-OXJNMPFZSA-N 485.508 0.756 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1 1808668290 ODQXAKBXFGBLOD-GUIRCDHDSA-N 461.288 0.842 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809971367 UCYGWQBXNDOGGE-QGZVFWFLSA-N 451.336 0.502 50 20 JCGD COC(=O)CSCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810294267 JBQSUBHLGOCWKK-MGPUTAFESA-N 486.554 0.306 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810309573 SCANXAMOCNZOBE-VQIMIIECSA-N 482.541 0.989 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccn(C(F)F)n1 1810906800 IROAFPWGSADTBX-APWZRJJASA-N 469.257 0.986 50 20 JCGD Cc1cc(CC(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1C 1813069231 WGDQMKBNLAGZLI-MBSDFSHPSA-N 455.563 0.745 50 20 JCGD CN1CC(C(=O)NC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)[C@@H]2c2cccnc2)C1 1813608351 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0.925 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN2CCCC2)[C@H]1c1cccnc1 1802554974 CAIUETFDMQWBJR-LAUBAEHRSA-N 451.531 0.496 50 20 JCGD COC(=O)CSCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803576557 ADGKQMSXACRDOH-FOIQADDNSA-N 486.554 0.306 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc2n(n1)CCCO2 1809856383 BYAIYNDTCQIXMF-GCJKJVERSA-N 475.314 0.374 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1 1810134400 PCZUNQMYEFLBFK-OJSZTNNSSA-N 456.547 0.295 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303507 TZKHNUPTRPTQBV-WRWLIDTKSA-N 477.529 0.328 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1 1810488720 ZLOAJCYVBSEVJH-KRWDZBQOSA-N 456.334 0.894 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc2cccnn2n1 1811267334 OTZGRWDFUQBIIR-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD Cn1ccc(=O)cc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1811362881 AEAQIUBXIHSFMV-XMSQKQJNSA-N 460.299 0.094 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@@H]1c1cccnc1 1813071730 WBEGGQGXGZTRSH-VGOFRKELSA-N 482.541 0.940 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCc2cncnc2)[C@H]1c1cccnc1 1813071913 VZINIJFVJMODOA-XXBNENTESA-N 453.547 0.883 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1 1813320019 ZWESVWXKCPYVPZ-UZLBHIALSA-N 463.502 0.082 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1 1813487532 QSBLNOJIHMUURB-GSBCXDHFSA-N 451.531 0.964 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1814169851 JEOLIQZFMAZBRV-ICSRJNTNSA-N 467.331 0.670 50 20 JCGD CNc1nsnc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1814432859 GRBRRNVSLACRLN-CYBMUJFWSA-N 470.519 0.921 50 20 JCGD C[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1 1815333909 YUHVFMLJQYTYBA-YUMQZZPRSA-N 466.321 0.883 50 20 JCGD O=C1CCc2ccc(C(=O)N[C@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)nc2N1 1815341267 VKJFITXCAPUDBY-HNNXBMFYSA-N 491.338 0.642 50 20 JCGD Cn1cc(CCC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1 1815354868 WALIXXLCFWVIKU-MRXNPFEDSA-N 453.333 0.415 50 20 JCGD O=C(/C=C/C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)NCc1ccco1 1817472156 LQHIJYCRPFNKBZ-CFGKVWFZSA-N 491.313 0.861 50 20 JCGD Cn1cc(CCC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1 1817510083 MFDIXHPDNHEZLL-LJQANCHMSA-N 450.308 0.762 50 20 JCGD CC(C)n1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1 1818293418 YMKBWRICFCWFST-KRWDZBQOSA-N 451.296 0.882 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnncc2C(=O)O)[nH]n1 1822414377 CRKBHWRWCMBWGQ-OAHLLOKOSA-N 458.479 0.577 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(CCO)CCO)sc2C1 1825318680 AQFWGZVVFDVVAX-NWDGAFQWSA-N 463.398 0.373 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830369891 DLQXGKKNHFPNCQ-UTKZUKDTSA-N 469.970 0.178 50 20 JCGD CC(C)n1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1 1830538436 FTMQZHIXLHIEFT-KDOFPFPSSA-N 458.357 0.960 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725652 LNQYDCWLXXSTNL-IIBYNOLFSA-N 467.906 0.041 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830734977 BPDIHJKOLVSNBI-KFUYTQMUSA-N 469.872 0.928 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CCN1C(=O)OC(C)(C)C 1830738978 WQARMSBSVKZKOC-FSTVOOFJSA-N 489.997 0.688 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)C(C)(C)C 1831086297 POEHSXQMYIZRLP-QFBILLFUSA-N 462.385 0.779 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nc3ncccn3n2)CC1 1831873514 VYNPEAHGLRMHQW-QGZVFWFLSA-N 456.551 0.731 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832800315 OCMKTKRYOOHZLV-BLLLJJGKSA-N 460.285 0.031 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832880178 AONHTRCRUMALIH-QRWLVFNGSA-N 485.379 0.765 50 20 JCGD CC1CCN(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1833405229 DLKZWJQRYWJJOK-UHFFFAOYSA-N 470.423 0.284 50 20 JCGD Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cs1 1834797459 KZQFNLWAAUICFG-UHFFFAOYSA-N 470.404 0.559 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800048 NRBJLCSGAVPCDA-MRXNPFEDSA-N 485.419 0.509 50 20 JCGD Cc1ncc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1835258252 ZCFOEVWRDLFLKE-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccccc3)C2)C1 1835933660 FWZNTNQZRRPNGL-FBLLAGFSSA-N 464.327 0.240 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccn3)CCO2)C1 1836187817 ZEOCORWTDMNNBN-NWJFTTBMSA-N 468.514 0.215 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@@H]1SC(=N)NC1=O 1836718086 RQOPMYYADRUGMR-GLQYFDAESA-N 460.984 0.387 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838076544 LULBAIRENCODFL-LRDDRELGSA-N 454.833 0.109 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2)C1 1839145030 RCXDOCLDXIBXPO-MRUHUIDDSA-N 477.986 1.000 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(O)nc3O)C2)C1 1839964413 QTMYGYFLEWCELN-PXAZEXFGSA-N 459.297 0.131 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccccc1)CCO2 1840121245 LPEQWUNSSGPWHJ-SKPFHBQLSA-N 458.559 0.620 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C2)C1 1840149893 ALZOVAFABOBQDG-LQBOVUBWSA-N 465.934 0.890 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1840153957 GNMSTKNLILWSIK-DLRJPAPCSA-N 457.955 0.098 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1 1840154992 MDIWRMQEOCWNTR-IERDGZPVSA-N 451.907 0.505 50 20 JCGD Cc1cc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840777290 PPZDETDWKGAGNF-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012481 SAYJILBIHDDQNC-IBGZPJMESA-N 473.379 0.980 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CCCC23CN(C(=O)[C@H](F)Br)C3)N1 1845874295 QGIJUTPEQWRLJE-LOWVWBTDSA-N 477.356 0.060 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)C1 1848093607 SWSIJWNODGHNHX-PDWMJMLSSA-N 484.557 0.970 50 20 JCGD Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccccc1OCc1ccc(F)cc1)c(=O)n2C 15878286 XOHICLGDXGNGQR-UHFFFAOYSA-N 480.456 0.613 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN(C)C1=NS(=O)(=O)c2ccccc21 18021865 GODPYDIQYRFRTA-UHFFFAOYSA-N 494.913 0.734 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1)n2C 27144224 JCCCKDJVXHAHCN-CQSZACIVSA-N 499.615 0.119 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cc(S(C)(=O)=O)c2)c2ccccc2c1=O 109040231 LRDSMTLJNQOFBO-UHFFFAOYSA-N 459.440 0.803 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)CC2)cn1C 726199681 GBPKTBJTUXMXNT-UHFFFAOYSA-N 497.961 0.787 50 20 JCGD Cc1c(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)c3ccc4c(c3)NC(=O)CO4)CC2)cc(C#N)n1C 731352833 FCKPXFNEHCBGES-MFOYZWKCSA-N 494.533 0.976 50 20 JCGD CCN1CCC[C@H]1CNC(=S)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 884003593 AUZNGWCAWGXHMV-INIZCTEOSA-N 455.606 0.301 50 20 JCGD Cn1cc(S(=O)(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)cc1C(N)=O 912979266 AEBLIBTURUTITA-UHFFFAOYSA-N 480.510 0.449 50 20 JCGD COc1cc(C(=O)NNC(=O)Cc2cc(F)c(OC)c(S(N)(=O)=O)c2)cc(OC)c1OC 915594062 BIKJQKPKFZYXNX-UHFFFAOYSA-N 471.463 0.511 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NC1CCC2(CC1)OCCO2 916412437 DZHBJMNWNLJOQS-UHFFFAOYSA-N 496.586 0.656 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@H]1CCN2CCCC[C@H]12 916638403 FXAIXBNEQFIYCR-ZWKOTPCHSA-N 451.549 0.278 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)COc3ccccc3F)CC2)cc1 916720080 MTSOLIGKLGNHLH-UHFFFAOYSA-N 464.519 0.667 50 20 JCGD 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CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1c[nH]c3nccc-3c1Cl)CCO2 1783935752 YQUNUFNYISOSFF-NRFANRHFSA-N 462.938 0.984 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CNC(=O)OC(C)(C)C)CCO2 1783940127 RMWWYRRYKFACGF-HSZRJFAPSA-N 483.610 0.740 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)c3ccccn3)[C@H]2C1 1786871776 UIAGYWWHYRTPAQ-AQKJHKAUSA-N 467.530 0.195 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCCC3(F)F)C[C@@H]21)c1ccc(B(O)O)cc1 1786980177 SAQULKKBODBTEE-KANFNMMFSA-N 450.291 0.785 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1 1786981990 VGDMKUJGJOUWIJ-BVSLBCMMSA-N 480.326 0.450 50 20 JCGD CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1Cl 1787132248 SSYXWPHDBMCLNU-QRTARXTBSA-N 460.727 0.212 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3NC(=O)C4)C[C@@H]21 1788610059 ZPZRPWYLFQLLOA-JVPBZIDWSA-N 478.509 0.087 50 20 JCGD CO[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)c1ccccc1 1788610601 KDHZCZHMUSEFGK-LRGNLBRXSA-N 467.526 0.666 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(C#N)c1 1789839579 JBEQNODFBRITHF-TZYHBYERSA-N 477.326 0.083 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCOCC4)cn3)C[C@@H]21 1791252241 FVGPUTKPSCTKEN-BOLBYERCSA-N 466.966 0.765 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C1)C(=O)NC[C@H]2C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793117484 ONKZVFMGMCCDDY-IAUVJCGVSA-N 499.008 0.598 50 20 JCGD C#CCO[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878369 YEUCNXXBROSYTH-KSWRQPAISA-N 457.955 0.746 50 20 JCGD O=C1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)Cc2ccccc2)C3)N1 1795391750 XSPOFKXZQIHBNY-FSNPWBFUSA-N 464.360 0.861 50 20 JCGD COc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1NC(C)=O 1796191930 QYTQATZQMKTMHX-ACDBMABISA-N 465.315 0.899 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccccc1)C2 1796440917 DUGBMMLJIRJQPD-OVZJUGGFSA-N 453.499 0.789 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)N1CSCSC1)C2 1796442128 RXTVCZSLSCYRFS-GLPAEGGISA-N 494.643 0.753 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)COC3)C2 1797750515 DMZOFTKJCRFERY-XEMDLRDOSA-N 451.483 0.232 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1sc3nccnc3c1N)C2 1798439136 GYCTZLJZNJPVIB-ZSBIGDGJSA-N 466.527 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2 1798442168 ZXSGDTMWRBABBO-SIRPWMCASA-N 454.531 0.338 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(C)c1 1799024201 URAOEGWOSVCFSP-YVWYUNDQSA-N 453.499 0.519 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)CCOC1 1799334576 XHQGPJRTOHWHET-IMDDZUEWSA-N 494.358 0.950 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nc2ccc(F)cn2n1 1801188534 CJWFCNCOADGWRN-BTTYYORXSA-N 452.450 0.433 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1 1804046542 AYSSLNUENKAOQD-CJNGLKHVSA-N 491.442 0.816 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1804197580 HXNBYZLQHPVNGN-AOIWGVFYSA-N 472.995 0.072 50 20 JCGD Cc1[nH]nc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1F 1805116242 GALDFPHTJQTYIT-KUHUBIRLSA-N 466.477 0.884 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)C1 1805505362 FWIBALHTPSZSSU-RBUKOAKNSA-N 456.348 0.801 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C=CCN2)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807454685 WITNETYWIOOSDM-FIXSFTCYSA-N 491.596 0.962 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1807996647 XZBPGMOYIOYZML-XOBRGWDASA-N 477.481 0.520 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1 1809329824 LUFYEKDQMIJSKT-JXFKEZNVSA-N 485.508 0.756 50 20 JCGD CC(C)(C)[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810293230 AZHCXTIDEAWLBR-KFKAGJAMSA-N 454.531 0.807 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810295653 UWYYXBICNLPPGC-PXNSSMCTSA-N 481.557 0.562 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cn2cccc([N+](=O)[O-])c2=O)[C@@H]1c1cccnc1 1812411154 QVJSMAKUQULKIM-VGSWGCGISA-N 499.528 0.231 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1 1813101519 QNZFKBKQKZEVQT-KBXCAEBGSA-N 472.468 0.139 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)CC2)c1ccc(B(O)O)cc1 1815343952 YSSQRGRCDREQJJ-UAGQMJEPSA-N 482.371 0.450 50 20 JCGD Cc1cc(C)n(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1 1815926482 UPCYMIYGGVSIFD-IBGZPJMESA-N 450.308 0.909 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2 1819796840 HMLSGBYFFZHXKB-MRVPVSSYSA-N 471.459 0.313 50 20 JCGD CC(=O)N/C(C)=C/C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1821632706 NEZYODSPXFNMAR-KQPPXVQYSA-N 454.491 0.754 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCCS3(=O)=O)sc2C1 1824931510 HTVBWWCUKZWJEC-FAUFNCHLSA-N 492.583 0.766 50 20 JCGD C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNCP(=O)(O)O)CC2 1825641381 HEQBCAUFVHPINO-YUMQZZPRSA-N 455.271 0.563 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2ncccn2)CC1 1828923265 AYWBABFODPQTRO-IBGZPJMESA-N 451.531 0.951 50 20 JCGD O=C(c1cc(O)n[nH]1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828995966 VNIAQRSDLUQMEW-VGOFRKELSA-N 491.932 0.781 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1830543667 XRNNNOXNZFDBJT-MEBBXXQBSA-N 484.273 0.925 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1 1833033214 SWZAVLZIDIOUHU-AUUYWEPGSA-N 459.952 0.188 50 20 JCGD O=C1CSc2ncc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)cc2N1 1833312601 ZFIMMNKDTRFUDB-KRWDZBQOSA-N 482.006 0.911 50 20 JCGD CCCNC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833424636 MMXIJSOPFFUZGJ-UHFFFAOYSA-N 487.605 0.177 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc[nH]3)CCO2)C1 1833712488 LMBOGCJYLNDIQP-XOBRGWDASA-N 471.942 0.612 50 20 JCGD COc1ncc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1F 1833966439 LFFAFWRLDWJYIB-UHFFFAOYSA-N 484.337 0.408 50 20 JCGD Cc1cccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834147864 MJKRIRCYUXURQG-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)/C=C/c3ccco3)CC2)CC1)c1ccc(B(O)O)cc1 1834797388 IBNDGQIMWNVHJG-BQYQJAHWSA-N 451.332 0.858 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1nccc2nc[nH]c12 1835027761 ZXEWTZRIIUABHT-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)c1 1835030433 RMJPPXFLOOFZGS-QTPRHWQCSA-N 497.552 0.828 50 20 JCGD O=C1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)N1 1835312272 VIEUPAHTPYINOU-JBYIUTFZSA-N 494.386 0.728 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCN3CCCCC3)CC2)CC1 1835736731 GACWVTFBMPXAKL-UHFFFAOYSA-N 485.633 0.746 50 20 JCGD C[C@@H]1CC[C@H](C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)O1 1835738195 XHFNPRHRGKXONX-FOIQADDNSA-N 458.563 0.438 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)ccc2c1OCCO2 1836460971 PJMHGOIGRBKONU-IERDGZPVSA-N 454.907 0.436 50 20 JCGD N#Cc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1Cl 1837460280 ZBSFGKZWUFYERA-QHCPKHFHSA-N 498.927 0.594 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)o1 1837921245 PKFFAHOQMLGPJL-UHFFFAOYSA-N 483.330 0.844 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(-c3cccs3)on1)CCO2 1837985705 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COc1cc(F)ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187311 RWPBHNLGZYVKOD-JOCHJYFZSA-N 466.510 0.277 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843013223 WBVYFGVSLANMOT-MJGOQNOKSA-N 469.347 0.653 50 20 JCGD CN(C(=O)OC(C)(C)C)c1cc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)n(C)n1 1843463425 YXOJTJQUNJOQIA-UHFFFAOYSA-N 497.361 0.602 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2COC3(C2)CN(C(=O)OC(C)(C)C)C3)C1 1846121385 VZGCKJMWNIRHNK-QGZVFWFLSA-N 493.605 0.589 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1846561181 YIHTZCAETLBDFZ-LJQANCHMSA-N 498.496 0.808 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CCS(C)(=O)=O)C1 1846699668 RKOZMYFWJTUOLS-ZDUSSCGKSA-N 451.973 0.757 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN 1847959445 QUDQXKOAJCODJX-YESZJQIVSA-N 458.519 0.510 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C(=O)O)cc(C)c2C)cc1 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)nn3)CCO2)C1 1833829619 GRIHVXJHVIAHKE-BTYIYWSLSA-N 499.952 0.384 50 20 JCGD COc1ncc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cc1C 1835736830 JFPJZGXHFXOKEO-UHFFFAOYSA-N 495.584 0.896 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4cc(F)c(F)cc4[nH]3)C2)C1 1835930443 IOMFKPCCWJBKKQ-XMMPIXPASA-N 499.279 0.510 50 20 JCGD O=C1CCCc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)c3ccc(B(O)O)cc3)CCO4)ccc21 1835930539 LUSGUAYIOSWCEE-SANMLTNESA-N 492.337 0.269 50 20 JCGD O=C(CCCC(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933967 IJHYBESQKRYOHG-IBGZPJMESA-N 458.242 0.169 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CN3CCNC3=N)CC2)CC1 1836670286 DMEKAFWIGFFHAD-CQSZACIVSA-N 458.401 0.856 50 20 JCGD CC1CCN(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1836803019 ZCELYJQVHCVUQX-UHFFFAOYSA-N 471.407 0.711 50 20 JCGD Cc1ccn(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1837191404 FDQSBQKUYZRQDB-UHFFFAOYSA-N 454.336 0.184 50 20 JCGD Cc1ccc(F)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457094 XJDPSDOPGSTZST-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1 1837457611 LBCPMRQJGODQQM-SFHVURJKSA-N 459.425 0.098 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccccc4n3)C2)C1 1837458788 BYOUQSJSBUXLDF-XMMPIXPASA-N 491.508 0.012 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C)nc3C(F)(F)F)CCO2)C1 1837963181 QJOFWAJDJMNIJT-SUMWQHHRSA-N 468.860 0.763 50 20 JCGD Cc1n[nH]c(C)c1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838394134 VPUWDOUCDRVMLE-UHFFFAOYSA-N 469.546 0.951 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C(/C)C(=O)O)C2)C1 1838528435 XFKZKXZQMGQHPM-VKVQTHCXSA-N 491.453 0.621 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)c1 1839026149 IRRFWZQWVFWDBX-HSZRJFAPSA-N 462.547 0.447 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1[N+](=O)[O-] 1839190464 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CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1 1840184489 PXHSOXVSTWBDFS-JOCHJYFZSA-N 476.509 0.145 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185303 JVGPBMYNULFEMQ-QHCPKHFHSA-N 496.536 0.286 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185361 OPEQDHMYRQIURI-JOCHJYFZSA-N 493.517 0.052 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)CCO2 1840747074 HKXIOAJTJDMLBF-RUZDIDTESA-N 490.325 0.140 50 20 JCGD Cc1ncc(Br)cc1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1842187041 ZZXJKHXSEUWVSM-UHFFFAOYSA-N 458.121 0.963 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)C1 1847289973 DMDZZFOQMWBPPQ-PEKRRXIPSA-N 499.373 0.065 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccn(C)n1)c(=O)n2Cc1ccccc1 727369521 OSLAPVQDHOSLBE-UHFFFAOYSA-N 478.513 0.259 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1nc(-c2cccnc2)no1 728078837 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O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1c[nH]c2ccccc2c1=O 915189070 BBOWKAUNYZYYQI-UHFFFAOYSA-N 484.534 0.943 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc(S(N)(=O)=O)cc2)nc1 915884525 ALIWCWOAFAFZSV-UHFFFAOYSA-N 456.550 0.586 50 20 JCGD O=C(CN1CCN(CC(=O)N2CCc3ccccc32)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 917125838 WKFWJGZSERKMCN-UHFFFAOYSA-N 466.498 0.563 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCCc1nc(C)no1)c(=O)n2Cc1ccccc1 918015947 BSBJLLLJWNJRPJ-UHFFFAOYSA-N 494.512 0.290 50 20 JCGD O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1)N[C@@H]1CCS(=O)(=O)C1 919884506 GZRZSXSJFBBAEB-CYBMUJFWSA-N 488.494 0.897 50 20 JCGD CCOc1ccc(NC(=O)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 920343126 NYWHKNLKKXKSSI-UHFFFAOYSA-N 463.516 0.918 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncsc1Br)CCO2 1779030332 OBTJXFBMDOZHAB-GOSISDBHSA-N 495.359 0.661 50 20 JCGD CCOc1ccccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032316 IYZYXAYBGXIQQH-QHCPKHFHSA-N 453.499 0.841 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779033677 BMIYBEYQMDYTOG-MWTRTKDXSA-N 453.499 0.596 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779033679 BMIYBEYQMDYTOG-QMHKHESXSA-N 453.499 0.596 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc4ccoc4cn3)CCO2)C1 1779037011 LYKZZAWBCUGXCU-JOCHJYFZSA-N 450.455 0.584 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(OC)c1 1780534775 LYDXFEAMFMODMS-HSZRJFAPSA-N 454.288 0.141 50 20 JCGD C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2)N1CCN(C)CC1 1780642459 UTGBHIHKSIMJON-AXVVYFOYSA-N 459.429 0.920 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(N3CCN(C)CC3)CC2)C1 1780651877 SROVXALTHQORRM-DBXWQHBBSA-N 457.015 0.534 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)cc2N1 1781410917 CRHNEHCQNSZFSU-ATIYNZHBSA-N 491.353 0.692 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1781575282 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CSCC[C@H](C(=O)NNC(=O)CNC(=O)c1ccco1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 751204160 DYETYNBPLAGSJK-MGPQQGTHSA-N 450.517 0.454 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1 914109959 UBCBZBCTVZTTBT-KRWDZBQOSA-N 463.516 0.415 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cnc3nc(O)nc(O)c3c2)c1 916726336 KGXMYWZMDAUGGE-UHFFFAOYSA-N 460.472 0.541 50 20 JCGD O=C(COc1ccccc1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)NC[C@@H]1CCCO1 918217547 JQYNBTDLDISUNE-IBGZPJMESA-N 494.512 0.481 50 20 JCGD CCNS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c1 919413486 QGJAMENTGUVGLA-UHFFFAOYSA-N 483.474 0.759 50 20 JCGD CCn1nc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@@H]23)c2ccccc2c1=O 921301277 UQYSDNABUNXHLP-RLFYNMQTSA-N 458.544 0.903 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc[nH]c2nccc1-2 1777892040 IFVFUBJBCVOPTM-HYBUGGRVSA-N 462.315 0.636 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1778407359 CTIPMIWVNDSIQJ-QHCPKHFHSA-N 451.263 0.744 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)CS[C@H]3CCCCO3)C2)C1 1779084712 RYSYJTSMVJJLSM-GHTZIAJQSA-N 463.560 0.388 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cn[nH]c3cn2)C1 1779191325 VSVQSNLUHWNWNQ-AUSIDOKSSA-N 478.513 0.398 50 20 JCGD CCSc1cccnc1C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1780463935 FUMCVTIBQHPGKP-JOCHJYFZSA-N 470.555 0.949 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969665 PBWHDFSEZZHHOV-CPJSRVTESA-N 497.600 0.695 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969925 NTTWQYFGTLPIBN-SNYIIPAISA-N 474.606 0.536 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1[N+](=O)[O-] 1781306139 XIMSKCJMUVRABV-QHCPKHFHSA-N 482.497 0.588 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2[C@H]3C=CS[C@H]32)C1 1781529553 DWAKPBHEKWHIII-GOWNKEFISA-N 457.556 0.688 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)C1 1782024589 LGUVKJZHZLBMLA-DSDYNGPPSA-N 457.531 0.380 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783022363 IHHHEZPXIJTQND-WWMYMODYSA-N 481.391 0.415 50 20 JCGD CCOc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1OC 1783699406 RHBMXPAEIWCOIX-VWLOTQADSA-N 482.342 0.460 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)C1 1784080297 BZTYLBGDIPNHMK-XOEWHZDYSA-N 487.557 0.689 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C[C@@H]21)[C@@H](O)CCl 1784091201 LEOPNGMKAJKZPJ-STECZYCISA-N 453.879 0.723 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1784414744 YATWSKSOKUYXGM-AOMKIAJQSA-N 455.345 0.386 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1Cl 1785116288 DJVZRBWFJHKZJO-JOCHJYFZSA-N 458.707 0.786 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)[C@H]2C1 1785332668 RJWRHDMPILMEGJ-PDTFXZCISA-N 483.363 0.756 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)nn3)[C@H]2C1 1785844030 UEQGWPIOILQALD-SDADXPQNSA-N 483.953 0.908 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)c[nH]3)C[C@@H]21)c1cccc(B(O)O)c1 1786983382 QHAKQNKIXOICSO-OWQGQXMQSA-N 465.237 0.620 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3OCCO4)[C@H]2C1 1787941864 WKWQOXFMTNFEIJ-DCPHZVHLSA-N 481.509 0.363 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1789587156 ZYXUZJBMJGVPQG-NYVOZVTQSA-N 451.332 0.340 50 20 JCGD COc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)ccc(F)c1F 1790171933 HKRRONGYKOTGHK-FNHZYXHNSA-N 474.269 0.560 50 20 JCGD C[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)Oc1ccccc1 1790698299 XVCBXNPOVHZSCV-FUAMJQMHSA-N 466.343 0.817 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)CCOCC1 1792975258 OZKFRBDIYDRBGE-YYIAUSFCSA-N 489.997 0.497 50 20 JCGD CN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl 1793115447 ODVCROGAHXYUHL-BQJWPVKWSA-N 489.013 0.986 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1csc(C)n1 1794079519 GSJLXCNQTYBFQN-UYNJTKMTSA-N 458.544 0.718 50 20 JCGD O=C(Cc1ccccc1C(F)(F)F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1795231516 DWKWDDJVEMWISS-UPHUGPLXSA-N 476.260 0.831 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCC3CC3)c(F)c1)C2)c1ccc(B(O)O)cc1 1795736884 MTKCTDKEAVWERU-BBIADKPPSA-N 482.317 0.811 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)c3ccccc3o1)C2 1797748594 LDWIJXQGVQIYSS-GFENJXEQSA-N 477.477 0.309 50 20 JCGD Cc1ccc(C(=O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797754443 XTXJEGZVCXCLAQ-HGKCTWBKSA-N 451.483 0.080 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCc1nc(N)n[nH]1)NC(=O)NCc1ccccc1 1798309543 QEHFQKAEPBDOIR-BCDXTJNWSA-N 483.577 0.304 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1)N1C[C@H]2C[C@@H]2C1 1799097238 KZXNBVWLHMUWCE-NLAFLKBPSA-N 498.628 0.262 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-c2cc[nH]n2)cc1 1799697322 SJDXSGGYCYKJMN-UPHUGPLXSA-N 475.509 0.592 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cncn1)C2)[C@H](Br)Cc1ccccc1 1800434798 BKVRITSXWFIISK-SFNKJDCFSA-N 462.348 0.874 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cc(O)ccc3n1)C2 1801011176 LIUGXMJIFIFYFN-MFKICJERSA-N 455.515 0.517 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1)C2 1802334936 UNCAWMHXMJVFLP-BCDXTJNWSA-N 495.621 0.760 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cc2ncccn2)[C@@H]1c1cccnc1 1804692659 ODJDPUAJYLSTSF-IERDGZPVSA-N 460.498 0.432 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)CC1 1806702995 XREAOAUKFFMBLZ-INIZCTEOSA-N 450.001 0.202 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)C(=O)N(C)C)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1806944033 NQFCPDRSALCHTQ-IRLDBZIGSA-N 495.584 0.522 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C/N=C/c2ccco2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361789 UEWPCKXGIFYIHR-QPMQWSBHSA-N 460.299 0.793 50 20 JCGD Cc1nc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c(=O)[nH]c1C 1807362581 LFLOUKCCHASNIT-GHTZIAJQSA-N 475.314 0.095 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363898 RBLJZMOECQIDBL-UWJYYQICSA-N 479.277 0.491 50 20 JCGD C[C@H](NC=O)C(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1807453067 NBCNGSSNOFELDW-AVCGJXAMSA-N 495.584 0.568 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnn3ncccc23)[C@H]1c1cccnc1 1808174307 YMIXIBGLDSCSPT-HRAATJIYSA-N 485.508 0.756 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C2=NNC(=O)C2)[C@H]1c1cccnc1 1810221345 ATJCSMQZYYKMGB-KIKGRTIKSA-N 464.486 0.097 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C(=O)c2ccco2)[C@@H]1c1cccnc1 1810295440 STQZFQABPUXUNY-HNAYVOBHSA-N 462.466 0.876 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCc2ncc[nH]2)[C@@H]1c1cccnc1 1810304639 FNBSZKKMOXUXJC-IIBYNOLFSA-N 462.514 0.756 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810309096 OZOGJCAGXVNJLL-OXQOHEQNSA-N 475.509 0.621 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccccc2C(N)=O)[C@H]1c1cccnc1 1813072307 FCCGSKHBVHCWBJ-VGSWGCGISA-N 466.542 0.873 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCSCC2)n[nH]1 1814416832 HRCYJUKAZVBQFP-MRXNPFEDSA-N 451.597 0.824 50 20 JCGD Cc1nnc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)s1 1817571928 YGQMEBSLNRNSKM-INIZCTEOSA-N 454.321 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc(O)n3c1CCCC3)CC2 1819797735 IJFIQYGEGGQTRK-LLVKDONJSA-N 496.553 0.920 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2 1823015064 JMGJYAFTYWHGLV-DRZSPHRISA-N 476.983 0.931 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc(CO)c(F)c1 1827905480 KSYVZVDBJQHDQK-MRXNPFEDSA-N 469.303 0.994 50 20 JCGD C[C@H](CN)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc2ccccc2)C1 1828550792 AZAUGISFNLZLSW-CDMIOBSGSA-N 466.966 0.633 50 20 JCGD CC(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCN2C(=O)OCc1ccccc1 1829000330 GTTXOMGKDAYAKZ-RUZDIDTESA-N 493.325 0.021 50 20 JCGD COCCn1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1 1830538643 LTYIRQUWRQLTJT-BEFAXECRSA-N 473.368 0.631 50 20 JCGD CC#C[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(O)cc1 1830738324 NPBWHBYCTXKLSZ-GREBRCKQSA-N 464.946 0.945 50 20 JCGD CC(C)[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1830840655 BFCNDGLOTKQQTF-JYFHCDHNSA-N 480.370 0.876 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CN3CC(=O)NC3=O)CC2)CC1 1833265503 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COc1nccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793723 RSUOROUIGDZQCS-SNVBAGLBSA-N 468.499 0.480 50 20 JCGD Cc1cc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)no1 1819933083 LGQBNOMYHRFKMR-LBPRGKRZSA-N 477.547 0.155 50 20 JCGD C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCS(=O)(=O)CC1)CC2 1820160573 PPKSZLIWISZUIA-ZDUSSCGKSA-N 474.681 0.637 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1CCc2nc[nH]c2C1 1822686334 BIYSEGQZJGRZAW-MGPUTAFESA-N 462.319 0.924 50 20 JCGD CCCNC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1824403663 SVNSUDOUALNOIE-NRFANRHFSA-N 457.380 0.906 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](F)Cl)CC2)n(C)c1=O 1825105625 WBDPCNWLHRRDER-PBHICJAKSA-N 482.944 0.588 50 20 JCGD COc1cc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)nn1C 1828924103 IXQSVQFXEPMPGF-IBGZPJMESA-N 469.546 0.974 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cc1 1830213449 IKVNXEFDFTWXGA-UYAOXDASSA-N 471.348 0.970 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1830535240 KDPOYQMWGQZDLT-FOIQADDNSA-N 483.363 0.299 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830738029 KHDXJPOSOPTIQJ-QRWLVFNGSA-N 463.959 0.347 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)C(C)(C)C 1831095738 LHSDNNBJNURRAG-LBTNJELSSA-N 466.348 0.684 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCC(N3CCC(NC(=O)C(C)(C)CCl)CC3)CC2)CC1 1833214532 FYYIIYGNYQVNIS-UHFFFAOYSA-N 470.058 0.987 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccnc(F)c3)CC2)CC1)c1cccc(B(O)O)c1 1834800039 QZKGIDCRRUXFIJ-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CSc3ncccn3)CC2)CC1 1834865543 PMKXODHDVLOKHI-UHFFFAOYSA-N 477.635 0.513 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Cl)CC2)CC1 1835084060 JALQQOGDMBRNNF-SUMWQHHRSA-N 454.934 0.701 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(F)c(F)c1)CCO2 1835142710 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C=C(CC(=O)OCC)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839175696 ZIVLAMTVJFAHRR-PBHICJAKSA-N 451.289 0.643 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202760 OWFHNDMRZOYYCV-PXNSSMCTSA-N 485.354 0.530 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1839209847 SXKKNJKPUFPATC-ZHRRBRCNSA-N 492.013 0.984 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)c(OC)c3O)CCO2)C1 1839377580 JNXLEWBIJAKTEB-YCRPNKLZSA-N 472.922 0.733 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1OC 1839399523 CCRYXDGDGWRWDO-DEOSSOPVSA-N 492.573 0.455 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840108186 BZCJQPOQELZZPS-HYFFOGBASA-N 489.997 0.736 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CSCC(=O)O)CCO2)C1 1840190419 WPSZQJLIZXCMPF-MLGOLLRUSA-N 453.355 0.292 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012324 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CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1844701917 MKXBZNYGHPLULT-UHFFFAOYSA-N 452.276 0.471 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)COCCNC(=O)OC(C)(C)C)C2 1846385556 UDHUKIKVYJHYTL-UHFFFAOYSA-N 455.556 0.104 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCn2cnc3sccc3c2=O)ccc1Cl 10414928 IEQQUOJBUZOIBH-UHFFFAOYSA-N 455.905 0.610 50 20 JCGD COc1cc(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc(OC)c1OC 104535195 RCTFWTQXARVNDE-GOSISDBHSA-N 460.439 0.786 50 20 JCGD COc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1S(=O)(=O)NC(C)C 728847524 IRYMSRGEDBARTN-UHFFFAOYSA-N 476.559 0.850 50 20 JCGD Cc1ccc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1S(=O)(=O)NCC#N 731188112 XQWGIOWQYFGNPG-UHFFFAOYSA-N 463.541 0.995 50 20 JCGD CS(=O)(=O)c1ccc(NCCNC(=O)NNC(=O)[C@H]2Cc3ccccc3O2)c([N+](=O)[O-])c1 748328970 HEMFGDYAGYMJDU-QGZVFWFLSA-N 463.472 0.744 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(-c4ccccc4)[nH]n3)c2)CCN1 906478749 WYTMKQKZAGQKLW-UHFFFAOYSA-N 468.495 0.272 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCO2 915356293 KJEXFQGCHJBJFQ-INIZCTEOSA-N 477.495 0.906 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCOCC(F)(F)F 916326134 AYUZNJAHYUNEJM-UHFFFAOYSA-N 482.481 0.549 50 20 JCGD COCCOc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 919678224 WMLXFXPFQONPIM-UHFFFAOYSA-N 463.512 0.808 50 20 JCGD N#Cc1ccc(NCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 920807336 GCQVTVONXGTYDQ-UHFFFAOYSA-N 471.539 0.771 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)NCC1CC1 920859658 YQOIJRXXFIEYKF-HMWXGYMHSA-N 458.562 0.120 50 20 JCGD O=C1CCCc2cc(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)ccc21 1777925601 QEJOWBNLUFLPEX-VWLOTQADSA-N 462.311 0.643 50 20 JCGD C[C@H](Nc1nccs1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1778069888 JKQUWIDWQNTLPX-QXATTWAWSA-N 472.376 0.451 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccn4cncc4c3)C2)C1 1778654406 BGPXTZADJWDGQT-LRULAXNGSA-N 463.498 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3cccc4ncccc34)CCO2)C1 1779028468 FMTFTJDRGTUFLX-RUZDIDTESA-N 474.521 0.920 50 20 JCGD CC(C)O[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779174652 AQOBBYLEVKHHLF-YADARESESA-N 475.590 0.976 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccncc3O)C2)C1)NC(=O)NCc1ccccc1 1779411171 PITBOVLVIOWKMA-DEOSSOPVSA-N 482.541 0.577 50 20 JCGD CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CC[C@@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)C[C@H]1CO2 1781060550 HHXFFHNDHWGKPK-YJPXFSGGSA-N 473.954 0.194 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1781444471 TUJYZUGSXACKFN-QFIPXVFZSA-N 461.519 0.681 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/O[C@@H]1CCCCO1)C2 1782214168 GYIPJHWVIKCLKJ-UKHSJILJSA-N 467.567 0.402 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1 1783539739 NERLQDMNOCNDPB-QAPCUYQASA-N 451.358 0.669 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1783873025 ILGFESSBWFYDQM-TUXXCZFBSA-N 454.911 0.076 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C[C@H]1COc3ccccc3O1)CCO2 1783933139 CNXLNBBMKZXNCY-SBUREZEXSA-N 460.531 0.419 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(Cl)nc3n[nH]cc13)CCO2 1783933596 AUNOSTNCBMYMRZ-FQEVSTJZSA-N 463.926 0.428 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@]1(C)CCN(C(=O)OC(C)(C)C)C1)CCO2 1783935111 NYCPYSNJZIWURA-RPWUZVMVSA-N 495.621 0.836 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783940144 SAIKPLSGYDCUPE-KSFYIVLOSA-N 469.583 0.493 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc(Br)nn4c3)C[C@@H]21)[C@@H](O)CCl 1784090313 YJKSVUOVXAUGJA-XUXIUFHCSA-N 486.754 0.685 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1784160695 LNCOAINAVBNMFB-QHCPKHFHSA-N 460.531 0.219 50 20 JCGD COc1ccccc1OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982107 MNMCHOQDKDJNJV-JLMWRMLUSA-N 468.315 0.047 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508131 HQKBNEWAKAZAEF-UKZVOZDVSA-N 465.576 0.214 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C#N)c[nH]3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726663 KUXIAZGCNSMJKO-ONTIZHBOSA-N 493.568 0.826 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1n[nH]c2cccc(F)c12 1790483141 KMCKYCJIWRSBLD-QOKNQOGYSA-N 466.278 0.289 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc(C)c1O 1791935029 XFRAZPLHARQAKH-YYWHXJBOSA-N 452.316 0.596 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2 1792886543 DIQDWGJTRAMDJI-ZRKYPZEGSA-N 468.378 0.698 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792979057 SARMYAHHHYZPDS-PFFSRIRZSA-N 491.969 0.022 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(C)(C)NC(=O)OC(C)(C)C 1793013948 VHCYLVLCTUWKHL-CWPLJXCYSA-N 483.610 0.642 50 20 JCGD CN[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C(=O)O 1794142814 UDQBBESJHOBNCK-KHMAMNHCSA-N 460.959 0.819 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cccnc3)[nH]n1)C2 1796441703 SPUAYKNMISHVAO-FKWFMORESA-N 490.524 0.809 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](N)Cc1cscn1)C2 1796892281 VGTDNEWQEOSFMM-JLOQOIBHSA-N 457.560 0.785 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=N/N1CCCCC1 1797742080 CUBKKMRWEVFXCL-SZBYLIOGSA-N 457.535 0.182 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(F)c1)C2 1797750927 XNZCDHJLFRVWMW-VTEUUUEMSA-N 459.453 0.409 50 20 JCGD COc1c(Cl)cccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754290 PYNFESYOCVCLIQ-IVWMJMPLSA-N 473.917 0.864 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2 1800839887 RZDVYFUSBMTWHF-HIRMHNASSA-N 455.379 0.882 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C)C2 1800980854 GMCKKJKVZYZXGI-LBKYZSNHSA-N 473.954 0.756 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1cnc[nH]1)NC(=O)NCc1ccccc1 1801242166 LVKXXEXTPGARCS-XKDQFEMLSA-N 481.557 0.359 50 20 JCGD COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1csc3c1c(=O)n(C)c(=O)n3C)C2 1802282694 HHOMOYWHXZYSTQ-LXTVHRRPSA-N 482.990 0.733 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cncn2-c2ccncc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361126 FESAJFKCNJLVPD-HYBUGGRVSA-N 496.336 0.976 50 20 JCGD Cc1nc(N)sc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807371199 QYQMFMCOHPMUDM-WMZOPIPTSA-N 465.344 0.742 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373237 PSKGBYKXQKOZAJ-PGRDOPGGSA-N 459.315 0.538 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CN2CCCC2=O)[C@@H]1c1cccnc1 1808413517 BQVHKCLIQBJZQR-XODNQNILSA-N 479.541 0.844 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1 1815336037 XQFKLEMLXKKKOS-INIZCTEOSA-N 499.379 0.766 50 20 JCGD Cc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(=O)[nH]c1C 1817471068 QOJIHIBRXQWYNO-QGZVFWFLSA-N 464.291 0.409 50 20 JCGD O=C(COc1cccnn1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822752794 RAUMAPLXNWJWLA-KRWDZBQOSA-N 450.264 0.264 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1 1823001694 JHNOYZBTUNTECR-RNCFNFMXSA-N 483.385 0.476 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc[nH]c1[N+](=O)[O-])CC2 1826085983 JNXBWUJQDVAJEQ-SECBINFHSA-N 450.481 0.373 50 20 JCGD N=C1NCCN1CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1828983991 XMHUGPNQFLIDFK-AVRDEDQJSA-N 494.955 0.813 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2C[C@H](O)CN2)CC1 1830199423 AQJFWRBJQPUGRP-IOOZRYRCSA-N 458.563 0.463 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1830539257 FVQRJAXSDYGIKP-LRTDBIEQSA-N 494.342 0.922 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CSCC(=O)O)C2)C1 1830544514 ZYRAJMMQWNZHAJ-LRDDRELGSA-N 453.355 0.292 50 20 JCGD O=C(c1ccc(N2CCOCC2)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830727988 MLOHDCXZWVNSLV-SIKLNZKXSA-N 467.950 0.193 50 20 JCGD O=C(c1n[nH]c2cc(Cl)ccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732468 YZDULOLBXIFLEI-BEFAXECRSA-N 457.314 0.886 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2NC1=O 1830732877 WYCKQCLNWLOGQZ-PCMMCCAGSA-N 467.906 0.076 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832549575 NIUMUYHWJKJNBR-CKFHNAJUSA-N 484.377 0.175 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccccn3)CCO2)C1 1833186132 WIFORXWZEHZFLM-BYEYKRMRSA-N 482.541 0.605 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc(O)nc(Cl)c1 1833992143 HSEJUKCHXQWSSN-UHFFFAOYSA-N 486.765 0.619 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1834818871 FOFUIFIXPSQVEE-RBZFPXEDSA-N 499.362 0.234 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834824757 LRWLDXUISKGXTL-KDOFPFPSSA-N 480.356 0.071 50 20 JCGD CC(=O)Nc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)ccn1 1835263774 NDNUKJIUTAJKPQ-UHFFFAOYSA-N 487.605 0.598 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccnc4ccccc34)C2)C1 1835928255 HFROAUDGGIMNQK-RUZDIDTESA-N 475.310 0.298 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1835930261 FVWKLNDSDVJXFM-HSZRJFAPSA-N 498.732 0.051 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4)CCC3)C2)C1 1835939687 DVFCADTVJINWPG-VWLOTQADSA-N 478.354 0.558 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1 1837458988 GZIPJRDXPGDJQY-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD Cn1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c(C(F)F)n1 1837920255 LRNACAMIJXDZGB-UHFFFAOYSA-N 490.316 0.964 50 20 JCGD O=C(c1cnc(Cl)nc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839197092 IQRROFWWOMCUSJ-NHYWBVRUSA-N 451.680 0.891 50 20 JCGD Cc1cc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)ccc2[nH]1 1839615355 JNNOPRDKTKGROH-RUZDIDTESA-N 477.326 0.540 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)no1 1843400821 AKAVYSJVGXYOLR-UHFFFAOYSA-N 497.556 0.861 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)ccc21 1844264407 PJIDEHFTPULJRT-UHFFFAOYSA-N 463.498 0.006 50 20 JCGD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1 10159973 ZMKMRKAKVMGFNV-UHFFFAOYSA-N 473.511 0.886 50 20 JCGD CC(C)(C)NC(=S)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 14895465 ZMTGODXPWARXOH-ZDUSSCGKSA-N 450.608 0.062 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1 28808128 VPSBKBXOECJAAM-UHFFFAOYSA-N 480.568 0.752 50 20 JCGD CCCn1nc(C(=O)NNC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)c2ccccc2c1=O 32671608 YSPJKJOMQAXRHT-UHFFFAOYSA-N 499.549 0.902 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)CSCC(=O)N2CCOCC2)c2ccccc2c1=O 104752647 DLBJQOYETLHVAD-UHFFFAOYSA-N 475.571 0.940 50 20 JCGD O=C(NNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1)c1csc(N2CCOCC2)n1 104855241 XKKJPISBRAHRSZ-UHFFFAOYSA-N 462.488 0.799 50 20 JCGD COc1cc(C(=O)NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)cc(OC)c1OC 727063405 WVCGLIBCLYOXRF-UHFFFAOYSA-N 495.290 0.380 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2cccc(C#N)c2)o1 728825413 ZLUAUOFKOASQQX-HNNXBMFYSA-N 460.468 0.942 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)c1cnn[nH]1 729455839 CBTQPFIGFBMGQV-NSHDSACASA-N 477.366 0.428 50 20 JCGD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)C1 731218487 BSBYRMURZQPFLP-DLBZAZTESA-N 493.634 0.647 50 20 JCGD COc1cc(N2C[C@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CC2=O)cc(OC)c1OC 751208515 FRTRNKRRDYPZRQ-GFCCVEGCSA-N 476.511 0.704 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1ccccc1 751212089 ZXCBCFZQKWFUJJ-HNNXBMFYSA-N 450.542 0.869 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)c2ccc(=O)n(CCOC)n2)c2ccccc2c1=O 769322735 PSSNVPQTLIWZQK-UHFFFAOYSA-N 454.487 0.865 50 20 JCGD N#CCCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1 849207780 LREZJIACIQVHEH-UHFFFAOYSA-N 454.468 0.845 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2ccccc2F)cc1 915788984 ABNWRAXXCIKERW-ZDUSSCGKSA-N 467.475 0.896 50 20 JCGD CC(C)NS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 915789087 HUXWQRKNUKHKNY-UHFFFAOYSA-N 474.948 0.749 50 20 JCGD O=C(NCc1nnc2n1CCCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 915915519 RBSVSPUTTWIQTK-UHFFFAOYSA-N 461.548 0.933 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)c3cn(C)c(=O)nc3O)cc2)cc1 916103557 FIYYSBWKGLLEDQ-UHFFFAOYSA-N 485.522 0.690 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCC(=O)NC(C)C)N(S(C)(=O)=O)CC2 916270963 WVVRXGLTBKUXEE-MRXNPFEDSA-N 499.590 0.198 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)CNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C 916562094 KWSCZIJHBCEZFF-UHFFFAOYSA-N 475.527 0.070 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CN(C(C)=O)c3ccccc3O2)cc1OC 920056822 DHWTXKHCWKWWRS-LJQANCHMSA-N 457.439 0.822 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)NCCc2cccs2)cc1[C@@]1(C)NC(=O)NC1=O 920832811 BKIQWYHBAQFABJ-GOSISDBHSA-N 467.529 0.547 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2c(c1)OCO2 1778439257 MJZVFHZLBBNRHD-ZJSXRUAMSA-N 466.299 0.536 50 20 JCGD Cc1nc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)s1 1779029166 SYTZUHMCSMENSV-OAQYLSRUSA-N 458.544 0.445 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(Br)c3)CCO2)C1 1779032725 WZEOHWZIUDLKLD-HXUWFJFHSA-N 489.330 0.600 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cncn1)C2)NC(=O)NCc1ccccc1 1780559443 MWILQIYKHQCEOC-HYBUGGRVSA-N 498.588 0.138 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(Cl)c(O)cc1O 1780843002 QSWKCBCWSIADMN-NFBKMPQASA-N 488.733 0.872 50 20 JCGD CCn1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n1 1780968486 AMBMRVKAWSRLBG-DEOSSOPVSA-N 483.573 0.693 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1781507909 NJMQKFYPGPECCA-DNVFCKCGSA-N 453.628 0.851 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ccnn4c3)C2)C1 1782402902 TXEPEFFLVOEOIA-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1783176741 AQMISSWTCJYINB-ZSEKCTLFSA-N 462.459 0.488 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]43)C2)C1 1783504232 ZKLRFEKMOFXNMH-UDABPDOUSA-N 493.605 0.302 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(-c3ccccc3)[nH]n1)CCO2 1783935707 VTWGSWNHEAKHED-HSZRJFAPSA-N 454.531 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(C(=O)OC(C)(C)C)CC3)C2)C1 1785718375 GHLJQZBQWZEYKC-XMMPIXPASA-N 495.621 0.836 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C[C@@H]21 1788611165 NBQZBUKJFDERMD-VHHKXPHXSA-N 492.536 0.796 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnncc3C(=O)O)[C@H]2C1 1788886082 NYUQYQXFYGFXKP-GVARAGBVSA-N 455.309 0.799 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)[C@@H](Cl)COC)C[C@@H]31)C2 1790687151 DEDSZMJHNGOVKI-WSRJKRBPSA-N 496.992 0.856 50 20 JCGD COCCOCCOCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Cl)COC)C[C@@H]21 1791135919 HCMNSNKPRLYHTQ-XSLAGTTESA-N 450.960 0.290 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)cccc3F)C[C@@H]21 1791290634 FOZKOCWSXBEQHN-QOKNQOGYSA-N 452.502 0.860 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2 1792887256 NZUMQIJRCSPMKG-IVSAIRAKSA-N 459.616 0.313 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(C(F)(F)F)n1 1794069241 KJPPTAISRQVEHM-DBWKPXFBSA-N 492.458 0.545 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1C(=O)C=CC1=O)C2 1794144026 DOKJDGKBJLCJLN-XGUBFFRZSA-N 468.938 0.682 50 20 JCGD COc1ccc(OC)c(CCCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1 1795736295 WWAUSLMQAUYEGE-NXKWYNOOSA-N 496.369 0.610 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)(C1)C2 1795740485 ASERLLLOYIYPQM-ULCYKIJUSA-N 499.373 0.017 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)C1CC1 1796190952 IBGBFIFZFNSXAX-YRPNKDGESA-N 471.363 0.922 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnnc3ccccc13)C2 1796442067 PRDOOKIMCQUOJD-BSBFHTJNSA-N 475.509 0.967 50 20 JCGD COC(=O)C12CCC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)(CC1)CC2 1797265136 RDKWMHWYNHGFOV-QJSFUDEASA-N 484.358 0.083 50 20 JCGD CC(=O)Nc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1O 1798442814 HEVBUQGDRWHDFY-MUJYYYPQSA-N 466.498 0.915 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(C)n1)C2 1798522683 MDAPMXCRDHBYQO-FVCICTRLSA-N 458.431 0.166 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C[C@](C)(O)CC(=O)O)C2)NC(=O)NCc1ccccc1 1799869387 NWMWTWHFTALZLH-YDLHNXBPSA-N 489.573 0.587 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)C2 1800971385 XSFJHAHRDFXTOD-XLIFZOOWSA-N 463.962 0.879 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]3C[C@@H]3N1C(=O)OC(C)(C)C)C2 1801014031 BAXXPDACJXWHMY-RDTNQEAYSA-N 493.605 0.347 50 20 JCGD CCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1801497364 MTTZWIGONGNWCE-HATOLVCRSA-N 461.563 0.349 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cn2nnc3ccccc32)[C@H]1c1cccnc1 1804019362 UAXWKJVLMVNRJJ-GAJHUEQPSA-N 499.535 0.845 50 20 JCGD Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)no1 1804493127 DKGQNPIABREETL-YWZLYKJASA-N 464.486 0.334 50 20 JCGD Nc1nc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cs1 1807364577 QXOINLBAAKZSGF-QAPCUYQASA-N 451.317 0.434 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCCn2ccnc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368503 UKSRNWGPAYNVLY-NZQKXSOJSA-N 461.331 0.758 50 20 JCGD COc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807369627 QMSXUSSDYILPQR-NQIIRXRSSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376799 WLIDZTPWYNLOLW-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@H]1c1cccnc1 1810301928 DXESXFWBAYRKFA-KKSFZXQISA-N 485.508 0.756 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1C 1811629443 VKAGIEMMTYYFIA-UTKZUKDTSA-N 463.303 0.137 50 20 JCGD O=C(CCCn1ccnc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813352331 UNEUNTNYRCXMAL-OFNKIYASSA-N 461.331 0.758 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3nn[nH]c3c2)[nH]n1)c1ccc(B(O)O)cc1 1817474791 GEAOWDXMFQMVNV-LJQANCHMSA-N 459.275 0.981 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)CC1 1824867289 CSBJYOZVUGRLHV-INIZCTEOSA-N 488.243 0.955 50 20 JCGD C=C(CC(=O)OCC)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826088369 DZUZIRVOILYNJO-ZDUSSCGKSA-N 451.549 0.938 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1827401086 ILUFHWARPLGTEQ-INIZCTEOSA-N 461.599 0.897 50 20 JCGD O=C(C1CC(O)C1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828541049 NGMKWMHTGFIMNO-YGRXKEQHSA-N 479.961 0.809 50 20 JCGD O=C(c1nc[nH]n1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551069 HFESHOWVJPATAA-IERDGZPVSA-N 476.921 0.470 50 20 JCGD O=C(Cn1cncn1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551368 OGNSWIUWJCFVTK-XMSQKQJNSA-N 490.948 0.330 50 20 JCGD O=C(CCBr)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(O)O)C2)C1 1828833272 JDWXUULTSGOYOE-HXUWFJFHSA-N 484.347 0.534 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cn1 1830538441 FVBVFJCYBORIII-VLIAUNLRSA-N 484.347 0.969 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830652902 SYAACFSDAFAGFR-VWLOTQADSA-N 495.316 0.230 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830720357 XWPHKEWJWBMWJA-YCRNBWNJSA-N 481.977 0.641 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732854 BWKUZLQEKYDTCL-OXQOHEQNSA-N 471.341 0.815 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)C1 1830736960 CAIKERLLFGUVNC-YVHKJVDXSA-N 489.997 0.690 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1831649910 CMMSHGNTQNYQOM-BTYIYWSLSA-N 467.954 0.494 50 20 JCGD C[C@@H](CN)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549136 GKTKIKXZVAORDS-AUSJPIAWSA-N 462.975 0.170 50 20 JCGD COc1ccc([C@H](O)C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cc1 1833182981 FWSYLDWEAFCTBP-DEOSSOPVSA-N 489.617 0.673 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)n3cnnn3)CC2)CC1 1833266060 MIGPDTZULKXVMC-KGLIPLIRSA-N 456.389 0.837 50 20 JCGD Cc1ccccc1NCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834772925 JYRFLAJJHYPXPX-UHFFFAOYSA-N 478.402 0.972 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1c[nH]c2ncccc12 1835318345 ZGCBIGHMXQEBTO-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cccc4c3NC(=O)C4=O)CC2)CC1 1835623772 DJNWPPFANLWOAF-UHFFFAOYSA-N 498.584 0.380 50 20 JCGD CC(=O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835734616 NGBSXXKFEUKEQH-UHFFFAOYSA-N 458.563 0.486 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3)C2)C1 1835937465 YEXPEIWQCJDAJZ-OTNCWRBYSA-N 498.772 0.894 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C3CC3)C2)C1 1835941475 LDZRAAZHCJHLQF-VWLOTQADSA-N 464.327 0.628 50 20 JCGD O=C(c1n[nH]c2cc(Cl)ccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837084171 XHMRCUVWBCQZRR-BEFAXECRSA-N 457.314 0.886 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CSC3CCCC3)C2)C1 1837456636 PCLANGCCRHJTRY-JOCHJYFZSA-N 477.587 0.431 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C(F)(F)F)ccn1)CCO2 1838083706 KONUBDBBIAGNDH-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528460 ZPIVIASJXYWQCZ-PEBXRYMYSA-N 492.485 0.115 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)nn1C(F)F 1838709442 NUDKBTJPBPVCIS-HXUWFJFHSA-N 472.493 0.030 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1839149331 CECJBAHUNUDXGC-GXZWQRSESA-N 490.985 0.229 50 20 JCGD O=C(NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)c1ccc[nH]1 1839199358 VDWALKSUACQUET-MAUKXSAKSA-N 475.315 0.282 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1839964425 RBTYKAQWVIUHBD-CRAIPNDOSA-N 496.424 0.042 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840006965 ZTEQGRGSSTZMOY-XCGNWRKASA-N 487.981 0.300 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccccc1)CCO2 1840119707 PCEVUBSTABCKJC-FHAGJXEFSA-N 479.537 0.559 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1 1840154567 ZQDJENSUVWQAIP-AUUYWEPGSA-N 472.329 0.935 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(S(C)(=O)=O)ccc3F)C2)C1 1840154956 LOEPIHAJEOHRNO-OXJNMPFZSA-N 492.953 0.553 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840186937 GXQVRGVWOMRCPX-KPZWWZAWSA-N 470.350 0.132 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1F 1840187055 JEEPWHVUKJLTEA-QFIPXVFZSA-N 468.501 0.716 50 20 JCGD C[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1840530330 KJIUKZALESARSA-SEPYTNNBSA-N 459.547 0.581 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cc(C(=O)O)ncn2)C1)NC(=O)NCc1ccccc1 1842217578 RCWSFCALSKYYFS-UHFFFAOYSA-N 481.513 0.338 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1(CNC(=O)OC(C)(C)C)CC1)C2 1846384018 UPYIUJAUXVASQP-UHFFFAOYSA-N 451.568 0.868 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2ccc(C(N)=O)cc2)C1)NC(=O)NCc1ccccc1 1846775050 BMIPZFYEDNKTQY-UHFFFAOYSA-N 478.553 0.949 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)[C@H]2OCC[C@H]21 1847563571 KNGVVYXXJSFEQZ-OVYBAWALSA-N 457.955 0.812 50 20 JCGD C=CCOC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847563664 OKNHADBRIVQKIQ-UGUYLWEFSA-N 488.969 0.593 50 20 JCGD Cc1cc(C(=O)N2CCC[C@H]2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)ccc1[N+](=O)[O-] 726527742 IZSNRQGJDXWZOP-ZFWWWQNUSA-N 453.477 0.025 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1OC(F)F 728981025 LSHBIAVQPUTJLZ-UHFFFAOYSA-N 478.456 0.880 50 20 JCGD O=C(COC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1)NNC(=O)[C@H]1COc2ccccc2O1 731247380 DPXYEDYIJRMBMW-IFMALSPDSA-N 469.494 0.715 50 20 JCGD CSc1nc2nc(C)c(CC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c(C)n2n1 750047354 UULWFONTFACLNM-MRXNPFEDSA-N 486.510 0.536 50 20 JCGD Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cn1 750716680 NRIHZCDIGRSMLZ-AWEZNQCLSA-N 463.497 0.883 50 20 JCGD C=CCNC(=S)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C\c1ccccc1 825123406 QQYSIAZCEVBGOQ-CTXBLAANSA-N 460.603 0.061 50 20 JCGD O=C(COc1ccc(F)cc1)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 910844900 QBPPUCKEMDOCDF-UHFFFAOYSA-N 457.505 0.677 50 20 JCGD COc1c(F)cc(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1S(N)(=O)=O 915545313 LEWPANYQRDTJMY-UHFFFAOYSA-N 473.866 0.682 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccnc(N4CCOCC4)c3)nc2)CC1 916389013 OGXQAWMDGUQYHH-UHFFFAOYSA-N 490.590 0.076 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCS(=O)(=O)Cc2ccccc2)c1 916636164 PSBCVHZHCHMNQQ-UHFFFAOYSA-N 468.557 0.496 50 20 JCGD CN(C1CCCCC1)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919886604 XSYINDQMUNQRKM-OAHLLOKOSA-N 472.589 0.771 50 20 JCGD Cc1n[nH]c(C)c1CCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 920213950 UKXCWVFMEFFQPX-UHFFFAOYSA-N 463.560 0.760 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@H]3NC(=O)N[C@@H]32)c1 921301609 GIGSNVOHVGBEIX-VYDXJSESSA-N 469.589 0.424 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1777705325 ZRZMUGRSRYIWCU-GCFUEJLLSA-N 493.524 0.633 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779294716 LHKUKLSQUGCACV-FOIQADDNSA-N 459.616 0.553 50 20 JCGD Cc1nnc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)s1 1782209475 SBOACRGUSXMOED-IIBYNOLFSA-N 466.608 0.666 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)nc3ccccc13)CCO2 1783934163 ASJCPFUMGVZAQV-HSZRJFAPSA-N 455.515 0.757 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)COc1cc(Cl)ccn1)CCO2 1783934270 BVLQHUGBKOLPKG-HXUWFJFHSA-N 453.927 0.317 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCCN(C)C(=O)OC(C)(C)C)CCO2)C1 1783939963 OWYILDCTHKLKPS-HSZRJFAPSA-N 483.610 0.836 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1 1783940148 SAXYWBPXPSSOMG-QFIPXVFZSA-N 467.567 0.058 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Cn3ccnc3)C2)C1 1784499175 WCGSMMBEJVIRNH-KOYRPVOESA-N 455.519 0.483 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1 1785486858 DOTILWFLVPDACF-HSZRJFAPSA-N 456.547 0.698 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786820716 KEZKWRKKZSPLKE-NSYZTORCSA-N 488.633 0.686 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978637 GSJRYQZTZGRUBD-HMNCIZAVSA-N 477.326 0.153 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ccnn34)C[C@@H]21 1788609949 UOCOSDNMDVYTKS-DCPHZVHLSA-N 463.498 0.240 50 20 JCGD CC(C)(C)c1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cn1 1788610129 FKMLDPXWUANTJL-FNHZYXHNSA-N 481.557 0.680 50 20 JCGD COc1cc(C#N)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1789258643 NJIREXVDORQRNU-JHVJFLLYSA-N 478.509 0.472 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnnn3)C[C@@H]21)[C@H](Br)Cc1ccccc1 1790779341 AKMXVNZZLAQYDZ-FJIDUMEYSA-N 477.363 0.659 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@]3(O)CCN(C(=O)OC(C)(C)C)C3)[C@H]2C1 1791332524 DTPCXKJQJMOYKQ-VMDVDIMUSA-N 489.997 0.592 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1 1792100619 FRPKAJOBEUHZRU-WPUCRFQZSA-N 479.382 0.937 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1Cc2ccccc2CN1C 1793830734 NCPTUURUCJQZDA-SRYPRDQNSA-N 457.575 0.006 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)[C@H](O)C1 1796361774 TWQFEECYRAUFCE-XBORSJSESA-N 463.934 0.728 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(O)c3ccn(C)c13)C2 1796441709 SYBKWEGRAKAFIQ-UTRJNVLQSA-N 493.524 0.616 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1cnn2C 1797088026 WHVXDSUGMGCUHY-BSBFHTJNSA-N 477.525 0.911 50 20 JCGD Cc1cccc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)[nH]c12 1797372770 VHDQIXAYVSGFIE-VPTLXERWSA-N 462.510 0.992 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(Cc2ccccc2)c1 1798151556 ROKGGMSFEWAEJS-HATOLVCRSA-N 489.536 0.447 50 20 JCGD COc1c(Cl)ccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1798690673 LWJYXYUBWWHETB-FVCICTRLSA-N 453.927 0.320 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1CCOCC1)C2)NC(=O)NCc1ccccc1 1799094683 FBYJXESOAKMKHY-RUMRUAAYSA-N 487.601 0.739 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1800707218 ZAULTQVBEPPGRP-DGADGQDISA-N 457.955 0.433 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](C)Br)cnc2c1 1800757674 OAUHIWZCCSXVGT-VWPFQQQWSA-N 463.332 0.990 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1801906095 YOOVGYRBQTZMQG-VPTLXERWSA-N 485.733 0.495 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CN2CCSCC2)[C@@H]1c1cccnc1 1802448022 GPASVLJVKATDFM-GCJKJVERSA-N 462.620 0.509 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCN2CCOCC2)[C@H]1c1cccnc1 1806953331 RDNBZFOXILBBDB-PGRDOPGGSA-N 481.557 0.122 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cc(=O)n2[nH]cnc2n1 1807358544 KIRYHRDYQTUTTJ-RISCZKNCSA-N 450.286 0.936 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807359529 ALTAXVXRIATCBE-LUDFCHSCSA-N 457.361 0.240 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccn(C(F)F)n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360798 LXVXITJSEFQBGD-LPHOPBHVSA-N 469.257 0.986 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2ccc(F)cn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362173 FANMAJPHAUSZOX-FDDCHVKYSA-N 462.290 0.858 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC(c3ccccc3)=NN2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373061 MJYZUPDIXGFZPP-TUSQITKMSA-N 497.364 0.847 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1=O 1807375037 KSTDUPMLNHPITD-VGSWGCGISA-N 498.304 0.530 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)Cn2nccn2)[C@H]1c1cccnc1 1808416071 DFBSRINBOHQXHZ-RYUIIRDCSA-N 463.502 0.513 50 20 JCGD O=C1Nc2c(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)cccc2C1=O 1810026220 JNYQYWWCEUVLLJ-VGSWGCGISA-N 498.304 0.530 50 20 JCGD COc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1OC 1811645209 QJKJLUHXGFRQCN-PGRDOPGGSA-N 490.325 0.807 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1 1813070701 MHYHDTLDDXFHCR-VGSWGCGISA-N 482.541 0.956 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1813071356 SMXLSLQLUAEHDE-XXBNENTESA-N 455.563 0.974 50 20 JCGD O=C(CCc1cnccn1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813442098 CXDGLGYXDKWZOE-AUSIDOKSSA-N 459.315 0.504 50 20 JCGD O=C(Cn1nnc2ccccc21)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815336785 FBGAFGJQAWFUBZ-OAHLLOKOSA-N 476.327 0.494 50 20 JCGD CC(C)n1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815340043 CEYAVMAZGFWMEF-AWEZNQCLSA-N 454.321 0.535 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCc3nc[nH]c3C2)[nH]n1)c1ccc(B(O)O)cc1 1817475657 QLTGOXOOJTWRPK-FOIQADDNSA-N 462.319 0.924 50 20 JCGD Cc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c(O)n1 1821514251 ZCTUMCXRNYVWCZ-CQSZACIVSA-N 452.301 0.772 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1826722918 KPZXJPQUDDGCIP-JOCHJYFZSA-N 485.633 0.556 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)NCc1ccccc1 1830674924 FUATUUMXYSIMIQ-BOXUBARPSA-N 453.898 0.850 50 20 JCGD C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732772 AIZUUCSEMHAYHO-HOIFWPIMSA-N 489.997 0.902 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CCC(F)(F)CC1)CCO2 1831006387 GKRIXYFWRZSLQQ-OAQYLSRUSA-N 481.500 0.581 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3(O)CCC3)C2)C1 1832551417 NFPOSJLIXZLDGH-KSFYIVLOSA-N 489.997 0.880 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(n3)OCCO4)CC2)CC1)c1ccc(B(O)O)cc1 1834798698 YOXAYZAWKFQVTN-UHFFFAOYSA-N 494.357 0.032 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835933827 GQCKMEYXXIZVOF-DFBJGRDBSA-N 466.343 0.315 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCc1c[nH]c3ccccc13)CCO2 1836109675 ZBYDVTXUJYUIKA-RUZDIDTESA-N 485.585 0.930 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3cnccc13)CCO2 1837035788 LCHCEWYBTUZALQ-DEOSSOPVSA-N 469.542 0.678 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1837396974 PNNQTXGURCJLAP-RXJHVNNBSA-N 475.546 0.150 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1 1837457172 ZBGVSFMSZLEBSV-RDUCDJESSA-N 455.471 0.062 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)ccn1)CCO2 1837867153 FTAKDYBGCDQIBZ-FQEVSTJZSA-N 453.927 0.178 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CSCC(=O)O)CC2)CC1 1838395462 UIEASEVUNPMDIN-UHFFFAOYSA-N 479.559 0.115 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839153905 VRJUAZJNOIKKQK-ZOCIIQOWSA-N 460.362 0.970 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cnc2c1 1839200620 LIOAAGIJSFHYEX-OXQOHEQNSA-N 497.321 0.763 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCO[C@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2s1 1839524704 DYTWSYQUHIQUNJ-QFIPXVFZSA-N 477.587 0.981 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839527919 TYFMQQIIICOZCZ-QHCPKHFHSA-N 490.536 0.225 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1839966431 DJZQOKYYEREVFP-KSMMKXTCSA-N 494.383 0.459 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OCC4CC4)cc3)C2)C1 1840187396 XOSYWRLZTPVRHA-VWLOTQADSA-N 488.585 0.918 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCc1ccccc1F)CCO2 1840547431 CEGFNBXAHJCQRX-HSZRJFAPSA-N 464.538 0.588 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)CCOC1 1845208254 RANQMSWCUBWUCZ-QHCPKHFHSA-N 488.545 0.186 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846126699 OTBLXOZBRYLIDW-MZNJEOGPSA-N 469.347 0.440 50 20 JCGD Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 10214151 ZMLURFQSSJOKPQ-INIZCTEOSA-N 465.553 0.669 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1 16786304 YBRZBFXKFSLDIL-GFCCVEGCSA-N 481.955 0.462 50 20 JCGD CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1 117598359 DZMUYXNINHFSPS-UHFFFAOYSA-N 461.475 0.929 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCN2CCN(C(C)=O)CC2)cc1 729318216 JHCLNECHWRCMBK-HMMYKYKNSA-N 493.568 0.621 50 20 JCGD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 729509745 DSSCAHMBULPBJK-IBGZPJMESA-N 498.569 0.520 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCS(=O)(=O)N2CCSCC2)cc1 730672550 GLLRXULAPXYMDO-AWEZNQCLSA-N 460.578 0.562 50 20 JCGD CCCn1c(CCC(=O)NNC(=O)COc2ccccc2O)nc2cc(S(N)(=O)=O)ccc21 730779197 XBFUGBULNNKWDJ-UHFFFAOYSA-N 475.527 0.958 50 20 JCGD CCCOc1ccc(C(=O)NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)cc1OC 914602313 WHQMDISDVQMIIX-UHFFFAOYSA-N 478.483 0.501 50 20 JCGD Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)Cn3ccc(=O)n(C)c3=O)cc2)n1 915060119 DZJWFHZMCPUPQB-UHFFFAOYSA-N 454.512 0.707 50 20 JCGD O=C(CNS(=O)(=O)c1cccs1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 915188275 VRWVRYXKGSLMOE-UHFFFAOYSA-N 486.597 0.662 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CSC(F)(F)F)c(=O)n2Cc1ccccc1 915193563 IJUPPOCESBBJKR-UHFFFAOYSA-N 484.460 0.828 50 20 JCGD O=C1Nc2cc(N3CCOCC3)ccc2C1=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915939525 RSLQQFUSAGTBHM-UHFFFAOYSA-N 499.549 0.630 50 20 JCGD O=C(CS(=O)(=O)C1CCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 916096287 MOBSQSRZYWVYHY-UHFFFAOYSA-N 457.574 0.980 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc(C(=O)N(C)C)cc3)nc2)CC1 916249912 CSWISXLCRHALKZ-UHFFFAOYSA-N 475.575 0.546 50 20 JCGD CC(C)[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)N1CCOCC1 916254038 DNHKAMKGELXWEW-GOSISDBHSA-N 469.612 0.001 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccccc3F)C2)ccc1Cl 916561272 MDKQYMAEGYQLJN-LLVKDONJSA-N 454.867 0.941 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)COc3cc(C)cc(C)c3)cc2S1(=O)=O 917545530 DEVIIAZNKQONLX-UHFFFAOYSA-N 461.496 0.934 50 20 JCGD Cn1c(CC(=O)NNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nc2ccccc21 918138172 NPRSQCAAEYHNQI-UHFFFAOYSA-N 473.534 0.526 50 20 JCGD C[C@H](C(=O)N(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)n1cccn1 918689183 QZFRRGMNBNDZDA-MRXNPFEDSA-N 476.559 0.538 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4ccncc34)C2)C1 1777978664 ZAPNDQYIDLMCAM-WGLQLPMYSA-N 464.486 0.307 50 20 JCGD Cn1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C(F)F)n1 1779030189 IKCOQRNMFHJZFK-HXUWFJFHSA-N 463.445 0.114 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2 1779200672 NGSDYWQKJBHFGW-HSTIPLNKSA-N 450.330 0.348 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnnn1C)CCO2 1780095641 RUGNMECENMOGCN-HXUWFJFHSA-N 458.431 0.406 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cnnn1)CCO2 1780099177 XJTBISPENVOLPN-ZUOKHONESA-N 473.446 0.211 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCCCN1C)CCO2)NC(=O)NCc1ccccc1 1780968517 MMEMCTVPNGDLEQ-PXDATVDWSA-N 486.617 0.647 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)C1 1781115303 PXEUMSWAFCSAPG-BZIRYSOJSA-N 494.358 0.735 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CS(=O)(=O)N1CCCC1)C2 1782173102 XMXUXUAVESNZLW-FRQCXROJSA-N 466.000 0.180 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1784441267 JTKHLEZTPMIHDT-XUXIUFHCSA-N 454.387 0.079 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccnc3)[C@H]2C1 1785172540 HYVZXKFOYVWRMG-NXOAAHMSSA-N 467.364 0.965 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)[C@H]1CCc2nc(O)nc(O)c2C1 1785330543 HYCVHZVHNVIZCG-TZANDKBRSA-N 487.326 0.663 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)C3(c4ccccc4F)CC3)C2)C1 1785458506 CBTRGLQSHVZHQY-HSZRJFAPSA-N 452.291 0.681 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnn3C)[C@H]2C1)NC(=O)NCc1ccccc1 1786076568 KZUHHQGFGPIUMB-ZJOUEHCJSA-N 483.573 0.360 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)[C@H]1SC(=N)NC1=O 1786405869 HKYSCBFGJXJXTB-DKKFBCOVSA-N 461.382 0.554 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](COC)NC(=O)OC(C)(C)C)[C@H]2C1 1787471983 ZFQMEOJVNORQQC-WOYTXXSLSA-N 477.986 0.760 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1787504341 RLXSGFPCCXSNRE-KKUMJFAQSA-N 466.398 0.177 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C(N)=O)C[C@@H]21 1787507719 MJFPMXWRPXZRKS-ZMEUDLNSSA-N 480.525 0.513 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21 1788701122 VJCQOUPEAGXCHL-JKQORVJESA-N 451.955 0.840 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1789597754 CUJFSVCDHJBEHW-INIZCTEOSA-N 487.325 0.723 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1791238627 ORJCNEJJVXVIJW-JKEDJMADSA-N 464.563 0.095 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)ccc1[N+](=O)[O-] 1791292576 XAQXPVNFFHWUDX-BXWFABGCSA-N 477.518 0.570 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)[C@H](O)C1 1792452294 PYCOSZYCAKTHAS-XBORSJSESA-N 463.934 0.728 50 20 JCGD COc1ccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c(OC)c1OC 1792975187 MINIYWFNJNRDLT-DMSOZEQRSA-N 468.934 0.915 50 20 JCGD 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NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3F)CCO2)C1 1835004995 JPNQIYLUVOVZKJ-HSZRJFAPSA-N 471.489 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3)CCO2)C1 1835050303 RFTJNGPQPBZIGZ-QHCPKHFHSA-N 471.489 0.137 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1835835035 MMOKJHKVPNBLJV-UHFFFAOYSA-N 488.727 0.140 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)C3(c4cccc(F)c4)CC3)C2)C1 1835934022 KHDKBLZTNZGQTE-XMMPIXPASA-N 482.317 0.307 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(s3)CCC4)C2)C1 1835935060 DISKKNLRPYTTQX-QHCPKHFHSA-N 470.356 0.300 50 20 JCGD Cc1scc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1C 1837456315 GPLQOQJJRBESRO-QFIPXVFZSA-N 473.555 0.747 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CS[C@@H]3CCCCO3)C2)C1 1837458751 AGESPRSKUWQKPW-DENIHFKCSA-N 493.586 0.015 50 20 JCGD Cc1ccc([C@@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)cc1 1837460453 GHBBTVFJEOYBOM-IQGLISFBSA-N 481.553 0.867 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1 1839197411 UKRHAMVYGPUCBS-TXPKVOOTSA-N 475.311 0.876 50 20 JCGD O=C([C@H]1CC(=O)N(C2CCCC2)C1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198305 BWTMVOJLPYWWDH-GZRFBZBPSA-N 490.370 0.924 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201926 NUZXLSRNSACDBA-AEFFLSMTSA-N 470.299 0.419 50 20 JCGD CC[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1839210975 INDCHTSEKOJIBE-VWKPWSFCSA-N 477.986 0.736 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c([N+](=O)[O-])c1 1839462168 FKYYCUBJHLNJFH-OXJNMPFZSA-N 485.877 0.051 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)CN)C2)C1 1839743705 ODQBQRMACFEFIV-OFJVLVBYSA-N 492.374 0.098 50 20 JCGD CCC1(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)COC1 1839776877 KVPJWSXSABBHFE-OLCUMFGGSA-N 461.519 0.003 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1 1839965407 XQQBGNDPGHNZFP-YZVOILCLSA-N 470.368 0.907 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCc1cnc3[nH]ccc3c1)CCO2 1840081964 RELOTUZSZCPDHW-XMMPIXPASA-N 486.573 0.325 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncn(C)c3C(F)(F)F)C2)C1 1840152600 NAPPNZRGRNHGQN-YVEFUNNKSA-N 468.860 0.763 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(OC)c1 1840185596 POTIHKLSPZCTOY-HSZRJFAPSA-N 478.546 0.147 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cnc2s1 1840188724 YWWNVKJYFCLWES-SFHVURJKSA-N 475.354 0.938 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1cccc1)CCO2 1840351363 VGKJSWHVIYVKFJ-UAZFOLIYSA-N 470.530 0.640 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@H]2CC[C@H]3CCC(=O)N3C2)C1)NC(=O)NCc1ccccc1 1845074557 YTHUFSRUHSPKTL-SFTDATJTSA-N 496.612 0.937 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1)C(=O)NC1CC1 14311811 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469.447 0.832 50 20 JCGD CC(=O)N[C@H](CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(Br)cc1 919886703 YWKGCDLISCYWMV-UONOGXRCSA-N 461.338 0.534 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 920017800 DVWXEJJMAQYBRZ-UPCZABBQSA-N 464.478 0.777 50 20 JCGD COc1cc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1[N+](=O)[O-] 921019990 PICLMXAMSWMBMX-UHFFFAOYSA-N 452.445 0.694 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Br)C(=O)NNc1ncccn1 1337271637 QXXPBSCQXOOLBN-ZDUSSCGKSA-N 456.322 0.916 50 20 JCGD Cc1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1778322391 UWLYTUCMHMNMCQ-AUSIDOKSSA-N 452.515 0.830 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031888 GVCCERRHNLSODU-NYHFZMIOSA-N 453.503 0.024 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1779317023 YQYLWXDGQRGWAL-PGRDOPGGSA-N 492.485 0.115 50 20 JCGD Cc1n[nH]c(C)c1C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779395598 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NC(=O)c1ccccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807363666 CFEDGJNHOXCPHO-GCJKJVERSA-N 472.310 0.494 50 20 JCGD CN1CCC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1 1807373914 VGCDWRBIFJXQAE-URVUXULASA-N 450.348 0.423 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1 1808413973 DEPKQNWCUUKDEB-DXNGAEDLSA-N 481.557 0.554 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cn2ncccc2n1 1809358368 YZJUYJBQDDAVNY-GCJKJVERSA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCN2CCOC2=O)[C@H]1c1cccnc1 1809530481 CRDBWPPYDMRPFV-OXQOHEQNSA-N 481.513 0.242 50 20 JCGD Cn1nc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cc1O 1810299426 PSSFCSYSYPNQBD-KUHUBIRLSA-N 464.486 0.153 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1ccnn1 1810305187 IZTSWISICZONCZ-IDHHARJASA-N 463.502 0.252 50 20 JCGD O=C(CN(CCO)CCO)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1 1812713144 HBFUFPRKRAQCDC-LPHOPBHVSA-N 457.369 0.159 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1812863464 HOEYAOFJXLDQAV-XCRHUMRWSA-N 460.137 0.864 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CC(=O)N(C3CCCC3)C1)CC2)c1cccc(B(O)O)c1 1815350151 GRAFZABFQKUPQN-RDJZCZTQSA-N 496.398 0.840 50 20 JCGD C[C@@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1 1817816635 JQUNFHJXNASUCV-KCJUWKMLSA-N 464.284 0.625 50 20 JCGD CC(=O)Nc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)ccn1 1817906988 ZOWSRJBQGWTHQO-MRXNPFEDSA-N 479.327 0.716 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCO4)sc2C1 1819122096 IBRMYKGHOIWGLD-LBPRGKRZSA-N 461.548 0.721 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C)[nH]n1 1822412113 ISIQXQPOBHQZLU-JKSUJKDBSA-N 495.581 0.660 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(S(C)(=O)=O)c3)CCO2)C1 1830182003 DFNHGAIISKTWAB-YLJYHZDGSA-N 474.963 0.414 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)cc3)CCO2)C1 1830345270 GVFGMUQHENOGLH-MSIOFZDNSA-N 499.524 0.361 50 20 JCGD O=C(c1c(Cl)ccc2c1OCO2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830727678 AUFCUNAIXWVALA-BFUOFWGJSA-N 461.298 0.738 50 20 JCGD CC#C[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)c1ccc(O)cc1 1830738327 NPBWHBYCTXKLSZ-JXHRLWIKSA-N 464.946 0.945 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(CN(C(=O)C#CC3CC3)CCO2)C1)NC(=O)NCc1ccccc1 1831218545 WJHAAUDEUIFXLD-VWLOTQADSA-N 483.569 0.202 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cn1 1832913237 QVRGYCCZKCHTQY-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD CC(C)n1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cc1C(=O)O 1834000172 VCPUDVRBPQIPNL-GOSISDBHSA-N 469.970 0.947 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834720183 YYUWZZSPYBPEIL-SFHVURJKSA-N 479.390 0.447 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCc3cccnc3)CC2)CC1)c1cccc(B(O)O)c1 1834800162 VMPYYNRTRNCZFE-UHFFFAOYSA-N 464.375 0.579 50 20 JCGD COCCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Cl)COC)CC2)CC1 1835179942 JLEAQOXNNRLRDH-SFHVURJKSA-N 455.987 0.969 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C#N)CC1)CCO2)NC(=O)NCc1ccccc1 1835345728 XEPVUVQPQWDSRY-XMMPIXPASA-N 484.557 0.093 50 20 JCGD CC[S@@](=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737995 PRKXEQZNDRNUIE-MGBGTMOVSA-N 478.619 0.029 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3csc4c3CCCC4)C2)C1 1835930553 MSVVXTRBUSFPCS-XMMPIXPASA-N 484.383 0.691 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835935758 PSWCEGFCVWAGFX-VWLOTQADSA-N 481.358 0.443 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@]3(F)CCCCC3(F)F)C2)C1 1835937453 XNIPLXAIEGUFAZ-RTWAWAEBSA-N 484.280 0.354 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccsc3)CCO2)C1 1836005969 ORHLUDKWIHRRFQ-JOCHJYFZSA-N 473.555 0.449 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2 1836473305 ALDUBEYFJBZYIZ-AVYPCKFXSA-N 463.959 0.346 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[S@](=O)CC)CCO2)C1 1837245610 CFTYHVDWZNCFQM-WZXMGIQQSA-N 453.399 0.775 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccc3F)C2)C1 1837455613 AJEJMJCFFVQFGL-JOCHJYFZSA-N 491.907 0.861 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)[nH]n1 1837459411 OHFBDABXBZIVSF-HSZRJFAPSA-N 485.545 0.090 50 20 JCGD C[C@](O)(C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)C(F)(F)F 1839150628 RTHCYYXTXLPZTO-KKUMJFAQSA-N 451.269 0.992 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1 1839199153 RMMUYZNJEVIYLI-FUHWJXTLSA-N 460.300 0.780 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CNC(=O)C3)C2)C1 1839744064 MQRVHCCUGJNWTE-SYJPKNQESA-N 474.464 0.464 50 20 JCGD CC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839744303 ZFZIPJRZPYJALF-NSKACUHBSA-N 462.453 0.464 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1 1839964397 QHDGGBNSPQAVNI-FOIQADDNSA-N 495.378 0.985 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(O)nc3O)C2)C1 1839964416 QTMYGYFLEWCELN-YVEFUNNKSA-N 459.297 0.131 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4c(c3)CCO4)CCO2)C1 1839999554 IZOPJVQPDZVZFR-PGRDOPGGSA-N 452.935 0.874 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCOc3ccccc3)C2)C1 1840183531 KDZLJWLUVIFNEL-QHCPKHFHSA-N 462.547 0.285 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H](C[C@H]2CCOC2)NC(=O)OC(C)(C)C)C1 1843422968 CGYLJUAZMDYYAY-MSOLQXFVSA-N 495.621 0.883 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cccn(C)c1=O)C2)NC(=O)NCc1ccccc1 1845038313 OUNDDZFVXSFMLS-UHFFFAOYSA-N 466.542 0.549 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C 1847502108 LHVPDQBKOZOGFT-XUXIUFHCSA-N 475.384 0.988 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CCCS1(=O)=O 1848098623 MHSLYGYAJGUUBB-ZQDZILKHSA-N 463.984 0.898 50 20 JCGD O=C(NNS(=O)(=O)c1ccc2c(c1)OCCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1 16128118 AZRYXNYROBUUDT-UHFFFAOYSA-N 483.524 0.102 50 20 JCGD CC(C)(C(=O)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)c1ccccc1 731219892 LUKGQTWTMFPKIK-UHFFFAOYSA-N 474.587 0.842 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1 745992002 QNYGVVSEKBAIFP-UHFFFAOYSA-N 481.575 0.384 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1ccc(Br)cc1)C(=O)N1CCCC1 748246946 GQYDGRSAZIAUGK-AWEZNQCLSA-N 473.349 0.372 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1 751289386 DXOMCYXTTOLGTD-UHFFFAOYSA-N 499.637 0.890 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccc2c(c1)OCCO2 770392880 ZJJIIGRFCCCKAV-UHFFFAOYSA-N 463.468 0.359 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1CC1(Cl)Cl 863950131 WOJGTXHPIODYPE-CQSZACIVSA-N 450.344 0.981 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCc2ccc(N3CCN(C)CC3)nc2)c2ccccc2c1=O 916247394 VEGAOJFTGNSYDB-UHFFFAOYSA-N 464.530 0.707 50 20 JCGD C[C@H]1CN(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C[C@H](C)O1 916250201 WNQCRBVCOFUKTK-IRXDYDNUSA-N 467.592 0.914 50 20 JCGD O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cccc(Cl)c1 916516090 CYOYCPVXSWTRAU-UHFFFAOYSA-N 466.951 0.831 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)CC)C2)c1 918549216 HCRQOVJHYIKRJI-MRXNPFEDSA-N 474.605 0.540 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCS(C)(=O)=O)C2 1778094669 LKYTZBRUYJWOGH-YMYKSDKLSA-N 481.575 0.069 50 20 JCGD Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c2cc(O)ccc2n1 1778425520 HCZDFCYLVFLMPF-VWLOTQADSA-N 475.310 0.686 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4ccc(O)nn4)cc3)C2)C1 1782115314 BQVADVFIMPTBMA-RUZDIDTESA-N 488.309 0.286 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)[S@](=O)c1ccccc1 1782682517 UJHNLMIPEGWACR-KVCQHZKUSA-N 485.566 0.325 50 20 JCGD O=Cc1ccccc1-c1cncc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1782766062 PNCGDJPQBIDHCV-MHZLTWQESA-N 499.332 0.998 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)CN3CC(=O)NC3=O)CCO2)C1 1782864155 RHBHCYUZGHJIMQ-CEMXSPGASA-N 473.436 0.253 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1783534247 GYVICLHGFJBHMC-CZUORRHYSA-N 452.371 0.025 50 20 JCGD CCc1nn(C)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1Br 1783933915 MPCRURFCLSYNMQ-FQEVSTJZSA-N 499.410 0.562 50 20 JCGD COc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1F 1784702842 MDMPIRWGOMOGRO-QHCPKHFHSA-N 471.489 0.519 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)ncn3)C[C@@H]21 1785075285 CMIJPDUZFTVEFB-SDADXPQNSA-N 483.953 0.908 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1C 1786982868 JJPTURYZTUXSKY-PMVMPFDFSA-N 450.344 0.819 50 20 JCGD Cc1nc2ncccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1787982472 LITGYSRTIUWXGR-ULQDDVLXSA-N 457.535 0.004 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccn(C(F)F)c3=O)[C@H]2C1 1788800061 HYDSWOBQKNFQQV-BPUTZDHNSA-N 469.489 0.210 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)nn3)[C@H]2C1 1788835883 HFEFTECWWMTKGX-YPMOQXHOSA-N 473.921 0.857 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCNC(=O)C3)C[C@@H]21 1789221827 IUHRABBTPNOEBF-QIJLZVCCSA-N 488.497 0.640 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C[C@@H]21 1791291019 IKFKLXHKXQQHCK-SZMVWBNQSA-N 481.594 0.206 50 20 JCGD Cc1nc2ccccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791291504 XGXRGWJMRHIUTE-BZSNNMDCSA-N 456.547 0.609 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1792780738 VMFVXWQLMVSXBS-JGAAPJFWSA-N 486.338 0.446 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)C1 1792814705 NHFPPKJOSFDECK-DACLVMHWSA-N 453.898 0.891 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)(F)C(F)(F)C(=O)O 1793976604 UFKARWPXXOFXNU-ILWJIGKKSA-N 461.372 0.292 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccc2sccc2c1=O 1794044721 LAISLYKWEPRZAW-HRJSJKBJSA-N 453.948 0.906 50 20 JCGD Cc1cncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)c1 1794810614 UYVKSNDWXLQORV-IUTQVRIDSA-N 480.569 0.939 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(=O)Nc1cccnc1)C2 1796892062 XQYSCSAQZVWLME-AUHJYUKYSA-N 451.487 0.792 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1797117620 RPQNPBDVOOHOCV-YUDUXTHKSA-N 463.934 0.523 50 20 JCGD N#Cc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797753948 LVJURPZGANOPGM-HBCWATKFSA-N 452.446 0.213 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc(C(F)(F)F)n1 1798513842 QPTVDCLSTSRGAS-NWJSVONSSA-N 451.829 0.912 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnnc1)C2)NC(=O)NCc1ccccc1 1799094716 GTSNDRIJVJNPCE-CEQLMSFQSA-N 467.530 0.026 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2 1801012932 NKPXLDANSGVETB-JWXAPSBJSA-N 486.495 0.106 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1CCCN1Cc1ccccc1 1801191112 HMYPXUJGABDACN-DVKRWUGUSA-N 477.370 0.234 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)CC1 1804589630 GGYBECTYKOZUFE-QDMKHBRRSA-N 472.546 0.994 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1804827430 MYZZJPRAAOLIPN-WMZHIEFXSA-N 487.325 0.748 50 20 JCGD CN(C)c1ccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)nc1 1807736352 VRCDXJOHIVTSCI-UHFFFAOYSA-N 450.348 0.986 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1CC[C@@H]2CCC(=O)N2C1 1807736636 VEAFTVBHJKPHSB-CXFRRJOOSA-N 490.369 0.482 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1808714890 IUYFZRYRCRULIV-UYAOXDASSA-N 462.319 0.567 50 20 JCGD CC(=O)c1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n[nH]1 1810298717 LZIXZYYECGNXRH-FOIQADDNSA-N 476.497 0.639 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(CO)on2)[C@@H]1c1cccnc1 1810303748 YASAXKJHFPEKAY-IFXJQAMLSA-N 465.470 0.194 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1810356014 APQMWGMVMNNIOQ-NQUFMGSDSA-N 455.353 0.521 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]1c1cccnc1)C(=O)C(=O)O 1810544438 LNXKRNIDYZSUEM-MAUKXSAKSA-N 450.568 0.482 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)ccn2C)[C@H]1c1cccnc1 1813072408 CWYRJTGTTSJFDR-JTSKRJEESA-N 454.531 0.473 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@@H]1c1cccnc1 1813074346 PONCRWAUPSDQBX-IIBYNOLFSA-N 482.520 0.956 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnc3[nH]ncc3c1)CC2)c1ccc(B(O)O)cc1 1815344399 XLJNEFIGCYWGHZ-OAHLLOKOSA-N 462.300 0.634 50 20 JCGD COCc1oncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354837 SVIUCDDGELTFFE-CYBMUJFWSA-N 456.289 0.497 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)Cn2cc(Cl)cn2)[nH]n1)c1cccc(B(O)O)c1 1817475547 SOXMMCQARZAPPI-QGZVFWFLSA-N 456.699 0.946 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCCS2(=O)=O)n[nH]1 1821835680 JHQVJFDXKQGKTJ-HUUCEWRRSA-N 454.553 0.352 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)[nH]n1 1822416568 IICWHBDIUMDLJE-CABCVRRESA-N 454.553 0.352 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1 1823007313 LVSUWFGJAHZTRY-PTOFAABTSA-N 451.318 0.897 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnn4c3OCCC4)sc2C1 1824001777 SCCZKHSQFPPAHI-LBPRGKRZSA-N 461.548 0.721 50 20 JCGD COC(OC)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828562573 HDOSCPOWUJHEKQ-VGOFRKELSA-N 483.949 0.657 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)n1ccnn1 1828924650 WMQIYDNVUHZBMU-DNVCBOLYSA-N 454.535 0.771 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccc2c1OCCO2 1830728171 QAKKDCPRLHQWSH-IERDGZPVSA-N 454.907 0.436 50 20 JCGD COC(=O)C12CCC(C(=O)N3CCOC[C@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)(CC1)CC2 1830730475 AQNRXHNHCGKZFW-QXFGJNNOSA-N 472.966 0.556 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)cn1 1833430061 OWKYUMFBHKZBDT-LIRRHRJNSA-N 471.352 0.976 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1833497593 NUJFXBCSEDPDJO-QZTJIDSGSA-N 461.302 0.481 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ncc(C)s1)CCO2 1833801733 FRIMTUBIOURHPQ-MNQDVBFDSA-N 474.543 0.656 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)CN3CCCCC3)CC2)CC1 1834613394 OQDQMOMWGGNYGX-UHFFFAOYSA-N 471.606 0.356 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)CC2)CC1 1835046768 IAXMQINRFRMQMK-MSOLQXFVSA-N 491.029 0.697 50 20 JCGD Cc1n[nH]cc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738158 WHXBYTLWZYYGFL-UHFFFAOYSA-N 454.535 0.216 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2 1836625088 OJFFCNMRWOVACN-SFTDATJTSA-N 484.280 0.354 50 20 JCGD O=C([C@H]1CCc2nc(O)nc(O)c2C1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836715329 PSUPPIGLDJPXHN-UGSOOPFHSA-N 482.965 0.591 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1 1836850613 VHDMYRONJRDIRS-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1 1836850615 VHDMYRONJRDIRS-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)N1C[C@H]3C[C@H]3C1)CCO2 1837289787 WWKZIUOXBXCEFV-GFAJBQDWSA-N 458.397 0.957 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837630207 JIIJIWWNKCBLFL-RBUKOAKNSA-N 459.330 0.713 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)N1C[C@@H]2C[C@H]2C1 1838368492 KGJIBMZNYLQPAG-SQNIBIBYSA-N 484.601 0.638 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C)n(C)c1C)CCO2 1838383483 MQRIUQCLCCXSDC-MSIOFZDNSA-N 484.557 0.846 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)CCO2)C1 1838484063 XMODVNWZKCIQSP-SBUREZEXSA-N 489.960 0.894 50 20 JCGD CNC(=S)NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839153848 TUSZSYIYEFHUGM-IRXDYDNUSA-N 455.408 0.163 50 20 JCGD O=C1NCc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc21 1839200675 PFCSTOGPPDNCPP-DNVCBOLYSA-N 470.295 0.691 50 20 JCGD Cc1cccc(Cl)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839339173 OBEUTPJFZHGWJQ-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1 1840153242 IJWXQBGELIGJAX-CVDCTZTESA-N 479.961 0.743 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4c(F)cccc4n3)C2)C1 1840154721 DSYZVSZVLAIYGE-VLIAUNLRSA-N 454.886 0.797 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1 1840184614 XIFBEUNDVFFEQY-QHCPKHFHSA-N 472.546 0.016 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)C1 1841347841 AWSOFJAEOGKOHF-AUSJPIAWSA-N 459.971 0.798 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012547 ZXCCMOVPCPOOIM-LJQANCHMSA-N 471.363 0.973 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C2 1846385115 UJHCCOKLBYLQCL-MRXNPFEDSA-N 451.568 0.820 50 20 JCGD Cc1sc2nc(CS[C@@H](C)C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)[nH]c(=O)c2c1C 17642328 YZOMOIFVODKOCO-WDEREUQCSA-N 458.587 0.805 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 725899328 ZZNJZOXGQNRURR-INIZCTEOSA-N 494.595 0.908 50 20 JCGD CCn1nc(C(=O)NNC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 726379513 MAPVZDFUFPRMCO-UHFFFAOYSA-N 459.484 0.294 50 20 JCGD COc1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc(Cl)c1OCC(N)=O 728847467 GUSPSQJUPJRXRO-UHFFFAOYSA-N 462.894 0.680 50 20 JCGD CCOc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728889936 UCOPXPRIBIQRCW-UHFFFAOYSA-N 476.559 0.608 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)cn1C 728971746 JWEUVMVEYNTUEP-UHFFFAOYSA-N 451.477 0.537 50 20 JCGD O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)CN1CCCC1=O 789857943 NTWFYLOEEYNTOH-UHFFFAOYSA-N 451.277 0.595 50 20 JCGD O=C(COC(=O)CNC(=O)c1ccc(C(F)(F)F)cc1)NNC(=O)[C@H]1COc2ccccc2O1 801980950 FHNIZPFVPSREGA-MRXNPFEDSA-N 481.383 0.966 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)C34CC5CC(CC(C5)C3)C4)c2)CCN1 906471181 KVMCQZIAXXMXCM-UHFFFAOYSA-N 460.556 0.785 50 20 JCGD COCCN1C[C@@H](C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CC1=O 914462281 JEUDQCICWGMOIS-ZDUSSCGKSA-N 466.541 0.805 50 20 JCGD COc1cccc(C[C@@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n2nnnc2C)c1 915857575 IMPCKQZVXQPLTD-SFHVURJKSA-N 458.500 0.639 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCCN2CCN(c3ccc(F)cc3)CC2)c2ccccc2c1=O 916513698 LVCJCBRXNNPYSG-UHFFFAOYSA-N 467.505 0.839 50 20 JCGD Cn1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)c(-c2cc3ccccc3o2)n1 920371032 RHWRRJWONULKML-UHFFFAOYSA-N 453.484 0.868 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Nc1cnccn1)C2 1778091374 XOYFARFTQNBGSU-GBBQKVGJSA-N 496.572 0.925 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778115731 AEKIJALOSUTOOR-DYVFJYSZSA-N 466.398 0.271 50 20 JCGD Cn1c(=O)n(CC(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)c2ccccc21 1778162576 WFTDWASTDCXGNO-HXUWFJFHSA-N 465.348 0.955 50 20 JCGD N#Cc1ccc2[nH]nc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c2c1 1779036819 GJEQZHBVPFFWGK-QHCPKHFHSA-N 474.481 0.190 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1ccc(O)nn1)C2)[C@@H](F)Br 1780776288 BRKDQSIMSOUIRR-RGYTYGDFSA-N 461.288 0.765 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)CCO2 1781220112 VINYPTIIEDZHRS-UJKGCTCZSA-N 472.995 0.014 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2 1782173034 SMHCIYWSOJBDNB-DXEZIKHYSA-N 477.986 0.640 50 20 JCGD COc1cccc(/C=C/C(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1783414242 YGBLBCZIXYGQOR-KDLSMAQYSA-N 450.300 0.532 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCC(=O)N3C(=O)OC(C)(C)C)C2)C1 1784190032 CCONOYNREYWZHG-VFCRVFHLSA-N 473.954 0.996 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)c1 1785587921 WUTLATONDMORSW-FBUXBERBSA-N 478.340 0.769 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CNc4ccccc43)[C@H]2C1 1786877876 LHYADRMKFGKCIU-TVLKCDEOSA-N 464.526 0.488 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C[C@@H]21)c1cccc(B(O)O)c1 1786982869 FWVUBGKMUVNPKJ-JLMWRMLUSA-N 466.299 0.045 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccnc3C)C[C@@H]21 1787507600 IAPCAYHTCPDTMU-ZPSROVLTSA-N 455.519 0.305 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cn3C)[C@H]2C1 1787747142 WXXUIFIWQUAVII-WILUMGJWSA-N 458.494 0.892 50 20 JCGD CN1CCN(C2(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCBr)C[C@@H]43)CC2)CC1 1789805121 RVSNPMBBAHBXAY-ULQDDVLXSA-N 457.413 0.531 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(=O)N(C2CCCC2)C1 1793776761 GTGKEBXAOXMKIO-GMHREAEJSA-N 498.584 0.501 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ncccn1)C2 1793878250 JLURTZVZJIWASZ-KRXQYRFLSA-N 467.954 0.741 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cc[nH]n3)n3ccccc13)C2)c1ccc(B(O)O)cc1 1795734111 DEFHQVQBLCUTSL-MRSFGVLCSA-N 499.336 0.526 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1OC(F)F)C2)c1ccc(B(O)O)cc1 1795736839 KPQAUYDDIXFPSN-CCWDJLKJSA-N 460.242 0.485 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1 1796365685 XNYOFKWMCRYDND-PLZKBRGSSA-N 463.934 0.728 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2 1796439552 KICCPXLMRRHZLF-MOPKTTBJSA-N 498.584 0.501 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3cccnc13)C2 1797750494 BWJBCOWWZAKHCI-CWPLJXCYSA-N 460.494 0.750 50 20 JCGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)nc2ccc(Cl)cn12 1797753832 HMSFPYHXSVEQJG-VTEUUUEMSA-N 497.943 0.812 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n[nH]1 1798650253 XJJAIIMFXZKYSF-RMFSNUHRSA-N 469.546 0.268 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799348646 PAZYKHRWRFPLBU-VZAMPYOESA-N 473.295 0.729 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)c1)C2 1800976872 BHYALXSZONUCER-PIKOESSRSA-N 451.951 0.980 50 20 JCGD CCc1c(Br)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)nn1C 1801013302 MERGRRUTMBYRPQ-IVWMJMPLSA-N 499.410 0.321 50 20 JCGD CN1CCCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1803173392 ZUMUAVSJRXDINQ-BVSLBCMMSA-N 450.348 0.565 50 20 JCGD CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1803514159 HFLZEVPNUMDXJG-QGJUGNDFSA-N 488.570 0.656 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1 1806051964 VWONMZQNXOHEIZ-KKSFZXQISA-N 455.519 0.573 50 20 JCGD CN1CCC(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1807367100 XGGFNPCBLLPLFK-UNMCSNQZSA-N 450.348 0.423 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2ccc(F)cn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370363 BWKHNTJKPKDFDO-MBSDFSHPSA-N 462.290 0.858 50 20 JCGD Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c(O)n1 1807373964 FCYUAKXPXZGDNR-RXVVDRJESA-N 460.299 0.804 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375962 RCSQWFNUCIZJPS-BPXKWBHBSA-N 474.330 0.372 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1 1809237480 ZRUWKGMVBSMSMF-CRAIPNDOSA-N 486.496 0.151 50 20 JCGD C#CCO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810295669 VCDZCNUYKMRASA-OXFYSEKESA-N 450.499 0.438 50 20 JCGD Cn1ncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1Cl 1815344376 WKSBSSYHNDBJQW-GFCCVEGCSA-N 459.724 0.749 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cnn4ccncc34)sc2C1)c1ccc(B(O)O)cc1 1818502184 JTGNCRHZNBBLQM-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(N)s1)CC2 1819794821 FJACPKYZDVAFDA-QMMMGPOBSA-N 458.529 0.720 50 20 JCGD CN1CCCn2nc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3ccc(B(O)O)cc3)CC4)cc2C1 1824381641 IBWXBCRYAMDUQX-MRXNPFEDSA-N 494.386 0.395 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824516888 MMKRLJOZVCHRFE-GOSISDBHSA-N 477.587 0.825 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCNC3=O)CC2 1825999729 UZSCBDJHEWGVIZ-ZJUUUORDSA-N 452.924 0.563 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3c(c1)CCNCC3)CC2 1826089912 QHRHVEQDEVDNAM-INIZCTEOSA-N 485.614 0.825 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057403 DPRVDFSVRADRPY-UTKZUKDTSA-N 465.363 0.890 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1827546359 HSJYXJIZZKTEOW-SFTDATJTSA-N 470.404 0.626 50 20 JCGD Cc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)c(=O)[nH]c1C 1831872112 ONMVPGHQCMZOLH-SFHVURJKSA-N 460.579 0.993 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2 1832162640 QGSMZMFMLIKKLU-ZNMIVQPWSA-N 451.269 0.992 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CN3CCNC3=N)CC2)CC1 1834703382 RZDRWNVUULTQKE-CQSZACIVSA-N 457.417 0.429 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1OC 1834798267 AMAPHKOTXVSEJS-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)COc3ccc(F)cc3)CC2)CC1)c1cccc(B(O)O)c1 1834800925 AWINVRIZLWXDKR-UHFFFAOYSA-N 483.349 0.770 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1835272928 ZXXUNPKXBRNXPQ-XMSQKQJNSA-N 470.950 0.693 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCOCC3)CCO2)C1 1835397590 UDFNOGABZDBCDW-VKNPPUGMSA-N 490.507 0.660 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1835642702 VFVCURQRXLFEHJ-PJIJBLCYSA-N 466.938 0.219 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1835765793 AAQKQBZPHNVYQS-UYAOXDASSA-N 465.422 0.445 50 20 JCGD CC[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1836343504 GCQCYBYGVKLDRZ-QFIPXVFZSA-N 488.633 0.675 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCCC3(F)F)C2)C1 1837456187 KRXXTMLUOXKGKC-DYESRHJHSA-N 481.500 0.581 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCCCn1cccc1)CCO2 1837623766 OTNQXPKMGOTVAS-QHCPKHFHSA-N 463.579 0.488 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837632737 WIIYJWIBFTWGSR-BEFAXECRSA-N 469.336 0.650 50 20 JCGD CC(C)CNC(=O)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838107470 MUOUTGFWPXWOIV-UHFFFAOYSA-N 474.562 0.070 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncnc3)C2)C1 1838527631 YWIUBXHLWPBOJD-JOCHJYFZSA-N 485.453 0.694 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(C)c1 1838901924 IUXPMFZCZNXREN-XMMPIXPASA-N 452.316 0.367 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839693616 PZAAAUWKPMPHFL-YLJYHZDGSA-N 485.354 0.530 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(CCOC)n3)C2)C1 1839964259 LDPQRYLKVDXUSR-HNAYVOBHSA-N 473.368 0.773 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1840032652 GJVFTDGRQDVSTK-QOKNQOGYSA-N 455.353 0.191 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1840033022 QRSPNFKYFHEXTI-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCc4sccc4C3)C2)C1 1840151324 YNMGGTSCVFDEKG-LAUBAEHRSA-N 472.007 0.816 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCCc3ccccc3F)C2)C1 1840183084 ZZFGBALYWBVULO-DEOSSOPVSA-N 478.565 0.978 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4[nH]ncc34)C2)C1 1840184186 WRTIBXHHHWZWOK-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD Cc1ccc(OCC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840184192 WVQJPDHYKVZJOH-HSZRJFAPSA-N 462.547 0.203 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(C)c1 1840785216 DZOBEPHPWCDPFF-UTKZUKDTSA-N 454.907 0.451 50 20 JCGD Cc1cccc(C)c1N1C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)CC1=O 1843013042 BCWLXYUAMSIQRL-FQEVSTJZSA-N 475.354 0.853 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)C[C@H]2C1 1843014835 HIQGMMTUFITCDR-AVRWGWEMSA-N 483.374 0.831 50 20 JCGD CC(C)(C)OC(=O)N1CC(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844264324 GGUDRRICBHKWQX-UHFFFAOYSA-N 458.519 0.369 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)[C@@H]2Cc3[nH]nc(C(F)(F)F)c3C2)C1 1845857167 ZDHIUHUGHVQOSY-ZDUSSCGKSA-N 462.237 0.340 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CSc2ccccc2[N+](=O)[O-])C1 1846302861 NEMYPVVQBXNODK-UHFFFAOYSA-N 455.301 0.884 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1847040069 VGAHLGDFHWTXJI-SHTZXODSSA-N 472.546 0.805 50 20 JCGD CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1sc(N3CCOCC3)nc1C)C2=O 12699511 HPDDZMOSHWAMAF-UHFFFAOYSA-N 478.575 0.940 50 20 JCGD O=C(CSc1nnc(N2CCOCC2)n1C[C@H]1CCCO1)NNC(=O)c1ccc([N+](=O)[O-])cc1 29067865 NQCMEEHFTUIGGN-MRXNPFEDSA-N 491.530 0.755 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@H]1CCCN(C(C)=O)C1)N(S(C)(=O)=O)CC2 726101986 GYJCJXYWDJMMCH-WMZOPIPTSA-N 496.586 0.359 50 20 JCGD Cc1oc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1S(=O)(=O)N1CCCC1 728328314 RQGOYWPTMZNUTG-QGZVFWFLSA-N 493.494 0.517 50 20 JCGD CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)ccc2Br)cc1 728508555 SAFJZFCMADQRPZ-UHFFFAOYSA-N 478.346 0.989 50 20 JCGD COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)o1 730766119 WQTKQOVARGRROD-UHFFFAOYSA-N 457.486 0.474 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc[n+]([O-])cc1)c(=O)n2Cc1ccccc1 798371559 DXFWCEIODLHLRG-UHFFFAOYSA-N 491.508 0.159 50 20 JCGD COc1ccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1OC 859314319 KGOUEXJOAZAWLN-UHFFFAOYSA-N 469.541 0.790 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)C2=NN(c3ccccc3)[C@@H](C(N)=O)C2)cc1 913081458 QDCAOCVUYAOLFP-GOSISDBHSA-N 478.538 0.989 50 20 JCGD CNC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cn1C 914688977 SNAWXORVZZMJIR-UHFFFAOYSA-N 463.545 0.429 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(OCC(=O)O)cc2)c1 915185547 DPYXQUHMQUFRMO-UHFFFAOYSA-N 457.486 0.024 50 20 JCGD CN(C)c1ncccc1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 915274400 YMSOQENJSPGFBU-UHFFFAOYSA-N 461.544 0.562 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](Cc1cccc(F)c1)n1nnnc1C 916134568 PXKWLQRBAKRISM-INIZCTEOSA-N 474.522 0.967 50 20 JCGD CCO[C@@H]1C[C@@H]1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 918017312 SGULFHHZRSNEMT-JKSUJKDBSA-N 454.487 0.000 50 20 JCGD Cn1c(CCC(=O)NNC(=O)NCc2ccco2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 920857675 JJVHCKOPWVAYBN-UHFFFAOYSA-N 490.542 0.650 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H](C)OC[C@@H]1CCCO1)c(=O)n2Cc1ccccc1 921023919 IFHNFHMQMVPLRV-AEFFLSMTSA-N 498.540 0.159 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1[nH]cnc1-c1cccnc1)CCO2 1779032516 MFWAMDOZAKPKLW-HSZRJFAPSA-N 476.497 0.228 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cncc(C(F)(F)F)c3)CCO2)C1 1779032867 YVZFEZWEAJQNKU-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)N1CCOCC1)C2 1780712711 VQGMPWQSHZMGNU-OHDICMOHSA-N 452.379 0.387 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780774562 DGVGUYZLMJQZHW-ZXFNITATSA-N 481.315 0.686 50 20 JCGD N#Cc1ccc(F)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1781103149 FGUVDIHKPGMOLK-ZJSXRUAMSA-N 465.290 0.818 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1781230573 VULGKAFERHAQHJ-OALUTQOASA-N 458.346 0.696 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1781382973 DVPJNWZVNNORJN-PKOBYXMFSA-N 499.374 0.593 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1781384088 ZADXJUPYHNKYEK-LJQANCHMSA-N 471.378 0.706 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)C1 1782169687 RPKBRGHDTNVEAC-ZHZLYBIUSA-N 486.374 0.473 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783023501 XFODTNLQJZRTOK-FVJLSDCUSA-N 498.374 0.887 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cnc(C)s3)C2)C1 1784436446 VCERTNXXCFBFHG-JHXRPTDYSA-N 458.544 0.958 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1784784121 DBEDNGBDCJNKES-VJANTYMQSA-N 495.621 0.809 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H](O)C3)C[C@@H]21 1785076517 ORTGPFUCAGIFIV-WBAHDQRJSA-N 459.971 0.869 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1[N+](=O)[O-] 1785183272 UPTPDJMEWFQEFA-OAQYLSRUSA-N 463.491 0.420 50 20 JCGD Cc1cccnc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1785204485 WGNRDZFEISXQRP-LRQRDZAKSA-N 466.542 0.615 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)n4[nH]cnc4n3)[C@H]2C1 1786978421 XMHFPZGBEDAPCC-FMSGJZPZSA-N 467.324 0.184 50 20 JCGD CN(C)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786984927 ZUIKCGHYZQGTCI-NYVOZVTQSA-N 451.332 0.340 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)[C@H]2C1 1787499776 ZALWZJZZWABPMW-LHEWDLALSA-N 475.409 0.942 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)C1 1788609715 CNYMKICDSSTPSO-MHZKCTCGSA-N 487.557 0.258 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnnc(Cl)c3)C[C@@H]21 1788611641 NXIZBSKFGMVUOB-UVBJJODRSA-N 459.894 0.036 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4CN3C)C[C@@H]21 1791288107 YMWJLJCLKMMKKX-KJJMTIBFSA-N 471.602 0.396 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1792126919 JZOKSDYBPRCVPT-FFGOWVMKSA-N 489.378 0.263 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl 1793117684 YFOVLVUZRVFXRF-XFIYOXNOSA-N 490.001 0.566 50 20 JCGD CC(C)c1nn2ccccc2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734721 MNDTUYBWEVRVIQ-FEJSZKPUSA-N 476.342 0.655 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(Cl)cccn13)C2)c1ccc(B(O)O)cc1 1795734855 ZOKGTPJDAJYQAA-CCWDJLKJSA-N 468.706 0.185 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(C(F)(F)F)n1)C2)c1cccc(B(O)O)c1 1795737312 ROSDLUWRMXTBGI-YVWYUNDQSA-N 477.248 0.226 50 20 JCGD COc1cc(N2CCC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)CC2)ncn1 1796187967 QDYCYVAOGPPCGI-WKCHPHFGSA-N 493.373 0.333 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(Cl)ccc3n1)C2 1797750768 POCZFOXGNBRJGD-DBWKPXFBSA-N 483.916 0.503 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)C1 1799343324 RBHPDRWVYYQXGF-AIEDFZFUSA-N 494.358 0.902 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc(-n2cnnc2)cc1 1806994095 ZTPDVANMLAJNJP-XUZZJYLKSA-N 496.336 0.976 50 20 JCGD Nc1ncc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1 1807275523 PTXSPOLMQYLCRW-QAPCUYQASA-N 451.317 0.434 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807361833 JLJNESZYTGPQDH-UYAOXDASSA-N 462.319 0.567 50 20 JCGD Cn1nc2c(c1C(=O)N1CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]1c1cccnc1)CCC2 1807364037 FFYCXUOPGUZICD-XMSQKQJNSA-N 473.342 0.617 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369335 HAKKDVULAOPRAL-HYBUGGRVSA-N 478.358 0.484 50 20 JCGD COCCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1808657581 MHCPJTOYRZZDMK-LAUBAEHRSA-N 492.540 0.556 50 20 JCGD CN[C@@H](CC(=O)N1CCCC2(CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)C1)C(=O)O 1809830795 BWBFWOWETMYXCT-STPJHCLOSA-N 460.535 0.414 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc2cn[nH]c2cn1 1810085420 MRGXRPAUDKYHPZ-VGSWGCGISA-N 470.298 0.666 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)cco2)[C@@H]1c1cccnc1 1810300589 ZIKNEXYSODQUSV-FOIQADDNSA-N 462.466 0.667 50 20 JCGD N=C(N)SCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303623 UCBPSPYTOYFGOT-GUYCJALGSA-N 456.532 0.026 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1nc2ccc(F)cn2n1 1812289111 DRQCMAQJSMHOLM-DYESRHJHSA-N 488.288 0.577 50 20 JCGD CCN(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1812312229 QIBKHRNCBYGMSM-SYNHAJSKSA-N 453.547 0.740 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1 1812392608 UAQBZYIOQMLALT-OFQRWUPVSA-N 469.336 0.804 50 20 JCGD Cc1nc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c(=O)[nH]c1C 1813070743 LPXDCWVAQFFJQA-DYESRHJHSA-N 469.546 0.474 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CS(C)(=O)=O)[nH]n1 1818112134 UJZBCSLRCGVNEL-OOXYOOLHSA-N 463.520 0.580 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1823124828 HWDRPGCKCHRCAD-HNNXBMFYSA-N 453.333 0.631 50 20 JCGD CN1CCN(C2(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1827052746 ZBYVCLVYYIOHIK-HSZRJFAPSA-N 482.434 0.380 50 20 JCGD O=C([C@H]1CCCS1(=O)=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053434 OKIKCBKWQKNEJQ-VQTJNVASSA-N 462.377 0.177 50 20 JCGD O=C(c1cc2n(n1)CCCO2)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057634 LMULHYLHBDVPRP-NRFANRHFSA-N 466.347 0.893 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)cc21 1828500337 OWCSPKDPZNQNGC-OAQYLSRUSA-N 493.373 0.244 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)C1(O)CCC1)CCO2 1829737513 SEYXYXYHQGQYDQ-KOYRPVOESA-N 475.546 0.128 50 20 JCGD C=CCCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1829783154 FWWVKCYTONRANI-QHCPKHFHSA-N 459.547 0.748 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C2=NNC(=O)C2)CC1)NC(=O)NCc1ccccc1 1830165303 BHNITGYOQQZNKV-OAQYLSRUSA-N 497.600 0.828 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3CCC4)C2)C1 1830543748 BSLBCASERXSSID-AUUYWEPGSA-N 455.353 0.930 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1 1830546712 VPFKUJXSBVQJIX-LIRRHRJNSA-N 456.337 0.817 50 20 JCGD COc1ccc2nc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2c1 1830727890 JQVXQROMTCGMOJ-DENIHFKCSA-N 463.918 0.913 50 20 JCGD O=C(c1csc(C(F)(F)F)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731545 LGBHWXIGLIBHNJ-NHYWBVRUSA-N 457.858 0.832 50 20 JCGD CC[C@H](C)[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1831513348 VSMNOJIFAQBCMB-NQKDMWHGSA-N 493.513 0.997 50 20 JCGD Cc1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccn1 1832627983 UVUDIGGWVDCYSL-HSZRJFAPSA-N 461.563 0.152 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cncnc3)CCO2)C1 1833114480 HOVLLXNSVHHFMI-HTAPYJJXSA-N 497.980 0.608 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nc(Cl)ccc1F)CCO2 1833244487 FSZHJEQZKYOCBL-HXUWFJFHSA-N 471.917 0.317 50 20 JCGD COc1nn(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1833860958 PLOIYXPVDQZNNP-SCLBCKFNSA-N 459.341 0.530 50 20 JCGD CCc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833973084 UWEWBWPYCRFCTL-UHFFFAOYSA-N 464.375 0.823 50 20 JCGD CNc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1834693404 UWWBCOFBWWVSAQ-UHFFFAOYSA-N 464.375 0.907 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C[C@@H](NC)C(=O)O)CC2)CC1 1834740203 SGABUCDJKBQAAG-JKSUJKDBSA-N 461.401 0.794 50 20 JCGD N[C@H](CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccnc1 1834797903 JTDSCPBARKIVPL-HSZRJFAPSA-N 479.390 0.037 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799114 OGEYANWVMSYINX-PKTZIBPZSA-N 497.401 0.307 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1834821650 SFWNHQQXPODURK-GOSISDBHSA-N 452.309 0.584 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1 1835083270 KSMGTPBHWIEDNT-MSOLQXFVSA-N 456.950 0.563 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(O)cn3)CC2)CC1 1835736986 PGFJWUFIRJPSDH-UHFFFAOYSA-N 467.530 0.285 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc4cccnn4c3)CC2)CC1 1835738285 SDENGSPYPNUBFR-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD CCn1nc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cc1C 1835992578 VLNAEIOEJRBRPJ-UHFFFAOYSA-N 461.611 0.770 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccoc4C3)C2)C1 1837455673 DAUKFIDIWRAYBU-BXKMTCNYSA-N 483.525 0.153 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1F 1837459572 KPYYPNJUBHNKFV-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD COc1cccc(OC)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838883008 MUDSMAOLGVHDPR-HSZRJFAPSA-N 478.546 0.147 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203718 UDTJKEGMCFACEK-YEWWUXTCSA-N 460.300 0.996 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(CC#N)cc1)CCO2 1839364310 YAWXOQDCEAMLHF-QHCPKHFHSA-N 457.531 0.196 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3c(Cl)cccc13)CCO2 1839495596 OSHREOYTKXYISR-HSZRJFAPSA-N 498.732 0.280 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)NNc3ccccc3)C2)C1 1840149718 YSRPRMAHTBNCLR-PLMTUMEDSA-N 454.955 0.702 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1 1840153677 XLJKMFYSFOKEKL-AUUYWEPGSA-N 463.865 0.567 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](N)c3cccc(Cl)c3)C2)C1 1840184298 YWKSFLAZZBIQTB-IRLDBZIGSA-N 481.981 0.169 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1OC(F)F)CCO2 1840745804 QUIUUDQHBYFRQS-JOCHJYFZSA-N 484.500 0.731 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3ccc(C)cc3)CCO2)C1 1840905513 KPLMFEFEKHBNPT-GCJKJVERSA-N 467.950 0.435 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC12CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2 1841290064 KEPGQPXJVJCTIA-STQMWFEESA-N 475.384 0.990 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)N1CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C1)C2 1843015661 SOOSDMOOWCUPRA-ZCNNSNEGSA-N 483.374 0.971 50 20 JCGD O=C(NC1(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CC1)OCc1ccccc1 1843927882 NZMZREBHKDXDEI-UHFFFAOYSA-N 477.326 0.642 50 20 JCGD Cc1cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)n(-c2cccc(=O)n2C)n1 1844264047 XTUPKADHCXTHMY-UHFFFAOYSA-N 490.524 0.009 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1847131128 KIIXPRALABEFQC-UHFFFAOYSA-N 476.509 0.461 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)CC2)CC1 1847558419 DSERHKRHQZZJMW-UFYCRDLUSA-N 454.999 0.511 50 20 JCGD COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c1C 9845152 XBPBOELYVIOYPA-WJHGTXIHSA-N 457.487 0.625 50 20 JCGD Cc1cc(C(=O)O)cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1C 13078536 QMBCJLKLJKCTFM-UHFFFAOYSA-N 497.551 0.646 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3cc(Br)c[nH]3)cc2)CC1 28717486 LDXWLSIPQFJGME-UHFFFAOYSA-N 498.359 0.705 50 20 JCGD C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)CNC(=O)c3cccs3)nnc12 725740682 GIRARJBJASINLA-UHFFFAOYSA-N 497.562 0.961 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)COCC(=O)NCc2cccnc2)c1 731192221 USYUZVDBWCJPEY-UHFFFAOYSA-N 451.277 0.947 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1 744446718 LGDHMNGHXRMQBK-KBPBESRZSA-N 454.549 0.647 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)n1 762991668 VZOYYBWHNBIFRA-AWEZNQCLSA-N 498.558 0.925 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)CN3CCCc4ccccc43)n[nH]c2n1 917393281 JRIFMEARYCKAII-UHFFFAOYSA-N 484.590 0.497 50 20 JCGD COc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1 920433454 FNBZYBWFLMNKTO-GASCZTMLSA-N 466.560 0.745 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)C[C@H](C)O1 1326447911 ZBBCTBQYYLQOKP-KBPBESRZSA-N 491.408 0.764 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1 1777932779 YJIGVPKNELMNCW-WGLQLPMYSA-N 464.486 0.307 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncn(C)n1)C2)NC(=O)NCc1ccccc1 1780559063 YKYHICPVVBEKLI-NTKDMRAZSA-N 498.588 0.289 50 20 JCGD Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1O 1780865030 UHYMOENJYIPNEQ-ZJSXRUAMSA-N 452.316 0.822 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)ccc1O 1780925842 MRYRCJKQOQIOTC-ZJSXRUAMSA-N 452.316 0.822 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCO1)CCO2)NC(=O)NCc1ccccc1 1780968338 IVRKZGDEANKVFI-WMZHIEFXSA-N 459.547 0.342 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1781061336 PMFBCGNPGIZGLO-LIXITEDJSA-N 487.981 0.440 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Cl)C2 1783276517 QUOPCEQUSUMMMF-RXIQLXCPSA-N 478.949 0.803 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1 1783838743 DUDHRZORJRBLGG-URXFXBBRSA-N 450.300 0.204 50 20 JCGD CC(C)[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)N1Cc2ccccc2C1=O 1783933672 VFBZTPMEAIOJLN-OZXSUGGESA-N 499.612 0.870 50 20 JCGD COc1cc(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1 1783935601 WAYSMZKJGDYPAO-NRFANRHFSA-N 454.474 0.790 50 20 JCGD O=C(C[C@H]1COc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784391931 KCTAQEYBZGSNIR-UDSSINMLSA-N 480.326 0.190 50 20 JCGD CC(C)(C)n1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)n1 1785698852 IBVGVOZHVDKTHT-QRFRQXIXSA-N 454.336 0.225 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981968 SRPWOAHXSFCIEH-ZRCAFCQKSA-N 472.734 0.936 50 20 JCGD C[Si](C)(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)co1 1788589078 HOUFURCVFXMHFU-VDGAXYAQSA-N 470.407 0.412 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-n4cccn4)cc3)[C@H]2C1 1790109300 CVYBZIQMHAOVSZ-HSQYWUDLSA-N 489.536 0.778 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccc2c(c1)OCO2 1795736530 VTGWISRTECZFQH-MUJYYYPQSA-N 451.483 0.908 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1796316397 GHYJDUYNOLRUIU-AICCOOGYSA-N 475.974 0.155 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnnc2ccccc12 1796890139 AZLOLOZLRDDPKQ-VTEUUUEMSA-N 461.482 0.145 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)C1=NO[C@H](c2ccccc2)C1 1797175673 RBGKNGKFOPIXRB-UDKICSLYSA-N 463.299 0.087 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)c12 1797754072 SJWGNYHONYZRDX-GFENJXEQSA-N 478.509 0.692 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc(OC)c1C 1797754420 VYGLOZRNGUOBOE-VPTLXERWSA-N 483.525 0.528 50 20 JCGD CCn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)cc1C 1798231889 XVAXSTMHYWGXNI-JHDGKUDLSA-N 497.600 0.761 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@](C)(O)CC(=O)O)C2 1798522913 DKRHIKCDMXXHLI-WPCGYXSLSA-N 493.469 0.339 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)[C@@H]1SC(=N)NC1=O 1799347163 HMILNIKNQQTBTG-OJHQEIPXSA-N 451.318 0.069 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2 1800980478 BDAIHSQFMIZOLO-CKBPBPHLSA-N 475.970 0.202 50 20 JCGD COC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c(C)c1 1801014054 BURLUHUPLBTVTF-UPHUGPLXSA-N 460.531 0.358 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1 1801447448 XMDRDROZDFTLQR-PLZKBRGSSA-N 472.995 0.059 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1ccc(S(C)(=O)=O)cc1)C2 1802332726 CRXYTKLHGRHQKN-BCDXTJNWSA-N 464.588 0.644 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1803142068 XAQLUSWSKFYCBS-PNBKFKSVSA-N 456.927 0.530 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnnc(Cl)c1 1804720447 DBKJLJKEMPDQKZ-OXJNMPFZSA-N 465.706 0.838 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)CNC(=N)N)[C@H]1c1cccnc1 1807059328 ZSBGHALKFSHTIF-FOIQADDNSA-N 483.485 0.718 50 20 JCGD Cn1cc(F)cc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807364957 UXTHXDUDWAWWSV-DYESRHJHSA-N 450.279 0.872 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)n1cccc1C=O 1807366518 ZPOBEUDEVWOMEX-HCLVMJGWSA-N 474.326 0.956 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@H]1c1cccnc1 1808410076 QNXFVBYPFLWGPH-GTZRZUIMSA-N 467.486 0.330 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C2CN(C)C2)[C@@H]1c1cccnc1 1808416275 KCBJILVHKSZIHI-BLCOGNGMSA-N 451.531 0.783 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnn2c1CCC2 1812141048 UCZDWPDMWWGQBK-XMSQKQJNSA-N 459.315 0.538 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2nn[nH]c2c1 1812298295 PBEATBLHYXGAOI-XMSQKQJNSA-N 470.298 0.666 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813069699 AAHIYEOOAAAUSB-ZWCUEREDSA-N 455.563 0.993 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343901 VTYWDELEGVTAJF-OAHLLOKOSA-N 453.333 0.631 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COc1ccc(O)nn1)CC2 1817283051 SIEDEPRLWIUPFS-ZVYABZQBSA-N 498.525 0.764 50 20 JCGD O=C(C/N=C/c1ccco1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1819951715 LVANEXTXWBXADO-QHBIDGPYSA-N 452.301 0.761 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nn[nH]c1C(F)(F)F 1820326408 UHWWXDUBXUXCNA-ZDUSSCGKSA-N 477.212 0.846 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1CC[C@@H]2CCC(=O)N2C1 1820758273 HNNXTFCOWQZWSE-HQRMLTQVSA-N 479.346 0.796 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1822415542 AEORMFAZOMMPSZ-INIZCTEOSA-N 471.522 0.087 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1 1823007315 LVSUWFGJAHZTRY-QRTLGDNMSA-N 451.318 0.897 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051724 AZMPWJFDEGNDFJ-JXFKEZNVSA-N 458.368 0.307 50 20 JCGD C/C(=C\c1cccs1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1829706643 RGLMPRZQKRXEKF-OEHGHSTBSA-N 464.588 0.981 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(C(F)(F)F)n1 1830731075 GWRWSDXBUGZWCF-ACJLOTCBSA-N 481.855 0.779 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1 1832586173 VFZVPAKWJYRMTR-UTKZUKDTSA-N 455.939 0.733 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)CC2)CC1)[C@@H](O)CCl 1833310099 IAGRMTYLLWPMMB-IBGZPJMESA-N 463.966 0.840 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)CC2)CC1)[C@@H](O)CCl 1833312116 KDYMLSQNISBZPW-RTWAWAEBSA-N 461.994 0.924 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1833565447 LLXFUTRMKUTGCR-MAUKXSAKSA-N 463.915 0.231 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931006 CLLDESRJRXPSGP-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD O=C(c1ccc(OC(F)F)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932201 SXOSEVCZPVJLFT-QHCPKHFHSA-N 490.268 0.352 50 20 JCGD Cc1ccc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1835942112 VYMOVAWMLQUJCD-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cn[nH]c4cn3)CCO2)C1 1837200420 FSCPVILVNADNBI-SGTLLEGYSA-N 452.309 0.811 50 20 JCGD O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2 1837296450 DWHYADXZVQGPJX-GDIGMMSISA-N 486.294 0.868 50 20 JCGD COc1ncccc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837453859 PPJHXQJPKYZUJU-UHFFFAOYSA-N 467.331 0.696 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CS[C@@H]3CCCCO3)CCO2)C1 1837510385 KZSVAHFWYVCPCC-KVSKMBFKSA-N 450.985 0.956 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1 1837921223 NQJVWZKDSPGPRZ-TZIWHRDSSA-N 497.401 0.380 50 20 JCGD O=C(c1ncccc1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838141074 GPABAUCNXKVFEG-GUYCJALGSA-N 451.829 0.770 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1839151140 JHJNHLZZXLYDJU-MOPGFXCFSA-N 494.397 0.791 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200466 IFVNDHYXAKWTBJ-RLFYNMQTSA-N 459.316 0.098 50 20 JCGD O=C(c1cc(Cl)ncn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200856 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CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c[nH]nc4c3)C2)C1 1840183844 DNMZNYGDZXSNTH-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc31)CCO2 1840260470 OTDSLCSBBFVJAV-RDPSFJRHSA-N 458.559 0.546 50 20 JCGD O=C1CN(CC(=O)N2CC3(CCCN3C(=O)[C@H](Br)Cc3ccccc3)C2)C(=O)N1 1845940365 LPXKAYVLJPZGIQ-OAHLLOKOSA-N 463.332 0.748 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O 3517877 RHIRPOILYWMLOK-WOJBJXKFSA-N 455.559 0.911 50 20 JCGD O=C(C[C@@H]1SC(N2CCCCC2)=NC1=O)Nc1cccc(C(=O)NNC(=O)C(=O)NC2CC2)c1 10213942 SOVNXXSGBMSFFO-INIZCTEOSA-N 486.554 0.539 50 20 JCGD N#Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1 15545083 AQHIUKKJTPVFBD-UHFFFAOYSA-N 472.483 0.234 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ncccn2)CC1)NNC(=O)c1nn(-c2ccccc2)cc1O 726710871 WKTHEGGHCHMGAN-UHFFFAOYSA-N 479.501 0.051 50 20 JCGD Cc1ccc2ncc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)c(=O)n2c1 728214850 TWNZCJFWAQPCAR-UHFFFAOYSA-N 456.528 0.696 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1)c1csc(N2CCOCC2)n1 730514544 JYRWSZVVELEZJR-KRWDZBQOSA-N 493.611 0.983 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1 747778655 KFFVLPAOZQLWNU-NRFANRHFSA-N 456.568 0.491 50 20 JCGD CCOC(Cn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nn1)OCC 748544257 HOHSDNOKKOKRDF-UHFFFAOYSA-N 454.509 0.002 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1OC 768961207 LBUPIZFMMMBFLF-GFCCVEGCSA-N 455.464 0.736 50 20 JCGD NS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl 793991112 NGZGTXOYLHDILS-CQSZACIVSA-N 469.859 0.132 50 20 JCGD COc1ccccc1N1C[C@H](C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1=O 849206131 DRPQPUVHXNYSRS-CQSZACIVSA-N 456.411 0.961 50 20 JCGD CCCn1c(CCC(=O)NNC(=O)C2CC2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 859365277 XUKMDIPLQDPRAE-UHFFFAOYSA-N 463.560 0.957 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1 913446100 LJDRMBXBHIEMBA-MRXNPFEDSA-N 463.512 0.993 50 20 JCGD CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 914750051 UHMXIOUMWQWMDW-UHFFFAOYSA-N 488.975 0.997 50 20 JCGD COc1ccc([C@@H](CNC(=O)NN[C@]2(C)CCS(=O)(=O)C2)N2CCOCC2)cc1OC 915894526 CFBVZDZBXJKQFG-OXQOHEQNSA-N 456.565 0.458 50 20 JCGD COc1cc(C(=O)NNS(=O)(=O)c2ccc(NS(C)(=O)=O)cc2F)cc(OC)c1OC 919954124 FBIUUBMQZLKMOE-UHFFFAOYSA-N 477.492 0.846 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=S)NC1CCN(C)CC1)c(=O)n2Cc1ccccc1 920307686 WMTQBZOVLZYHMD-UHFFFAOYSA-N 498.613 0.017 50 20 JCGD CCC(=O)N[C@H](C)C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 920436371 ICZSWHYCJUWDJU-DOMZBBRYSA-N 470.548 0.015 50 20 JCGD COc1ccc(CC(=O)NNC(=O)NCc2ccco2)cc1S(=O)(=O)N1CCOCC1 920857384 DKRABBZVWDNDPX-UHFFFAOYSA-N 452.489 0.382 50 20 JCGD C[C@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1nn(C)c(=O)c3ccccc13)C2=O 933556993 LGROENZRILOUPC-NPMABZOXSA-N 468.514 0.831 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CCN(S(C)(=O)=O)CC2)C1 1778758145 XDHDLZUATNGFPM-IDHHARJASA-N 494.452 0.955 50 20 JCGD CSc1ncccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779911669 FDXCXLQYULLCQV-AUSIDOKSSA-N 469.372 0.925 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccnn3n2)C1 1779994201 ZDSUVUSYHFJWGT-XMSQKQJNSA-N 457.535 0.230 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C2)C1 1780034471 KQRWYLAGIMDLGK-RUZDIDTESA-N 487.325 0.007 50 20 JCGD CN1CCN(CC(=O)N2CCO[C@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)CC1 1782866055 KCYCDEKCGQTCKM-HNFCMGRUSA-N 473.524 0.949 50 20 JCGD N=C(N)NCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783021822 COTVMZFDOUHAQB-KXBFYZLASA-N 452.353 0.306 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1 1783843453 NAVJYOGLAHSIAF-GBXCKJPGSA-N 465.510 0.522 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)C1 1783869273 SQTNDJLBJXFHAA-YVHKJVDXSA-N 452.552 0.169 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4sc(C)cn4c3=O)CCO2)C1 1783876459 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1803397185 SNZHGFQJRKJPEW-UDKUSLMSSA-N 455.559 0.863 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)C(=O)C(=O)O 1806346170 APMASHBERZRMLW-CJNGLKHVSA-N 455.309 0.415 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807366871 HUOXGCTWUXURMD-ZNLUXHQJSA-N 461.331 0.614 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)c2ccccc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370718 JWVIJPMTPAQPJR-MDNUFGMLSA-N 459.311 0.815 50 20 JCGD O=C(Cc1ccc(F)cn1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807477154 HLMIVUGGOLEOFS-MBSDFSHPSA-N 462.290 0.858 50 20 JCGD O=C(CNC(=O)c1ccco1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807587875 LCPZOTILZRNHIH-GCJKJVERSA-N 476.298 0.104 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CNC(=O)O2)[C@@H]1c1cccnc1 1808410065 QNXFVBYPFLWGPH-ABVZAHHRSA-N 467.486 0.330 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1)c1nc2c(=O)[nH]c3ccccc3n2n1 1809457258 JABHRRNHIFWERO-JCGIZDLHSA-N 495.927 0.885 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCc2ncc[nH]2)[C@H]1c1cccnc1 1810304642 FNBSZKKMOXUXJC-KKSFZXQISA-N 462.514 0.756 50 20 JCGD O=C(CNC(=O)c1cccs1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350342 QUPJXFPPODYKSK-CQSZACIVSA-N 484.368 0.540 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1 1818693510 LEOHALNNSUUQMI-NSHDSACASA-N 473.515 0.210 50 20 JCGD COc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)cn1 1819402270 YMNILQJQGCXANY-MRXNPFEDSA-N 465.474 0.827 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800338 NFRATXTVTMJLQK-QWRGUYRKSA-N 476.515 0.929 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052292 SSASSKLTRMSBNE-VXKWHMMOSA-N 488.346 0.095 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055768 FAOGOADDZUCAOI-FQEVSTJZSA-N 464.331 0.407 50 20 JCGD O=C(O)C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829330213 CFBVJQCKFFLVPE-HTAPYJJXSA-N 477.901 0.126 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnccn3)C2)C1 1830546990 YWYUFBRYEFTVLX-KXBFYZLASA-N 455.353 0.897 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1831640387 LXJJFVCKCHJVRY-KKSFZXQISA-N 454.955 0.999 50 20 JCGD Cc1nn2cc(CC(=O)N3CCO[C@]4(COCCN(C(=O)CO[Si](C)(C)C)C4)C3)nc2s1 1832109962 VYFRADKMYFRSHJ-HXUWFJFHSA-N 481.651 0.950 50 20 JCGD CNC(=O)CC(=O)NC1CCN(C2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CC2)CC1 1833439481 KGIMJHFHTAIDEA-UHFFFAOYSA-N 489.529 0.841 50 20 JCGD CC(=O)N(C)CCC(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1833670132 UWVWFGKFAHGBIA-WPWMEQJKSA-N 487.605 0.560 50 20 JCGD Cc1cc(C)n(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1833838994 ZFYXGBPWUOSRIN-UHFFFAOYSA-N 482.589 0.384 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn(C)c1)CCO2)NC(=O)NCc1ccccc1 1833854536 GLHVAUYWWLNHHO-RUZDIDTESA-N 498.584 0.441 50 20 JCGD Cn1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n1 1833877608 HNLPEYFRNYRXKS-XOBRGWDASA-N 486.957 0.017 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncccn3)CCO2)C1 1834290588 BWLRQUBLLWBJJJ-YCRPNKLZSA-N 483.953 0.679 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc4[nH]ncc4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798648 UTWICTUHEYJTOK-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834824780 MJHUHKMRZKYPJI-GOSISDBHSA-N 464.357 0.753 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835122861 ZEYAINFIFHSQRO-DCMOEJRUSA-N 487.605 0.559 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cccn4ccnc34)CC2)CC1 1835577668 GSXJWCYIOLLSOS-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD CN(CC(=O)NC1CCN(C2CCN(C(=O)c3nc[nH]n3)CC2)CC1)NC(=O)NCc1ccccc1 1836344113 XYUZJJWFELUWTI-UHFFFAOYSA-N 497.604 0.336 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836728105 HYGZJFOUTCDGHQ-NRFANRHFSA-N 472.590 0.782 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837171318 JIYNBPHYAFSPPK-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccoc4c3)C2)C1 1837457471 DFKDXUIAULZPPB-QHCPKHFHSA-N 480.481 0.210 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)sc1C 1837459699 MIMJZMKEHSOPCJ-OAQYLSRUSA-N 474.543 0.142 50 20 JCGD CCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837460151 WHSMDIMQFBTJMI-DEOSSOPVSA-N 467.526 0.631 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1 1837713075 FXDBTAQINZIUGU-QFIPXVFZSA-N 461.591 0.852 50 20 JCGD COCc1c[nH]c(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1837921211 MSJFEQSFUGYGSJ-UHFFFAOYSA-N 469.347 0.767 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838110712 DQHLYZCNGVOCOI-HNAYVOBHSA-N 462.330 0.803 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1838471479 PWEUFRRGLIHJHQ-FOIQADDNSA-N 451.911 0.418 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C#N)cc(OC)c3)CCO2)C1 1838583507 HGPIULJIJXYLHH-RXVVDRJESA-N 451.907 0.891 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)C2)C1 1839143242 PTGIXTMPDAXOJH-GAJHUEQPSA-N 493.992 0.495 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1839151509 UUGAPRIZEWBIAS-OALUTQOASA-N 494.397 0.791 50 20 JCGD O=C(c1c(O)cc(O)cc1O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839373018 RYGZHWOASMPUMG-WMLDXEAASA-N 463.256 0.564 50 20 JCGD O=C(c1nc[nH]n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839801956 ISGAUPQQOULTJE-OXQOHEQNSA-N 478.347 0.881 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3C1)CCO2 1839992324 FVLHDXPEHWDMPZ-FNZWTVRRSA-N 493.564 0.560 50 20 JCGD O=C([C@H]1C[C@@]12C(=O)Nc1ccccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1840017147 AGGVGDOYUAVUDI-VBGDYPAJSA-N 451.882 0.887 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS(=O)(=O)c3ccc(C)cc3)C2)C1 1840151422 AZXMSKSCXLITSO-NQIIRXRSSA-N 488.990 0.479 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(=O)OC)nc3)C2)C1 1840152217 BDGPTZJQJSNZOT-QRWLVFNGSA-N 455.895 0.192 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1840153611 VGDVNZYKYJUMIL-VLIAUNLRSA-N 456.927 0.249 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1 1840184832 FXJZOEVFGGCATR-JOCHJYFZSA-N 495.508 0.106 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840189371 NVZNLSBJMPPZJI-IBGZPJMESA-N 484.377 0.788 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1 1841924610 GZALGQVLMWJZBE-QWHCGFSZSA-N 462.931 0.386 50 20 JCGD COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)nc1Br 1843011793 TZEWZLDGLRRYJJ-UHFFFAOYSA-N 474.120 0.663 50 20 JCGD O=C(c1ccc2nnc(Br)n2c1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013449 MMKJGZXLNVGGGT-UHFFFAOYSA-N 484.119 0.302 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(Br)cn1)C2 1844264518 AQAMZUBORSSQNE-UHFFFAOYSA-N 459.304 0.973 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1845128989 LFOGOTSMKLVBQX-SFHVURJKSA-N 471.363 0.831 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)CC1 1847146456 TWJGBUYSTJJMMO-UHFFFAOYSA-N 458.519 0.559 50 20 JCGD O=C(CCNC1=NS(=O)(=O)c2ccccc21)NNC(=O)c1nn(-c2ccccc2)cc1O 10159907 HMOOCMGWHPREHA-UHFFFAOYSA-N 454.468 0.468 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)CNC(=O)c1ccccc1I 725902913 XGCBTFBCMVJIDA-UHFFFAOYSA-N 470.223 0.191 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NN(C)C(=S)NCCCOC)CC2=O)cc1 726077262 TZZAJIBYIMWJTA-INIZCTEOSA-N 499.659 0.944 50 20 JCGD O=C(COC(=O)[C@H]1CCCN1C(=O)OCC(F)(F)F)NNC(=O)[C@@H]1COc2ccccc2O1 728345782 QWYMOEHNWRIRFZ-RISCZKNCSA-N 475.376 0.680 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1 729275170 MOBUTRKAGUGWKS-LLVKDONJSA-N 474.948 0.840 50 20 JCGD Cn1[nH]c(Br)c2c(=NCCNC(=O)NNC(=O)c3ccc(C#N)cc3)ncnc1-2 729624974 IEUJBOBKOYHYHI-UHFFFAOYSA-N 458.280 0.427 50 20 JCGD O=C(COC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)NNC(=O)c1ccc([N+](=O)[O-])cc1 730619202 DDJNEJGVZDCRLU-MRXNPFEDSA-N 484.421 0.723 50 20 JCGD O=C(COC(=O)CN1C(=O)CCOc2ccccc21)NNC(=O)[C@H]1COc2ccccc2O1 749689747 VGPOPQBJGOSRFZ-GOSISDBHSA-N 455.423 0.333 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1OC 768290379 DKWZNFDJUNRSAN-UHFFFAOYSA-N 451.501 0.825 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1ccc(COc2ccccc2)o1 912952910 HHHVQUPKTYZHKH-CABCVRRESA-N 461.496 0.655 50 20 JCGD C[C@H]1CCCN(C[C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 919914210 CXGDTJLINSCHRZ-IRXDYDNUSA-N 467.592 0.772 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cc2NC1=O 1779032684 RQYTYXJKAOULAR-BSEYFRJRSA-N 494.508 0.162 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032868 YXCJBYFIVXEMIO-HSZRJFAPSA-N 492.496 0.196 50 20 JCGD CCc1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)s1 1779547970 TWQGCICIIZZZHI-XMSQKQJNSA-N 457.361 0.827 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3cnc[nH]3)CCO2)C1 1780097433 ZQNUNTZRLGRUSU-OAQYLSRUSA-N 457.443 0.929 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@]1(C)CCCN1)CCO2)NC(=O)NCc1ccccc1 1780968306 IFKBJMBDUWOJOV-RPWUZVMVSA-N 472.590 0.305 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1782049573 MEBPTMSLNWUKPM-HSZRJFAPSA-N 482.302 0.098 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3ccncc3=O)C2)C1 1782664622 MMGJGHACYQVRAI-AKMURLTLSA-N 469.448 0.959 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)CCO2)C1 1783531950 GJRJWSSPQPHZIZ-BTYIYWSLSA-N 494.390 0.635 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCCNC(=O)OC(C)(C)C)CCO2)C1 1783940190 WDVPJVIFVYPHQF-QFIPXVFZSA-N 469.583 0.494 50 20 JCGD 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C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1)[C@@H]1SC(=N)NC1=O 1789923021 QBGLUZURQVRSIT-SDONNHMOSA-N 465.345 0.459 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnnn3)C[C@@H]21)[C@@H](Br)Cc1ccccc1 1790779342 AKMXVNZZLAQYDZ-XSLAGTTESA-N 477.363 0.659 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)c1ccccn1 1791714297 FLAFRGKXZZVEBS-QIJLZVCCSA-N 452.515 0.477 50 20 JCGD CC(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1792612541 WFYCMAKVESTUJH-HATOLVCRSA-N 461.563 0.347 50 20 JCGD COc1cc(N2CCC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@@H](O)CCl)C4)CC2)ncn1 1793305543 LZFOSINFRXZCFN-YVSFHVDLSA-N 451.955 0.940 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)c2c1 1793968128 RISOGCHIGQNJGJ-NHKMSHSESA-N 461.327 0.602 50 20 JCGD Cc1nc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(C)s1 1794180407 VRXNSTFBMOSKKJ-HBCWATKFSA-N 458.544 0.204 50 20 JCGD 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CN(C)c1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1840314879 RMPUIGAPDFNCDO-AREMUKBSSA-N 495.385 0.135 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1840789910 IYDHJHLPQGEBIP-VQIMIIECSA-N 495.381 0.413 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)C[C@H]2C[C@H]21 1847573115 PIRDMNCIJWOMHB-DABHTEOTSA-N 469.347 0.580 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc(C)cc2)n(C)c1 18396396 XRKYQPGNLMMMPB-UHFFFAOYSA-N 450.517 0.982 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc(C)c(OCC(=O)O)c2C)cc1 726154932 CRGYVXBVSNMQRB-UHFFFAOYSA-N 499.567 0.705 50 20 JCGD Cn1c(=O)n(C)c2cc(S(=O)(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc21 747692299 JXTFKYQMAIOCOA-UHFFFAOYSA-N 493.567 0.285 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)OCC(=O)NNC(=O)c2cccs2)C1 760982203 NXYDYLMSNQSUNC-CYBMUJFWSA-N 470.529 0.758 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C 904226050 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O=C(CNC(=O)c1ccco1)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1 725739219 AHAFYIBDWYBINV-ZDUSSCGKSA-N 484.918 0.581 50 20 JCGD COCCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1 726863628 ZMNQJRLTAAKNKJ-UHFFFAOYSA-N 468.557 0.809 50 20 JCGD CC(C)Oc1ccc(NC(=S)NNC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)cc1 727497426 QJIQBPWEGBLOTE-CQSZACIVSA-N 467.573 0.957 50 20 JCGD CN1CC(=O)N(CC(=O)NNC(=O)CCN2CCN(C(c3ccccc3)c3ccccc3)CC2)C1=O 747472093 VBMRXBZYIPOIJR-UHFFFAOYSA-N 492.580 0.825 50 20 JCGD COc1ccc(C(=O)NNC(=O)CNC(=O)c2cccs2)cc1S(=O)(=O)N1CCCC1 751211819 VQQCQVWVVNEHQI-UHFFFAOYSA-N 466.541 0.732 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCCCC2)c(C(=O)NNC(=O)CN2CCCC2=O)c1 751616870 HXLAIEMHIJDUNW-UHFFFAOYSA-N 451.549 0.311 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCC(=O)NNC(=O)c2cccs2)cc1 849120005 JIWCWWWVRISZHU-UHFFFAOYSA-N 468.513 0.331 50 20 JCGD O=C(c1cc(S(=O)(=O)NC[C@H]2CCCO2)ccc1Br)N1CC[C@@H](B(O)O)C1 864232672 AXSNEWPFZQTQCK-VXGBXAGGSA-N 461.143 0.595 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)[C@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)cc1 912953124 PQIVLIBDYUZUFY-ILXRZTDVSA-N 453.517 0.036 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1C 916561802 GVYBDCWHVJKTNA-UHFFFAOYSA-N 480.568 0.714 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCC[C@@H]1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919886378 RPCAWWJSBLWPOD-TZMCWYRMSA-N 458.924 0.471 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 920077326 VHEOETYMMSBZSD-ZDUSSCGKSA-N 477.634 0.713 50 20 JCGD COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNC(=O)NCc2ccco2)CC1 920856417 HFLPFWKQXORPBM-UHFFFAOYSA-N 464.500 0.998 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNC(=O)c3cc(Cl)ccn3)cc2)CC1 1318242430 JDTHCCPJTSFXBR-UHFFFAOYSA-N 466.951 0.544 50 20 JCGD CCn1nc(C)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1777842487 QTYYIONMPSNYID-NFBKMPQASA-N 454.336 0.333 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1noc2c1CCCC2 1777865329 JSPQHDHMOLBFDG-HYBUGGRVSA-N 467.331 0.675 50 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COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(c4cc(OC)ncn4)CC3)CCO2)C1 1783871056 MHHLAJYYKPTJEN-VGOFRKELSA-N 481.981 0.785 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc4c(c3)OCO4)CCO2)C1 1783934028 SUNUHDUMHRAPEP-QHCPKHFHSA-N 460.531 0.551 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1=NO[C@@H](c3ccccc3)C1)CCO2 1783935282 PMEOWDIFBSPGKB-XXBNENTESA-N 457.531 0.707 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784093529 AJSCTJMTIWNANJ-GVRJEKJASA-N 491.969 0.022 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1784156683 PSNNWHOEJVPQMB-DEOSSOPVSA-N 481.509 0.158 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1784186346 OXFWTZJNGBYYGE-JZKQVHKSSA-N 459.927 0.342 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1785606903 JFJHXSPQFMUNRT-QKKBWIMNSA-N 474.986 0.850 50 20 JCGD 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NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1noc2c1CCCC2 1796153101 CIAFQYGXFXFONP-IVWMJMPLSA-N 454.487 0.069 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796445748 IVLNKPVGFMKCRZ-CFAUTMRTSA-N 485.541 0.465 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)n1ccnc1C)C2 1796446445 XAVXMKMGYYZMCK-SHBUVVKZSA-N 455.519 0.476 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cn2ccc(Cl)cc2n1 1797105551 GMEALRNOZIKIIR-YVWYUNDQSA-N 468.706 0.185 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(N2CCCC2)c(F)c1 1798559953 WMUDGWNFWUCUCV-BBIADKPPSA-N 481.333 0.623 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnnn1C)C2)NC(=O)NCc1ccccc1 1799865891 PGYQFAZPOWDAMX-BCDXTJNWSA-N 454.535 0.413 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799869329 HKKQRRFSQPIALI-WOZUAGRISA-N 488.589 0.122 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cnnn1)C2)[C@H](Br)Cc1ccccc1 1800436208 RAFFHUYNANTMOV-KYHPRHEASA-N 463.336 0.269 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2 1800980484 BDAIHSQFMIZOLO-VPEYGQHGSA-N 475.970 0.202 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)C2 1801013007 PUJZNZYOHMKTRX-JDCJZRKESA-N 493.605 0.062 50 20 JCGD CCS(=O)(=O)CC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1803514165 HFLZEVPNUMDXJG-YVIKVBFHSA-N 488.570 0.656 50 20 JCGD COc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1806038644 JTRJIMFQPAOLFD-UTKZUKDTSA-N 461.287 0.193 50 20 JCGD CCOC(=O)/C=C/C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1806293130 LJKLIOULCOVQJO-BDWJNYAHSA-N 451.288 0.200 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1)C(=O)C(=O)O 1806346163 APMASHBERZRMLW-BBRMVZONSA-N 455.309 0.415 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359930 FSDKDKXWZGKNPL-XLIONFOSSA-N 474.282 0.519 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374081 IFOJEFMNTBWDBB-GUMYABAYSA-N 451.332 0.632 50 20 JCGD Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)s1 1807534796 VTYABJZXYXXUDH-MGPUTAFESA-N 480.554 0.802 50 20 JCGD CN1CCN(C2(C(=O)NC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)CC2)CC1 1807950104 KIJRWHHBGXUDKD-NZQKXSOJSA-N 485.633 0.240 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Cl)[C@H]2c2cccnc2)n(C)c1=O 1808309922 UEZOQSATNJLHTE-FRFSOERESA-N 491.911 0.069 50 20 JCGD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc(O)n1 1808334425 XUVUZVWFISIUTB-GCJKJVERSA-N 460.299 0.804 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)Cn2ccncc2=O)[C@H]1c1cccnc1 1808416291 LDXUYKDJHHFNOZ-IYXSTTPGSA-N 490.524 0.478 50 20 JCGD Cc1ncc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1810298596 KEXFJRHWJTUMMA-UZLBHIALSA-N 460.498 0.812 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1815104598 SOOLXYRWHHUCHR-BLLLJJGKSA-N 456.507 0.629 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)Cc1ccccc1)CC2)c1ccc(B(O)O)cc1 1815348570 PSCFKSAEXZEQIG-IEBWSBKVSA-N 465.340 0.652 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cn3cc(Cl)cn3)sc2C1 1815416387 KHHYCARALWNMPY-LBPRGKRZSA-N 453.956 0.978 50 20 JCGD COC(=O)C12CC(C(=O)N[C@H]3CCc4nc(NC(=O)c5cnccc5C(=O)NN)sc4C3)(C1)C2 1819800031 JRDXUHNCTZNWGI-DAJNEVHCSA-N 484.538 0.711 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1820073923 SRMQADHMKLDQCI-NWDGAFQWSA-N 469.531 0.295 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1)[C@@H](F)Br 1820932260 FHTSGZZDXHMXQA-JOYOIKCWSA-N 456.209 0.817 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3nc4ccc(F)cn4n3)sc2C1)c1ccc(B(O)O)cc1 1824390523 UVZLDOWTNBEIFE-AWEZNQCLSA-N 480.290 0.544 50 20 JCGD O=C(CNC(=O)C(F)(F)F)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827055204 SANYFSHMYWAXED-KRWDZBQOSA-N 469.269 0.278 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726038 NQLXSSKMIPKGAD-HRAATJIYSA-N 477.986 0.738 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732010 OVNHMNVVWHEMMI-KXBFYZLASA-N 462.330 0.803 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1830732826 BKFZBVXIKAEMSN-UTKZUKDTSA-N 454.907 0.533 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@H]1O)CCO2 1830818611 IPAFWYBMXWIYRW-JPAWQOSXSA-N 452.935 0.339 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](COC)NC(C)=O)CC2)CC1 1835844764 BNAQAOZHZLCPBX-ROUUACIJSA-N 475.428 0.883 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(F)(F)F)c[nH]3)C2)C1 1835936758 BSKALKBYIPVHNJ-FQEVSTJZSA-N 481.236 0.097 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)c1 1836714894 AMNCDUDDQWCQAS-SFHVURJKSA-N 473.979 0.697 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2c1 1836925240 LZPXCWPOIDMELY-DEOSSOPVSA-N 487.557 0.620 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3nncn3c1)CCO2 1837015233 JXERJHKTHQIPIL-GOSISDBHSA-N 452.309 0.584 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1837254662 JCNHIUXPJVNYQC-UHFFFAOYSA-N 494.357 0.646 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1839143709 GFLROBRBMXNGPY-GEYWLOKFSA-N 489.997 0.831 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)c12 1839557408 YMZKGKLVEIMNNV-RUZDIDTESA-N 493.325 0.240 50 20 JCGD O=C1CC[C@@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)N1 1839801937 IOLUXFMWDDVFPX-KGVIQGDOSA-N 494.386 0.728 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1839964140 IJDSQDZRODOKGB-LIRRHRJNSA-N 472.336 0.639 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1ccc(O)cc1 1840185831 YBGLRVYJCZCOLO-SBUREZEXSA-N 462.547 0.325 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840186564 KWRVCSJXPGBILB-ORAYPTAESA-N 484.377 0.522 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1840908619 CUCGATQSPQSTBW-AUSJPIAWSA-N 461.918 0.894 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@@]21C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012425 NTDKROUEZNMWTI-XDHUDOTRSA-N 469.347 0.583 50 20 JCGD CN(C(=O)OC(C)(C)C)c1cc(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)n(C)n1 1843013749 ILGXKQSWQCUXNI-UHFFFAOYSA-N 497.361 0.602 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)c1ccc[nH]1)C2 1843428806 RBZRMVZCZZMWTG-FQEVSTJZSA-N 496.373 0.648 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccc(F)cc1 1845006229 NRMDVMBEXSAYPV-IBGZPJMESA-N 468.489 0.519 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039003 STCMMVRQCXJYFD-SFHVURJKSA-N 472.590 0.841 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1847132180 RMIOMSLTGYBSAX-ROUUACIJSA-N 475.326 0.531 50 20 JCGD Cc1cc(NC(=O)CSCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)no1 16593807 ZORKIANYXCZWCL-UHFFFAOYSA-N 455.518 0.366 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)N2CCc3ccccc32)c1 16785611 SIYWSERDWGQCCN-INIZCTEOSA-N 463.537 0.634 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 729273928 BFMNETLFRQIHKE-PWSUYJOCSA-N 450.439 0.139 50 20 JCGD CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)[C@H]1c1ccccc1OC 729275099 KYLGMOPHTKBLNZ-URLQWDBASA-N 468.576 0.860 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cc3ccccc3F)c2)CC1 731329835 UQLGUVJKKDEWCN-UHFFFAOYSA-N 462.503 0.682 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cnc3c(c2)c(C)nn3CCO)cc1OC 749411042 XQJMIHPJRIVCIN-UHFFFAOYSA-N 457.443 0.367 50 20 JCGD CO[C@@H](C)CC(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 749567039 FEFQXMDSPILIBZ-INIZCTEOSA-N 470.530 0.636 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(NS(C)(=O)=O)c2)cc1OC 844773674 SNHFSJSHHGLHKY-UHFFFAOYSA-N 451.457 0.693 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)OCC(=O)NNC(=O)c3cccc(Cl)c3)cc2)CCN1 914667872 JTGMMUVYJSBSDG-UHFFFAOYSA-N 494.913 0.079 50 20 JCGD Cc1n[nH]cc1CCCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916259435 GQYWUALSHCGUPZ-UHFFFAOYSA-N 478.575 0.635 50 20 JCGD CCn1nc(C(=O)NNC(=O)Cc2c(C)[nH]c(-c3ccncc3)nc2=O)c2ccccc2c1=O 917915576 OPMVLNKEVKQUHP-UHFFFAOYSA-N 459.466 0.874 50 20 JCGD COc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N1CCCCCC1 919886937 XWFLREMUUWEOFB-HNNXBMFYSA-N 488.588 0.391 50 20 JCGD O=C(NNC(=O)N1CCN(C(=O)Cc2ccccc2F)CC1)c1csc(N2CCOCC2)n1 921199476 JQELWUSICMEZBL-UHFFFAOYSA-N 476.534 0.860 50 20 JCGD COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)CC1 1317732279 OZKUOAULTCOYLU-MRXNPFEDSA-N 487.600 0.366 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CCCC3)C1 1777878855 ZRXBTGAZDPQOOD-WZONZLPQSA-N 460.579 0.789 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1778057918 UKYVUMFTASKERT-JOCHJYFZSA-N 468.706 0.425 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1 1778665937 AFYKXYODMUTPEI-NMWDDECMSA-N 453.503 0.407 50 20 JCGD CCOc1ccsc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029621 VYMFGRWNPMDQKX-NRFANRHFSA-N 459.528 0.903 50 20 JCGD O=C(C[C@H]1CNc2ccccc2O1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779302835 CTQSPYVIWRVZNI-VAPDBKPJSA-N 493.369 0.757 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)cco1)C2 1779370989 CQHNNOUBBQZZRK-XMSQKQJNSA-N 455.471 0.080 50 20 JCGD Cc1nnc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)s1 1779371097 CZEZMPWWVKHTOZ-VGOFRKELSA-N 487.586 0.605 50 20 JCGD COCc1c[nH]c(C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c1 1780078379 ROQNPJLLBSARDD-RUZDIDTESA-N 498.584 0.951 50 20 JCGD Cc1cc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nn1C 1780970030 QSEDGHSLRTWCHY-RUZDIDTESA-N 497.600 0.447 50 20 JCGD COc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1C 1782210753 HBSAPXYEKLRHRU-WZONZLPQSA-N 461.563 0.899 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C[C@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 1782869939 KKVCAWLMKWGSFY-HOYKHHGWSA-N 495.621 0.979 50 20 JCGD COc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc(OC)c1OC 1784086656 ZDHRCUVIQGUBOY-GGXPGOJBSA-N 470.950 0.834 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)cn3)[C@H]2C1)NC(=O)NCc1ccccc1 1786199186 PJHPRROCMSKBMY-ZJOUEHCJSA-N 483.573 0.360 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3cccc3C=O)[C@H]2C1 1786994242 VBOKSJSGEWOLMO-HNTLRFHGSA-N 482.541 0.975 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1 1788762529 ZZZORJMBKARAMM-GCPWLZLNSA-N 491.661 0.997 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C[C@@H]21)[C@H](F)Br 1789924739 CWZQJTIDIXCBTB-UHXUCMFUSA-N 475.271 0.427 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C[C@@H]21 1791057351 SUSUQGUNMOCQLS-DSPQJCBJSA-N 474.377 0.862 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c(-n2nccn2)c1 1791290709 MXEQWPKKSRYJJZ-CUWPLCDZSA-N 483.573 0.542 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C[C@@H]21 1791291571 ZWWQXHCETUTGFB-ZWOKBUDYSA-N 469.546 0.438 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3ccc(C)cc3)[C@H]2C1 1792253442 ZLRQUGYMUPRFQJ-VJANTYMQSA-N 451.951 0.958 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1793317781 JWEVJHMRBQLHKX-CZXMPRJFSA-N 496.536 0.789 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csnn1)NC(=O)NCc1ccccc1 1793499780 OPSMFNYTGWQVSZ-HGKCTWBKSA-N 473.559 0.088 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)C2)c1ccc(B(O)O)cc1 1795732876 OIOIASNNUREKMK-YNKYUYGSSA-N 470.281 0.652 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=NO[C@@H](c3ccccc3)C1)C2)c1cccc(B(O)O)c1 1795739064 NFLNVBTYMMGYQU-GMQQQROESA-N 463.299 0.087 50 20 JCGD C[C@H](N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)C1CC1)c1ccccc1 1795740750 KVYQOLOMUXPWLD-USDRJLJOSA-N 491.397 0.699 50 20 JCGD CN[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C(=O)O 1796089083 TURHBQKLZQDCBS-KHMAMNHCSA-N 460.959 0.819 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(CCN2CCCC2)nc1 1796189239 OQKNUYHPNVFNIE-BKFWDETESA-N 476.386 0.965 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1 1797282432 PXSJPRADJJNTHW-QIEVIBBNSA-N 499.584 0.298 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(OC)c(O)cc1[N+](=O)[O-] 1798594789 LEMRPGFWOMCLIM-QTFJUKGGSA-N 457.867 0.766 50 20 JCGD Cc1nnc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN(C)NC(=O)NCc2ccccc2)o1 1799871659 SXUVGJOVVGQYQP-REPLKXPHSA-N 469.546 0.905 50 20 JCGD CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1800861937 UNCLHWMFYJMLAR-BMQTXXJKSA-N 497.637 0.888 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)OC(C)(C)C 1801244650 AXNUMSHGWDURKF-QKGUJMCYSA-N 499.996 0.689 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C2=NN(C)C(=O)CC2)[C@@H]1c1cccnc1 1804119489 IHSPDXFERZDCEC-HBSVRTSBSA-N 492.540 0.830 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1)c1cc(=O)n2[nH]cnc2n1 1807358543 KIRYHRDYQTUTTJ-FZMZJTMJSA-N 450.286 0.936 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1 1807359535 VVVLXVMPZPXWFB-GHJWDPDVSA-N 474.319 0.916 50 20 JCGD COc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1OC 1807360177 HWFPLOZCMHTJLD-GCJKJVERSA-N 490.325 0.807 50 20 JCGD Cn1c(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cccc1=O 1807362295 JZBAMHLKVSGODC-XMSQKQJNSA-N 460.299 0.094 50 20 JCGD Cc1nnc(CC(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)s1 1810101831 UYUNTAIKCXLDLG-UHFFFAOYSA-N 457.560 0.933 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@H]1c1cccnc1 1810308168 JWTJRUYWNOXBQN-IERDGZPVSA-N 476.497 0.269 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1810793407 AUXURQRIXRMYFL-IBGZPJMESA-N 456.377 0.238 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1814126489 MAMXFDMVGGYFQL-YYWHXJBOSA-N 481.557 0.705 50 20 JCGD Cc1nn(C)c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1F 1816244195 WIFWQWFJUXANTH-INIZCTEOSA-N 454.271 0.890 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2CCOCC2)n[nH]1 1817179936 PNWGRHMUAWZBGJ-SFHVURJKSA-N 470.534 0.436 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc4n(n3)CCC4)sc2C1)c1cccc(B(O)O)c1 1819282348 ASGXXHFQXAKDIH-AWEZNQCLSA-N 451.317 0.505 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819404486 NQXONQPTBIKCJD-OAHLLOKOSA-N 463.520 0.149 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793497 OQUDJGULCCTLRI-GFCCVEGCSA-N 473.559 0.530 50 20 JCGD CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CC(=O)NC1=O)CC2 1825440825 GNAZOLDPMXHZQQ-DTWKUNHWSA-N 458.338 0.780 50 20 JCGD O=C([C@H](O)CCl)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1 1828550855 DSOXYDYMGVJEAP-UEHPKLIBSA-N 491.972 0.931 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3ncnn3c2)CC1 1828733491 IYVBAEDVIVKWKI-NRFANRHFSA-N 461.331 0.956 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccc(Cl)cc1 1830259838 BONVKHSOJWUOLX-OSPHWJPCSA-N 486.761 0.894 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCN1C)CCO2 1830770376 WYIVQSXKFSZPKE-GGTDSNQQSA-N 474.562 0.061 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCN(C(C)=O)CC3)C2)C1 1831650132 DKDJLBVWVKESTG-GHTZIAJQSA-N 458.987 0.014 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)CC1 1831829940 DMMXLXUTUBWVLJ-HOCLYGCPSA-N 450.927 0.905 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2 1832227482 XQXMKLPXDNDMTG-CVDCTZTESA-N 471.489 0.466 50 20 JCGD O=C(Cc1ccc2c(c1)CCC2)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832504203 NYNHGTCAFGPJLX-AREMUKBSSA-N 478.354 0.168 50 20 JCGD Cc1cn(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)c(=O)nc1O 1832775924 LCMJEMCPDDSYRN-GOSISDBHSA-N 476.578 0.250 50 20 JCGD O=C(NCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1ccc[nH]1 1832877934 ORCKSYSZWGPTMT-CRAIPNDOSA-N 475.315 0.282 50 20 JCGD CN(CC(=O)N1CCC([C@@H]2CCCCN2C(=O)CNC(N)=O)CC1)NC(=O)NCc1ccccc1 1832939256 AMHSDVGSHXZMMG-FQEVSTJZSA-N 487.605 0.621 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccnc3)CCO2)C1 1833099315 QTFJMSLDUJOCKS-AIHDCSCUSA-N 480.525 0.685 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)n2)CCCN1 1833724200 LUFMNUYXRXIULZ-NQIIRXRSSA-N 483.928 0.012 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797865 FSZOGDFNVRAUJT-GOSISDBHSA-N 479.390 0.447 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801498 PUHGNMGCNMDWPR-GOSISDBHSA-N 467.379 0.084 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1 1834820238 RTEONTRTXHYJLL-AZUAARDMSA-N 471.348 0.970 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccccc1Cl)CCO2 1835013956 NILGFPSBFPRPTO-JOCHJYFZSA-N 466.966 0.712 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@@H]1Cc2ccccc2CN1 1835058542 PDJWHKWWGFJAOY-VWLOTQADSA-N 490.413 0.266 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3snnc3C3CC3)CC2)CC1 1835245954 YVUFYMQEOLAKTE-UHFFFAOYSA-N 477.635 0.974 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1835843210 MSCPIWXONGDGAY-KRWDZBQOSA-N 461.401 0.494 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835941527 NFLHDRCMUMBJMJ-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2 1837297442 UOMVYYKFPPAXQE-MOPGFXCFSA-N 458.298 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1 1837457105 XUGGZURJGJSKIK-NRFANRHFSA-N 481.500 0.581 50 20 JCGD CCCOc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837460036 QXOHEHUCAPFJGE-RUZDIDTESA-N 497.552 0.858 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1F)CCO2 1839095893 UIMDCKIBCLXLBV-LDNFRZNASA-N 463.934 0.933 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1 1839966432 DJZQOKYYEREVFP-NJSLBKSFSA-N 494.383 0.459 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C3CC3)C2)C1 1840152692 PVUBLSMCHAXHOV-PNLZDCPESA-N 489.997 1.000 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1840314761 JRXMOEDQJGHRFU-AREMUKBSSA-N 495.385 0.135 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840881622 ZTROLAXVGIPSIO-ZTMHYXLHSA-N 470.906 0.527 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010389 LIDCIGWSSCGXDK-UHFFFAOYSA-N 450.300 0.603 50 20 JCGD O=C(CN1C(=O)COc2ccc(Cl)cc21)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013038 ATSXVKQWFITGAB-UHFFFAOYSA-N 483.717 0.262 50 20 JCGD Cc1nn2cc(CC(=O)N3CC4(CCCN4C(=O)c4cnccc4C(=O)NN)C3)nc2s1 1844263580 SDKPMEDXNGUWRR-UHFFFAOYSA-N 454.516 0.157 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1 14850712 LVKDUSDLTVPAPJ-SFHVURJKSA-N 499.567 0.247 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CN2C(=O)CCOc3ccccc32)ccc1Cl 726152445 ONHJEHUFEMNBFY-UHFFFAOYSA-N 452.876 0.564 50 20 JCGD COC(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1 726717015 JUSLTXKIDKZWTK-OAHLLOKOSA-N 453.521 0.646 50 20 JCGD NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1Cl 728343125 PVPKOPYJECFNKN-AWEZNQCLSA-N 469.859 0.132 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1sccc1S(=O)(=O)N1CCSCC1 728846162 SUIPRDKEOGBRCK-UHFFFAOYSA-N 496.640 0.953 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1cc(Cl)ccc1Cl 729274905 HCYVGYZIHHCGRM-RNCFNFMXSA-N 451.332 0.683 50 20 JCGD CCN1CCN(C(=O)CC2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)CC1 731214964 YWPOMFYBSDUCSY-UHFFFAOYSA-N 460.535 0.622 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1 744447385 FMXFAVUCXXXDEM-XMMPIXPASA-N 463.494 0.838 50 20 JCGD CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)C(=O)N1CCCC1 748246304 IIAPKWRMNHELPG-DKGMDFAASA-N 454.574 0.468 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)[C@@H]3Cc4ccccc4O3)n[nH]c2n1 748273438 GNQJZNDWGRKTEA-ZDUSSCGKSA-N 457.520 0.048 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1 749561803 RJCQSIZASGWCDU-QGZVFWFLSA-N 488.522 0.731 50 20 JCGD O=C(COC(=O)Cn1nc(-c2ccc(F)cc2)oc1=O)NNC(=O)[C@H]1COc2ccccc2O1 749733289 NEWYFFJVFGYCIY-MRXNPFEDSA-N 472.385 0.173 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)c2cc(O)nc3ccc(S(=O)(=O)N4CCOCC4)cc23)n1 788697303 MSBKPIZBUVSQDI-UHFFFAOYSA-N 488.526 0.236 50 20 JCGD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)NNC(=O)c1ccc(COc2ccccc2)o1 807137993 KFBNADUTSNBNBX-OAHLLOKOSA-N 478.527 0.838 50 20 JCGD COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)c1csc(N2CCOCC2)n1 916104727 QWMCZGDMOALGMN-UHFFFAOYSA-N 455.518 0.570 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc1C 916562108 LPCRHCGPPJKXHW-UHFFFAOYSA-N 478.502 0.863 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C)c2ccccc2c1=O 916622273 FERXGMCPSFFCHA-UHFFFAOYSA-N 452.537 0.639 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1 916725607 OSAFFHFIWHRTER-UHFFFAOYSA-N 476.555 0.780 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1)N[C@@H]1CCS(=O)(=O)C1 919883821 CYZIQYQGNLIILE-OAHLLOKOSA-N 452.514 0.619 50 20 JCGD CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)CC2)cc1 919885822 RXFNBTVJTANLHJ-KRWDZBQOSA-N 486.616 0.728 50 20 JCGD O=C(NNC(=O)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1)N[C@@H]1CCS(=O)(=O)C1 919889373 LPKQDPAVLSOFCU-CQSZACIVSA-N 477.524 0.379 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=S)NC1CCN(C)CC1)N(S(C)(=O)=O)CC2 920307827 PLAPBALMMZEZOX-QGZVFWFLSA-N 499.659 0.542 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1cc(S(=O)(=O)N2CCCC2)ccc1Br 920435543 IYTZOLFYHDIIKV-UHFFFAOYSA-N 473.349 0.617 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)CSc1nnc([C@H]2CCS(=O)(=O)C2)n1C 1317736492 DGTWTTKLKMUDTE-JTQLQIEISA-N 473.964 0.933 50 20 JCGD O=C(C1=NO[C@@H](c2ccccc2)C1)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1778174443 ZZZLFFWHKRMFJI-QPPBQGQZSA-N 463.299 0.328 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc4cc(F)c(F)cc4[nH]3)C2)C1 1778402180 WAZPDYWKAUFGSN-HSZRJFAPSA-N 469.253 0.883 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ccncc23)C1 1778683330 DNTPXNAALNXACI-BMIDIIHHSA-N 492.540 0.991 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3nccnc3C(N)=O)C2)C1 1779878880 JCYBKYRQVHATOD-JOCHJYFZSA-N 498.452 0.166 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc(Br)c(O)c3)C2)C1 1781697255 POWLNMBTLJIIEJ-NRFANRHFSA-N 489.131 0.592 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2 1783933832 HYLAIWQINHSHEX-OAQYLSRUSA-N 455.556 0.056 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)n3cnnn3)C2)C1 1784599686 WRQKUCSIXYCRRS-RBZFPXEDSA-N 473.446 0.211 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(N)=O)C2)C1 1785629837 BBEGYXJXAVAYJV-ULXKQSRTSA-N 476.331 0.854 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786984358 HZXOQWDYGNYVGK-VJBMBRPKSA-N 466.343 0.601 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Cl)COC)C[C@@H]21 1787471982 ZFQMEOJVNORQQC-KSWRQPAISA-N 477.986 0.760 50 20 JCGD C[C@H]1Oc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)cc2NC1=O 1789260611 MULJQVSICHWHFH-YDODLJOBSA-N 451.907 0.599 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)[C@H]2C1 1790174360 ZGIUQGOPTXKNDK-SMSYFYOWSA-N 478.384 0.840 50 20 JCGD Cc1ccccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790936837 IWUJHNSEYKCLRF-PMVMPFDFSA-N 450.344 0.901 50 20 JCGD Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(C)n1 1791495589 HOQDYDFKSRGWIF-PMVMPFDFSA-N 465.359 0.604 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)C(C)(C)O 1792272227 MBXMZMGGTLCBJS-UVPYHEFZSA-N 477.986 0.230 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)CC1=O 1793872686 UQYZHYYPMWNZQZ-MTXNFPGFSA-N 499.612 0.619 50 20 JCGD CN(CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)C(=O)OC(C)(C)C 1795740617 CTNYVSFVDNXNQZ-RMFSNUHRSA-N 489.378 0.217 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nc3ccncc13)C2 1796440689 YEHAUVYEJMJKPW-FXOZFUDCSA-N 464.486 0.295 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799341908 ADVRSVGMHJMNKL-JGAAPJFWSA-N 486.338 0.446 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cn2cccc(Br)c2n1 1800004408 LPXZMJRYRCOOOV-JLUCKKNBSA-N 471.739 0.900 50 20 JCGD CCNC(=S)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1800188864 ITHHVWZDFSLESF-AHHPBITISA-N 477.537 0.945 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2 1800759774 HNUZWYZYXPXNEM-XYFZXANASA-N 478.384 0.635 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1800801595 OGVVBYODHJLUTM-XXUMUBMXSA-N 465.906 0.567 50 20 JCGD CN(C)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1805109665 WDRZZGJDUSUUPR-XXBNENTESA-N 473.342 0.856 50 20 JCGD CN(C)c1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)o1 1805340923 KECSJJSLADTQLQ-KXBFYZLASA-N 478.513 0.768 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C2CCOCC2)[C@@H]1c1cccnc1 1806703381 UOFOVHNMEHPRBU-PXNSSMCTSA-N 452.515 0.826 50 20 JCGD Cc1nnc(CCC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1 1807362864 MKFWSDNGZTZUSX-GCJKJVERSA-N 479.371 0.874 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807368420 TUFLKGIHCUGQSP-GBXCKJPGSA-N 475.358 0.674 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCN2CCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374107 IKGATCKIJZUHNM-OFNKIYASSA-N 450.348 0.567 50 20 JCGD COc1nccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1F 1807711080 IGVLJEZBZNSAJF-LAUBAEHRSA-N 478.289 0.938 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@H]2C[C@@H](O)C2)[C@@H]1c1cccnc1 1809505926 YWHRDSUBXIVCEY-ZMRCISECSA-N 452.515 0.992 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3nc4ccc(F)cn4n3)CC2)C1 1809980041 FKEPAZBTKHAKJW-UHFFFAOYSA-N 465.294 0.707 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303056 OZQOKZHDUCDYLM-JKTDJZPLSA-N 453.547 0.773 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810507850 JXUOWLMCVQKSLL-LDBYXDLTSA-N 481.557 0.705 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1C 1811140842 HRTWUJKEMLIGFU-AVRDEDQJSA-N 461.331 0.691 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CNC(=O)C(F)(F)F)[C@@H]1c1cccnc1 1813101523 QNZFKBKQKZEVQT-KSSFIOAISA-N 472.468 0.139 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1814169853 JEOLIQZFMAZBRV-UYAOXDASSA-N 467.331 0.670 50 20 JCGD O=C(CN1CCSCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1814414900 PCESJKIQYIRQDT-GOSISDBHSA-N 457.365 0.444 50 20 JCGD O=C(CNCP(=O)(O)O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2 1814770485 VZDHCHGJOXHBKY-LHLIQPBNSA-N 459.234 0.470 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)C[C@H](N)c3cccnc3)sc2C1 1815184585 NAWROQBIGVWRON-CABCVRRESA-N 459.576 0.913 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1ccnn1)CC2 1817282411 FPSNXYCZQDEPHY-SUZBBLJPSA-N 469.531 0.871 50 20 JCGD Cc1c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn2[nH]cnc(=O)c12 1817472052 DYNUEHAXXJOIAJ-GOSISDBHSA-N 489.301 0.354 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnc2[nH]ncc2c1 1818997366 WUEUKFKIQXXOOP-SFHVURJKSA-N 459.275 0.981 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=N)N)CC2 1821304808 SEHIDRIACNZSDI-SNVBAGLBSA-N 475.487 0.685 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc(Cl)cn1)CC2 1826085337 NEZAUVKLWNXFOH-GFCCVEGCSA-N 453.956 0.978 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnn3ccncc23)CC1 1828282491 WWWBTCUPGSEUHX-NRFANRHFSA-N 461.331 0.956 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830647690 XSSBCEJUGZSSEH-GHTZIAJQSA-N 453.898 0.837 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(C)n3)CCO2)C1 1830917332 MXFJEOHVMGXTLC-BYEYKRMRSA-N 482.541 0.523 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831650358 GSUNHBHEPRCHFE-OXJNMPFZSA-N 453.927 0.163 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832728548 NBYKNPMIEIPQTI-NRFANRHFSA-N 464.595 0.119 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1 1833451305 VCHJJWNWIBZVDN-KBPBESRZSA-N 481.457 0.669 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(=O)n3O)CCO2)C1 1833469118 ZXCIRHLMIREPKI-SCLBCKFNSA-N 458.309 0.187 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccsc1)CCO2 1833963246 IAQGOVYHSSPKMV-CPOKCXMASA-N 459.528 0.952 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc1 1834797476 MNQKUBQWWJPNJC-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccnc3S)CC2)CC1)c1ccc(B(O)O)cc1 1834798042 OEKBCGYGSNYETJ-UHFFFAOYSA-N 468.388 0.549 50 20 JCGD COc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1OC 1834801178 OYCVJWWKMHJCNE-UHFFFAOYSA-N 496.373 0.278 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)C1 1834819608 SBVASUVPXHGIEP-SPYBWZPUSA-N 461.353 0.817 50 20 JCGD O=C(CCc1ccccc1Cl)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835175311 ZYZCNNJBZHNVIR-DEOSSOPVSA-N 486.761 0.723 50 20 JCGD CC[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835929212 HSRDBZAIXXKSGV-RCZVLFRGSA-N 466.343 0.630 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc43)C2)C1 1835934558 YNZHYVUXBJILIN-RDGATRHJSA-N 464.327 0.166 50 20 JCGD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c(O)n1 1836151186 PIJQEHCLTGDNHG-UHFFFAOYSA-N 481.557 0.593 50 20 JCGD CO[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccc1 1837457455 CRDZBYOMCORQQY-RDPSFJRHSA-N 483.525 0.143 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CSc3nc[nH]n3)CC2)CC1 1838789162 JBHDMLKVFORPDF-UHFFFAOYSA-N 467.596 0.268 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)nn1 1838831310 CSGYIQGJCYJBOP-WMLDXEAASA-N 461.288 0.636 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1839151050 GWBLJRXYLVPDGY-ROUUACIJSA-N 461.302 0.481 50 20 JCGD O=C(c1nc2ccc(F)cn2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202579 KENGHGMYQYPZKY-GUYCJALGSA-N 474.262 0.629 50 20 JCGD Cc1cc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)ccc2[nH]1 1839615603 YMYKWYUBCPTTGK-RUZDIDTESA-N 477.326 0.540 50 20 JCGD CCNC(=S)NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1 1839655582 IFNGEFKLYWDTEF-CXAGYDPISA-N 465.414 0.100 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1840033849 SFYIBGNZFYJGDJ-ORAYPTAESA-N 471.352 0.778 50 20 JCGD Cc1cc(F)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1F 1840186587 BBJOJXJVENZGRR-JOCHJYFZSA-N 468.501 0.716 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)C3=COCCC3)CCO2)C1 1840215951 PWSHPVVUBOXIPQ-ZHNJOBQTSA-N 459.503 0.271 50 20 JCGD CN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841353835 SSZZEWSZRUEGEK-HUUCEWRRSA-N 474.986 0.551 50 20 JCGD CCc1nn(C)c(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c1Br 1843013599 ZSTYIGMRKXWCAD-UHFFFAOYSA-N 475.152 0.556 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@H]2ON=C(c3ccccc3)O2)C1 1844197426 AFJQAZBRYIWAEK-OAQYLSRUSA-N 450.455 0.237 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846198177 SARKCHJGLIDEMT-LJQANCHMSA-N 471.363 0.973 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1846330888 NDAYGKWIVZOVHE-UONOGXRCSA-N 481.999 0.118 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN 1847940294 PIEBWCUMMQHXEH-SQNIBIBYSA-N 472.546 0.970 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2cc(Br)c[nH]2)c1 28717813 OTQFOQMJSNURJF-UHFFFAOYSA-N 472.321 0.219 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cc1 726710572 GWCXMZJGCOPTJE-KRWDZBQOSA-N 485.545 0.712 50 20 JCGD O=C(CCc1ccco1)NNC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1 731366309 YJTBRYDUMKPJPP-UHFFFAOYSA-N 477.499 0.290 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1 748212486 PTDQWHUHSRCEMK-UHFFFAOYSA-N 477.503 0.457 50 20 JCGD O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)c1nnc(O)c2ccccc12 748464262 AGYVTRQEQMICFO-UHFFFAOYSA-N 450.503 0.887 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)c1 748464571 FREYMLRYMONUHF-UHFFFAOYSA-N 456.503 0.782 50 20 JCGD CNC(=O)NC(=O)COC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1 782181852 ZAOCSSLSUFOKIY-JYRVWZFOSA-N 458.862 0.985 50 20 JCGD O=C(COC(=O)CNC(=O)c1ccc(Br)o1)NNC(=O)[C@@H]1COc2ccccc2O1 802258531 BXFNVESXUGMWRU-ZDUSSCGKSA-N 482.243 0.303 50 20 JCGD Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 818373601 JVJVDVBEESHMIP-LZOLKVDOSA-N 482.428 0.649 50 20 JCGD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CNc2ccccc2OC)c1 825649417 QZPNRRSSEFWHDK-UHFFFAOYSA-N 450.517 0.801 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)c1 825802099 XNZPRCMRABHZTQ-OAHLLOKOSA-N 465.532 0.960 50 20 JCGD O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 912642973 VHSLZMMVLYQMLT-IRXDYDNUSA-N 462.528 0.407 50 20 JCGD CN1C(=C(C#N)C(=O)COC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)N(C)c2ccccc21 913374585 JLUNXJLHFMDRLO-UHFFFAOYSA-N 460.450 0.679 50 20 JCGD COc1ccnc(NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C\c2ccccc2)n1 914762570 PCUQSOMDDBHQKK-UZGISAJGSA-N 469.545 0.322 50 20 JCGD COC(=O)c1cc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)ccc1OC 915890916 HIZOETQPFYZPKG-UHFFFAOYSA-N 492.558 0.639 50 20 JCGD COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 916034349 DUAWWYIRGLKHAZ-HXUWFJFHSA-N 493.538 0.571 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1nnc2ccccn12 916222009 OPWRUXVOAUQHCT-CQSZACIVSA-N 473.515 0.455 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)nc1 916253712 HZUQUOPSPDWBRV-UHFFFAOYSA-N 476.625 0.990 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)cc1 916516900 PPYMEUPQWWESST-UHFFFAOYSA-N 497.599 0.066 50 20 JCGD CCc1ccccc1OCC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(CCOC)C2=O 916741479 GXROWVWNEYDIHB-UHFFFAOYSA-N 461.496 0.880 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)cc1 916830632 LUMMDCLXTDJMGQ-KRWDZBQOSA-N 460.512 0.852 50 20 JCGD COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 917723845 OXNVJOPRKNNKEL-UHFFFAOYSA-N 470.529 0.545 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2C(=O)c3ccccc3C2=O)c1 919788340 JPZOZVYKHTUIKO-UHFFFAOYSA-N 487.538 0.957 50 20 JCGD O=C(NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1)N[C@H]1CCS(=O)(=O)C1 919884985 IUNFDQUSWDRRRQ-ZDUSSCGKSA-N 463.965 0.944 50 20 JCGD CN1CCN(c2ccccc2CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 1318293469 MYJXTKGPVGEJQV-UHFFFAOYSA-N 452.563 0.975 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029706 XIWFWLVRCFHRSW-QHCPKHFHSA-N 454.531 0.706 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)SCC(=O)N4)CCO2)C1 1779030875 YVXDHCPAWOXMGF-QHCPKHFHSA-N 496.549 0.487 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnc3ncccc13)CCO2 1779037256 UTJRKMSMDVSUJF-QHCPKHFHSA-N 461.482 0.386 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2ncc[nH]2)C1 1782406231 ARRMAMVIYGYUII-TWLABZOOSA-N 469.546 0.990 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)(C1)C2 1783434840 SSULIKRLWRVWMS-DDJHWDJXSA-N 499.373 0.257 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CS(C)(=O)=O)[C@H]2C1 1784525042 UVUNMLDVHNKYRC-FQKPHLNHSA-N 453.399 0.820 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCC3=O)[C@H]2C1 1786731956 RTIUTVIWKPZVCM-QSFXBCCZSA-N 488.497 0.736 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C[C@@H]21)c1cccc(B(O)O)c1 1786984207 QLFYPVUUIOGEEI-JLMWRMLUSA-N 475.314 0.059 50 20 JCGD CCOc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1OC 1791151760 URMWZGHYSLBWFW-IPJJNNNSSA-N 490.601 0.989 50 20 JCGD COc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1OC 1791293704 BWZKIVXGFGUYNW-MPGHIAIKSA-N 480.537 0.809 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OCC(F)(F)F)n1)C2)[C@@H](O)CCl 1792975881 BDYVZQIFSUJASA-WJNVRWDZSA-N 451.829 0.826 50 20 JCGD C#CCO[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878370 YEUCNXXBROSYTH-UHDSXZAQSA-N 457.955 0.746 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1 1795735304 XHKHJHHARDRGSD-USGNIVHTSA-N 472.278 0.040 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)c(C(F)(F)F)c1)C2)c1cccc(B(O)O)c1 1795740764 LRKWVFHDJHZOBI-VPTLXERWSA-N 494.250 0.970 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3ccnc3c1)C2 1796442029 NQCKVUGSKLVWRY-KEMUROEHSA-N 463.498 0.672 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(F)n1)NC(=O)NCc1ccccc1 1798072223 DBERYCLWMQXCDT-OPMZPASUSA-N 484.532 0.770 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798440129 CCCOCVGZRDEYOR-FVCJKWQPSA-N 466.502 0.071 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)n1 1799347800 SVKUQGVIJRXZSB-XSPYEYLBSA-N 461.244 0.892 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1ccccn1)C2 1800762489 SVPBEZZTSATUSN-IPVBOJNNSA-N 453.337 0.573 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCCN1C(=O)OC(C)(C)C 1800783695 ZBQRCXDJXSZPTA-BMQTXXJKSA-N 495.621 0.739 50 20 JCGD Cc1[nH]nc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1805117761 DNAQURNUJZHNCI-UZLBHIALSA-N 451.267 0.565 50 20 JCGD CN1CCC[C@H](C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C1 1807367074 PUOBDLNWXKCOAP-RZUBCFFCSA-N 450.348 0.423 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1808430021 HBMCNROLNZWNNM-ZTQAJYAQSA-N 467.530 0.267 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnc2ncccn12 1809331128 QBDNOASSOMTRJV-RXVVDRJESA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1 1810300477 ZEEKHASWVCEGOR-FOIQADDNSA-N 488.508 0.207 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303673 WZRAMPQQTALTBV-IDHHARJASA-N 482.545 0.107 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1 1810305336 KBZSYDJLTOKEIW-GUYCJALGSA-N 493.446 0.078 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1 1810349809 UKAZGWRAZWRBKZ-OYRIPWCXSA-N 469.380 0.769 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1810540903 HAHWHEAOHLWDKE-KSSFIOAISA-N 470.566 0.379 50 20 JCGD COC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1812690185 NLGTZYGAHIPKBB-QAPCUYQASA-N 466.498 0.353 50 20 JCGD O=C(CCN1CCOCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1817178106 HUTWHIAZJMAEPC-IBGZPJMESA-N 455.324 0.118 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncnn1C)CC2 1817276653 ADOPGKZQGPCOJF-YBGGJHSQSA-N 455.504 0.631 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nc3ccccn3n2)[nH]n1)c1ccc(B(O)O)cc1 1817471242 HYSHPNYWQJWBOH-QGZVFWFLSA-N 459.275 0.752 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2[nH]nc3ncccc23)[nH]n1)c1ccc(B(O)O)cc1 1817471469 OPKUYZKPACSYIZ-KRWDZBQOSA-N 459.275 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)/C=N/N3CCCCC3)sc2C1 1819776517 DWGBTMFXFCRJNV-LFWZTCNZSA-N 470.559 0.839 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)Cc1ccccc1)CC2 1819799573 DOKMSJWZEZCYPP-KSSFIOAISA-N 480.550 0.971 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1819899245 SNWKFLRJJBUAEA-WITJGNNASA-N 472.332 0.578 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](O)Cc3ccccc3)sc2C1 1825435484 YEIREAMZPBTXDN-KDOFPFPSSA-N 480.550 0.971 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)N1CCCC1)CC2 1826084186 ZXEMFSWVLIWSSK-CQSZACIVSA-N 464.592 0.831 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)CC2 1826085087 CPZRMZBGEJMGBB-JSGCOSHPSA-N 498.606 0.314 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826886753 PROCGVDWCSRPNM-XJKSGUPXSA-N 466.328 0.911 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051873 HXUFEXBONWYHIY-JTSKRJEESA-N 493.373 0.208 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnn3ncccc23)CC1 1827525075 MXCGBUNLVWOVJP-NRFANRHFSA-N 461.331 0.956 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](C)n2cnnn2)CC1 1827679389 BDCURFUMWMFNIK-UDXRYCPGSA-N 469.550 0.988 50 20 JCGD Cc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)n1 1829728561 XSHGWBLJWVMWDT-ISGGHPHESA-N 459.547 0.233 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1830545216 IIMXHSPQQUWZRS-SJCJKPOMSA-N 494.433 0.334 50 20 JCGD O=C(CCc1nc(-c2ccc(F)cc2)no1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726693 TZLDVKFAGFVYAH-JTSKRJEESA-N 496.923 0.864 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)C1 1831645615 CPSKFJDPWMVWLL-QYWGDWMGSA-N 477.986 0.736 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832036666 UJUTWPRGTDVPQT-VBKZILBWSA-N 463.959 0.346 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832729852 NYSLGYVJCOBVBX-VQTJNVASSA-N 473.357 0.504 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n1 1832768915 FIONLFNZBLVRMY-AUUYWEPGSA-N 456.337 0.873 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833313914 STUVNFKGZJKNFX-GOSISDBHSA-N 491.029 0.699 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1 1833565434 LFAZUCQEDLXLTP-JXFKEZNVSA-N 473.979 0.714 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccns1)CCO2 1833774059 UNFWHMZIAOFIPE-BTVXTAIASA-N 460.516 0.347 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833885767 JHNXWPJCKKFJOO-SFHVURJKSA-N 467.379 0.084 50 20 JCGD CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1834751454 XMOSRISUSZHUHU-DFBJGRDBSA-N 481.553 0.949 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834826515 QRHPODGTOMTDOX-YRNRMSPPSA-N 473.364 0.983 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cnc2ccccc2n1 1835276241 DSODCEBIVUXINJ-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD CNc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)cc1 1835604566 ANGAWEFSLYCHGK-FXZATJRASA-N 482.541 0.932 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C[C@H]3C3CC3)CC2)CC1 1835734633 NPRCARZXOYTTMR-VQTJNVASSA-N 454.575 0.916 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934505 WCOIVWHHEXYGQQ-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)CCO2 1837297368 SRDYJYYIHCRZGR-NDXORKPFSA-N 467.906 0.431 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1 1837460104 VEJMUPCTWDBDSQ-QHCPKHFHSA-N 497.487 0.084 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)ccc3F)C2)C1 1837460708 JOQXKUDOIPOQHY-QHCPKHFHSA-N 489.479 0.276 50 20 JCGD O=C(CNCP(=O)(O)O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1837835426 HAFLENNZSQDPCR-AWEZNQCLSA-N 474.264 0.400 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921744 WYZDWHUTYPHHDX-UHFFFAOYSA-N 482.346 0.107 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)NC(=O)c3cnccn3)CC2)CC1 1838416116 LXPMNXXEAQQCRU-YJBOKZPZSA-N 481.981 0.847 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1838435609 XPMURMMQURAKPT-JKSUJKDBSA-N 466.348 0.827 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839047310 JFGAUYMHCBWYOA-YWZLYKJASA-N 480.363 0.759 50 20 JCGD C/C=C/C=C\C(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054435 YYZLFWHNRPOPKX-UEISIHFFSA-N 485.585 0.921 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1839152940 OKMNJWPWFVVZKK-RBUKOAKNSA-N 461.346 0.972 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1839155574 XUVZXMAVRVZUIG-ZWKOTPCHSA-N 463.318 0.254 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1840034401 JTTRXFJUEPFGIA-QFBILLFUSA-N 473.412 0.006 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1 1840035352 OCJNHHVVZBFULS-DJJJIMSYSA-N 454.321 0.639 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1 1840184835 GAMNWJMTTUWDRF-OFVILXPXSA-N 472.586 0.621 50 20 JCGD CO[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1840206861 KPQYOMRDRIDFQX-AVYPCKFXSA-N 463.959 0.610 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1 1840820371 MCLFGYIYKVOSSA-UTKZUKDTSA-N 451.907 0.647 50 20 JCGD CN1N=C(C(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CCC1=O 1841923973 JPKQEWBNMKVIGC-AWEZNQCLSA-N 455.943 0.930 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)C1)NC(=O)NCc1ccccc1 1841999918 HJQLPJKEMFZJTE-UHFFFAOYSA-N 484.517 0.341 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)c2ncc[nH]2)C1 1842302129 JVGWPRSEUUITDQ-SFHVURJKSA-N 497.361 0.043 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012427 OALUBRHNCRKODB-SFHVURJKSA-N 457.336 0.583 50 20 JCGD CCOC(=O)N(CC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)Cc1ccco1 1843015062 DHIMRKVUJUOIRL-UHFFFAOYSA-N 469.303 0.435 50 20 JCGD O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)C1 1843235563 DGZTWYHMNRMULF-CQSZACIVSA-N 486.330 0.636 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@]2(C)CCN(C(=O)OC(C)(C)C)C[C@H]2O)C1 1843984051 VGPVIAVTNLRLAJ-UZUQRXQVSA-N 495.621 0.571 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1844383415 CTJDYULTGAHJEV-GJZGRUSLSA-N 460.959 0.473 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038932 KCVWAAGLHPIMPU-GOSISDBHSA-N 480.573 0.827 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)cc2)C(=O)C1 1846385469 KGHVEZIJHYZERK-UHFFFAOYSA-N 454.531 0.989 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccn(C)c1=O)NC(=O)NCc1ccccc1 1847914859 AYRYOWOXMPPNFU-PMACEKPBSA-N 466.542 0.547 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)COc2ccc(Cl)cc21 1848035142 CXPHUBOTWGZNAT-IRXDYDNUSA-N 498.927 0.580 50 20 JCGD C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 15053524 JLYMGIYLKPKBFB-CALCHBBNSA-N 460.535 0.478 50 20 JCGD CCn1c(CCC(=O)NNC(=O)Cn2nc(C)cc2C)nc2cc(S(=O)(=O)N(C)C)ccc21 27610005 OSAJTCAEDLXLPG-UHFFFAOYSA-N 475.575 0.900 50 20 JCGD O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)c1csc(N2CCOCC2)n1 104730724 DPNRZWOIPGPAPJ-UHFFFAOYSA-N 493.489 0.738 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)c1 106074947 BTNHEQVIXOGSAI-UHFFFAOYSA-N 459.459 0.697 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)NCCNC(=O)c1cccc(Br)c1 725871724 QIRHGCUZGROWNU-UHFFFAOYSA-N 452.265 0.532 50 20 JCGD O=C(COc1c(I)cc(Cl)c2cccnc12)NNC(=O)Cn1cnnn1 726097326 CUYLSDCRDOBTRI-UHFFFAOYSA-N 487.645 0.706 50 20 JCGD Cc1nc(N2CCOCC2)nc(O)c1CCC(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1 726863338 NNCXCIYWEQSLIN-UHFFFAOYSA-N 476.559 0.844 50 20 JCGD COc1cccc(N2CC[C@@H](NC(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cn3)C2)c1 728221057 NAOQUGCJSGPBMJ-QGZVFWFLSA-N 489.602 0.931 50 20 JCGD COc1cccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)NCC(F)(F)F)cc2)c1O 751272365 URUXYDGCIUTHOJ-UHFFFAOYSA-N 483.446 0.865 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2cccs2)CC1 756143286 ODWSRTFPVLDMHQ-UHFFFAOYSA-N 469.545 0.493 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cnn(C)c1C)N(S(C)(=O)=O)CC2 824202428 KNNPKEZNIBEHKQ-MRXNPFEDSA-N 465.532 0.456 50 20 JCGD Cn1c(CC(=O)NNC(=O)c2cc(-c3ccco3)nc3c(C(N)=O)ncn23)nc2ccccc21 913081332 JNSNLZWTWYUNFI-UHFFFAOYSA-N 458.438 0.979 50 20 JCGD Cc1cc(C)c(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c(C)c1 913155957 KIJVWCNLJKKFSJ-UHFFFAOYSA-N 457.516 0.717 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1cc(-c2ccccc2)[nH]n1 913423007 JLHGKHPLBGYLON-UHFFFAOYSA-N 471.495 0.978 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)Cc2nc3ccccc3n2C)cc1 913534467 HPOGGTFXSUKKHS-UHFFFAOYSA-N 457.512 0.834 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(-n3cnnn3)cc2)c1 914612736 NERLCWTXKSOWBG-UHFFFAOYSA-N 457.516 0.697 50 20 JCGD CN(CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(=O)c1cccs1 914710757 FRAVUMSLJFKWGQ-UHFFFAOYSA-N 494.595 0.621 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1ccnn1C)N(S(C)(=O)=O)CC2 916570927 FRCLLDGTYWPWGI-MRXNPFEDSA-N 480.547 0.217 50 20 JCGD CCn1nc(C(=O)NNC(=O)NC[C@@]2(N3CCOCC3)CCSC2)c2ccccc2c1=O 916636437 CJHMZKICPWWIOX-NRFANRHFSA-N 460.560 0.568 50 20 JCGD O=C(NCc1cccc2c1OCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 919656282 MVIBMFJXQQRBBP-UHFFFAOYSA-N 462.484 0.580 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)Cc2ccccc2)c1)N[C@@H]1CCS(=O)(=O)C1 1326932264 CUPCLEGOMAGNEA-MRXNPFEDSA-N 451.526 0.792 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(=O)n3[nH]nnc3n2)C1 1777821846 NJLWZAAYRDWYTL-NXOUGTEYSA-N 472.333 0.176 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1nnc3ccccc31)C2 1779371500 VUGYMJWUPWPUKZ-HYBUGGRVSA-N 492.540 0.258 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372221 CPVJQFIVRNUEQU-LSRZYVKLSA-N 481.557 0.708 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc3c1OCO3)C2 1779372372 GHEDFCNOCNVFKG-UZUQRXQVSA-N 482.497 0.250 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4cccs4)on3)C2)C1 1779565430 LFKHSHRJCCANII-JOCHJYFZSA-N 467.312 0.840 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1781232746 XUPKTCWTFGDZOE-OALUTQOASA-N 475.398 0.958 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)C1 1782256537 SPZBHDOLLZDPMK-AHWCRGGASA-N 489.997 0.472 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1 1783538130 UCBYYRBBEHRJNG-XLIONFOSSA-N 495.411 0.686 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C[C@H]2C[C@H]21 1785589292 IZSUCOHMLREHJS-KMPPDALZSA-N 457.955 0.814 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(Cl)ccc4c3OCO4)C[C@@H]21)c1cccc(B(O)O)c1 1786983294 MKXLCJPVOGYUFP-QOKNQOGYSA-N 486.717 0.656 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4O3)C[C@@H]21 1788609709 CCEMYQLJGQWPQC-VHHKXPHXSA-N 479.537 0.672 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cccc3F)C[C@@H]21 1788609942 FJZWCPLVXOPECS-QITLCBANSA-N 459.453 0.870 50 20 JCGD Cn1cc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)ccc2n1 1790351843 JQRLZJZQLRTUBK-XJABCFGWSA-N 462.315 0.160 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793106271 COLWOOORHVPIEE-YVSFHVDLSA-N 477.986 0.782 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)n2[nH]nnc2n1 1796574794 ZUEGZFIXYFMRSS-WMTCKVMYSA-N 480.435 0.950 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(N2CCOCC2)n1)c1ccc(B(O)O)cc1 1797090108 XQNXAARZDQEOFT-ACDBMABISA-N 464.331 0.164 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)C1 1797820783 CTLBIUFOVOPAHA-FFGOWVMKSA-N 471.363 0.875 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])c2c1OCO2 1799343204 XEQXLMBIBVSRLD-CLLJXQQHSA-N 482.453 0.888 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C)C2 1800754337 MHAGXCURYHTSQD-IGNRKKQASA-N 488.379 0.938 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCS1)NC(=O)NCc1ccccc1 1801564095 DTYFIKYWNWHURK-JTJHWIPRSA-N 475.615 0.818 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc(OC)c1C 1801833117 FNOGHHONPLNYOT-VPTLXERWSA-N 483.525 0.528 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnc(Cl)nc1 1802295213 AFYUBCXDWNJSAK-LPHOPBHVSA-N 465.706 0.838 50 20 JCGD Cc1nc(N)sc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807243664 LTNFZDGYLBZEBK-AEFFLSMTSA-N 465.344 0.742 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807364107 HRAABMHWJQHVFP-XMSQKQJNSA-N 467.331 0.813 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2cscn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365728 WFHKLSBFHAVFRG-UTKZUKDTSA-N 450.329 0.780 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)COc2ccc(O)cc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807367006 WQSFHJLTROATKA-YADARESESA-N 475.310 0.866 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375014 KQYWIDAVBADCKR-GCJKJVERSA-N 475.314 0.374 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@H]1c1cccnc1)[C@@H](F)Br 1808682091 YTOMEDVWFCKSPV-AFAVFJNCSA-N 453.268 0.703 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1 1809967880 NNLDRICSXVENQI-JOCHJYFZSA-N 466.343 0.953 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1)[C@H](O)N1CCOCC1 1810349659 LQNFTNDNVSVXBM-WDYCEAGBSA-N 455.353 0.523 50 20 JCGD C[C@](O)(C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)C(F)(F)F 1815350345 ROHBEDUXIAEPKF-GTNSWQLSSA-N 457.239 0.362 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3Cc4ccccc4CN3)sc2C1)c1cccc(B(O)O)c1 1817138632 LANMELVEYZPMEP-UYAOXDASSA-N 476.367 0.763 50 20 JCGD CC(C)(NCCC#N)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1817315924 VQVHBHGFUAFEAS-SFHVURJKSA-N 452.324 0.677 50 20 JCGD COc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)nn1 1821066461 VRQFHKRXFJKTIH-ZDUSSCGKSA-N 453.289 0.161 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)[nH]n1 1822410640 MYCVCQDERLLERO-HNNXBMFYSA-N 461.483 0.580 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1C(=O)CNC1=O)CC2 1825440916 HSFFXKTVAFPBFC-IUCAKERBSA-N 458.338 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2CCOCC2)CC1 1826751195 ZAFAHTBKQMLHOD-NRFANRHFSA-N 472.590 0.641 50 20 JCGD O=C(c1cnn2c1OCCC2)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053718 YHVDYENXFWDSHZ-OAQYLSRUSA-N 466.347 0.893 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCCO1)CCO2 1829917654 VBYCKDRDYIOSOJ-IJRBDHGVSA-N 461.519 0.146 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1830540380 PSTQJKZSZZCLMY-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cn2[nH]cnc(=O)c12 1830543055 IZYSGMMGEWGASD-ZUOKHONESA-N 496.362 0.432 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C)COC3)C2)C1 1832549799 SFQLFBXHUBPNLV-YCRPNKLZSA-N 475.970 0.611 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1832840258 IYCWXANAXFAPLF-FCHUYYIVSA-N 457.380 0.905 50 20 JCGD Cc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1833804638 OHWCXUKKBHYAJB-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD COc1cccc(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834797954 PHWFSJIXDROHLP-UHFFFAOYSA-N 479.386 0.803 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(Cl)ncn3)CC2)CC1)c1ccc(B(O)O)cc1 1834798304 FVGYFSTXQYSZJR-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1834823955 OKHLEURETGZMFT-GOSISDBHSA-N 456.293 0.665 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cn3cccn3)CC2)CC1 1835117928 XQUZWRPJNCHTSO-WPWMEQJKSA-N 468.562 0.589 50 20 JCGD CC(C)(O)CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835260494 CMQFJMDXGCDVCA-YCRPNKLZSA-N 477.986 0.736 50 20 JCGD Cc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1835737130 NMGBHHXJIALBQE-UHFFFAOYSA-N 479.585 0.816 50 20 JCGD CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1835737976 PHNMKQUFKCOHJO-UHFFFAOYSA-N 494.600 0.645 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835932048 LIPHHNDBHDNWFI-RUZDIDTESA-N 466.343 0.296 50 20 JCGD COc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1C 1835933542 BCIXBFMQTSZVAW-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccccc3Cl)C2)C1 1835938283 RNOTZVBDZJVHIE-JOCHJYFZSA-N 458.707 0.404 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836128266 HPPDUILXQDADSX-MOPGFXCFSA-N 462.330 0.702 50 20 JCGD CC[C@@H](Br)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1836541815 HPZLEXPSXBCUIP-CQSZACIVSA-N 495.382 0.171 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1836666982 JUNIVVUFPDWCKE-XMMPIXPASA-N 489.573 0.017 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1836673045 LVMMRCIZXKZLFH-QRWLVFNGSA-N 476.412 0.667 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4C3)C2)C1 1837460972 MHENPVISDKBBHF-FQRUVTKNSA-N 493.564 0.560 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1838101480 QBCDSCNWHBLJFR-MOROIOLQSA-N 488.589 0.986 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1839173551 XXAQYLQFLNKLBL-KXBFYZLASA-N 461.353 0.983 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201844 LANQESHSCTVEIS-RIPAZEOFSA-N 488.310 0.904 50 20 JCGD Cc1nccn1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1839713928 OFNQBRVDOFBZJD-JTSKRJEESA-N 499.996 0.780 50 20 JCGD C[C@H](NC=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802377 UZPQWCVSZMZRFD-YRISNDGFSA-N 482.375 0.584 50 20 JCGD CO[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1840206863 KPQYOMRDRIDFQX-SIFCLUCFSA-N 463.959 0.610 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1 1840958199 VDJNFLRDXNANHK-FXAWDEMLSA-N 458.870 0.843 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841354469 CJGDTIXCVDYUOK-ZIAGYGMSSA-N 475.974 0.131 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1S(=O)(=O)N1CCOCC1 17329867 IAIJVYHVQXCTEK-UHFFFAOYSA-N 464.456 0.699 50 20 JCGD O=C(CCNS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 17457124 MHVLZACHCZHDKN-UHFFFAOYSA-N 480.568 0.601 50 20 JCGD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1 110549611 AFPCEQVILMOBPO-ZDUSSCGKSA-N 468.557 0.946 50 20 JCGD CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)c1cccn1C 726540681 JSKDMQIGFXKYDS-GOSISDBHSA-N 450.517 0.951 50 20 JCGD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1 727608976 FVKQVOYLYKESEF-GFCCVEGCSA-N 482.588 0.901 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccccc3OCC(=O)N(C)C)cc2)CC1 728214782 SGYCCSFORCMBKI-UHFFFAOYSA-N 475.571 0.847 50 20 JCGD O=C(COC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)NNC(=O)[C@@H]1COc2ccccc2O1 728341599 XAIHMQGODDPGRU-CJNGLKHVSA-N 495.535 0.432 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1 729274970 IHVQPCNJVLIUKS-HZSPNIEDSA-N 490.604 0.061 50 20 JCGD Cc1ccc(S(=O)(=O)Nc2cccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)cc1F 729274974 IIAHCSORQIFRCS-GFCCVEGCSA-N 472.520 0.634 50 20 JCGD CC(C)(C)c1ccc(C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)N2CCOCC2)cc1 745988061 PPGHSMVSWPUYDO-KRWDZBQOSA-N 468.576 0.590 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)c1 748465838 SZEARYYXNCFDFG-UHFFFAOYSA-N 474.543 0.168 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)COc1cc(C)on1)N(S(C)(=O)=O)CC2 771851355 SMCVNGCCXNRLTA-HNNXBMFYSA-N 482.515 0.476 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=S)NCCc3cccs3)c2)CCN1 913055456 ZENSQLGSBWGUNJ-UHFFFAOYSA-N 467.598 0.220 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)cc1 915880385 LGNKTXCURMBWGK-HNNXBMFYSA-N 482.540 0.627 50 20 JCGD CN(CCCNC(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12)S(C)(=O)=O 916580319 MKPIALXRIZBISA-UHFFFAOYSA-N 486.554 0.670 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@@H]1CCCN(S(C)(=O)=O)C1 920239970 KCDKCNLIXUOUKD-DGCLKSJQSA-N 463.354 0.971 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4sc(C)cn4c3=O)C2)C1 1777990929 ZCFXPIGFRRWBJB-LIRRHRJNSA-N 454.936 0.762 50 20 JCGD O=C(/C=C/C(=O)c1cccs1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1778097251 SYFKONOACJAZTC-XINXXDONSA-N 482.367 0.995 50 20 JCGD COc1cncc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779029360 WGKRPOZERKOKJV-HSZRJFAPSA-N 468.514 0.165 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1nccc3occc13)CCO2 1779030387 PVTHZQZILBBJRC-JOCHJYFZSA-N 450.455 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(Cl)nn1)C2 1779372600 NAKJSKQWDWWTNJ-IIBYNOLFSA-N 473.921 0.570 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780936146 ZDONCMIXUOJQNX-DJJJIMSYSA-N 485.404 0.752 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1780938773 HYTNZPUTKFZPPW-QHCPKHFHSA-N 482.733 0.582 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)c1 1780969549 OAESXJBAJXYWCK-CPJSRVTESA-N 497.600 0.929 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781335013 TVHGNCRYCRHSEN-ACJLOTCBSA-N 484.282 0.813 50 20 JCGD COc1c(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)ccc(F)c1F 1781847658 SZPSPDJSKRVHNB-QFIPXVFZSA-N 475.452 0.729 50 20 JCGD Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc(C)c1C(=O)O 1782173819 ATMWRCFJVRRUSP-HSZRJFAPSA-N 460.531 0.818 50 20 JCGD CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCOC2)C1)NC(=O)NCc1ccccc1 1782693817 FMVWUSXGEGMWGA-DNRQZRRGSA-N 487.601 0.883 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783933143 CNYXZXAFCOJHJM-BVZALQNUSA-N 499.609 0.118 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCS3(=O)=O)C[C@@H]21 1783974293 LBZCYPRTJOIQKP-QTVXIADOSA-N 451.383 0.574 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784092175 IMDPEDWVVXXPBO-FQMQPWHVSA-N 477.961 0.913 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1784417214 MHARMLBWPOQHAP-OYHNWAKOSA-N 470.555 0.704 50 20 JCGD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1784661492 HEUAICPNHQKDBK-UGDFAFBOSA-N 489.997 0.590 50 20 JCGD Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cs1 1785293257 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0.599 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3COCCN3C(=O)OC(C)(C)C)C[C@@H]21 1791253970 GHFLTTNSLVOLDM-JCECYMMASA-N 489.997 0.856 50 20 JCGD O=C(CCc1ccc(F)c(F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1792742756 AMAHAACMPORGKS-FAQVEIGNSA-N 458.270 0.481 50 20 JCGD CC1(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)CN(C(=O)OC(C)(C)C)C1 1792983073 BMICFVFAUMHXAV-JYYAWHABSA-N 459.971 0.823 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1794156776 RSOWLIJKGHKPAH-APAFKAMOSA-N 496.992 0.707 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(=O)O)ncn1 1794365249 VFTSPHQQTVWIDT-VZAMPYOESA-N 497.936 0.510 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)nc(Cl)c1 1794413858 CYLBOERQRPUNSI-VNGJRTCYSA-N 474.905 0.778 50 20 JCGD CC(C)Oc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(F)c1 1795735758 DKKLQLKCWJMMMA-FAQVEIGNSA-N 470.306 0.810 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2)[C@@H](F)Cl 1796360946 GFRSZUGDWWGKIM-GTYSZEQSSA-N 451.882 0.726 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)ccc12 1796375189 SXVSYIYHYKSVHP-ACDBMABISA-N 490.325 0.756 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c2cc(O)ccc2n1 1797353559 GBCSZKGTLBKJLK-GPVSGQMNSA-N 475.310 0.446 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2cccnn12 1798497103 ZKAZSRXBAMEEJI-KOFHJDLBSA-N 464.320 0.324 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccn(C)n1)C2 1798522322 PBEPMCUCJIWXAG-USGNIVHTSA-N 471.470 0.700 50 20 JCGD C=CCO[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095354 OWGLSJFNNMSJHK-RPUPUWCGSA-N 473.574 0.513 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)CC1 1801965780 GLBPPBVABSRPDA-FSDCSDTHSA-N 462.950 0.663 50 20 JCGD Cc1cc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1C 1803288298 DGELXZNEBQCKPU-VGOFRKELSA-N 476.541 0.684 50 20 JCGD O=C(CNCP(=O)(O)O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1 1807021065 FYXOSYCZTFJYCT-BBRMVZONSA-N 463.269 0.597 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCc2cncnc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362359 GOEYRVADZDCZMM-NFBKMPQASA-N 459.315 0.504 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807363095 OFWMUKBCRWAMTK-DENIHFKCSA-N 477.330 0.238 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375291 RUYVODPKDQNGJO-UYAOXDASSA-N 467.331 0.670 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3Cc4ccccc4CN3)CC2)C1 1809978498 WCIDXGGTRWQCQB-HSZRJFAPSA-N 461.371 0.926 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810294163 IOEYCSRLUWXOOR-OGWOLHLISA-N 488.570 0.080 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2)[C@@H]1c1cccnc1 1810294731 MYVUNRBFJCBMBV-LAUBAEHRSA-N 451.531 0.496 50 20 JCGD COCc1c[nH]c(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1 1811347975 GSEWYSPMQYMBMN-SIKLNZKXSA-N 462.315 0.869 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1813419665 QUULGFRSYKHPRC-MBSDFSHPSA-N 490.568 0.993 50 20 JCGD CC(C)(C)n1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1 1815343562 ACDZHADCHFMGQK-AWEZNQCLSA-N 468.348 0.709 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3ncccn3n1)CC2)c1ccc(B(O)O)cc1 1815344368 VWOABFMDDTXISZ-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[nH]n1 1819610064 WRSLFJTWOBTLIV-SDVARSMKSA-N 486.533 0.687 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CNC(=O)C2)n[nH]1)NC(=O)NCc1ccccc1 1821964394 VYFCMIISFXIRSJ-HKUYNNGSSA-N 496.572 0.884 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1824599880 YJVSLSSIHASAQA-BXUZGUMPSA-N 461.305 0.610 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(=O)n2O)CC1 1825493919 NPMMJXRZNQBKRV-GOSISDBHSA-N 468.514 0.631 50 20 JCGD Cc1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c(=O)[nH]c1C 1827055998 NGSYSXTYXBIYBC-FQEVSTJZSA-N 466.347 0.614 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829049852 HRWWXQHYXVIIFN-UTKZUKDTSA-N 453.352 0.528 50 20 JCGD O=C1CCCc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc21 1830728021 NDRBOABOVLJOKW-UGKGYDQZSA-N 450.919 0.875 50 20 JCGD O=C(COc1ccc(Cl)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1831286639 CUWYMTZUAIVWTP-APWZRJJASA-N 465.305 0.914 50 20 JCGD COC(OC)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549127 CIAQMDPHYTWWNZ-XOBRGWDASA-N 479.958 0.194 50 20 JCGD CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1833530478 YSFPNCPQCAANTL-LJQANCHMSA-N 477.071 0.696 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@@H]1CC(=O)N(C2CCCC2)C1 1833686059 OHMSZWKIZSZOMT-OXQOHEQNSA-N 469.026 0.949 50 20 JCGD CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)nn1C 1834798415 SJDCCPVQIIMBQU-UHFFFAOYSA-N 467.379 0.161 50 20 JCGD O=C(CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2)N1CCCC1 1834818773 DXUZOXVVSQODRA-LJQANCHMSA-N 460.369 0.630 50 20 JCGD O=C(CCc1ccc[nH]1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834830505 XEYNQGPQHSAFEL-UHFFFAOYSA-N 452.364 0.513 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CS(=O)(=O)N3CCCC3)CC2)CC1)[C@H](F)Cl 1835079559 FUAYRIFSXFORJE-KRWDZBQOSA-N 452.980 0.518 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnc4ccccn34)CC2)CC1 1835348987 KOPSECSOGNUGSE-UHFFFAOYSA-N 469.590 0.893 50 20 JCGD COCCn1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835736738 GESJEEOAYIKIMO-UHFFFAOYSA-N 498.588 0.027 50 20 JCGD CN1CCN(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)CC1 1835836987 IKAIHHMVKIAKJZ-UHFFFAOYSA-N 453.704 0.657 50 20 JCGD Cc1cn(CC(=O)N2CCC(N3CCC(NC(=O)CO[Si](C)(C)C)CC3)CC2)c(=O)nc1O 1835837588 KOECRLVTSYYHHR-UHFFFAOYSA-N 479.654 0.680 50 20 JCGD Cc1cc(F)ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835941841 RRKIEPGPJYPRKR-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD CN1CCC[C@H](C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)C1 1836351603 FZEAIBRUZKVIDW-KRWDZBQOSA-N 471.606 0.212 50 20 JCGD O=C(Cc1cnccn1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836773930 OQGUXRWUYZOQBB-UHFFFAOYSA-N 452.320 0.011 50 20 JCGD Cc1nn(C)c(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1F 1837337336 GUIAAHZNOUJGTJ-UHFFFAOYSA-N 472.326 0.473 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1 1837530788 QRWXTLNSCAQQHH-ZCVAIWLRSA-N 462.341 0.755 50 20 JCGD CC#CC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1837612758 LODZIECLNMDHLO-RPLLCQBOSA-N 490.365 0.634 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC4CCOCC4)n3)CCO2)C1 1838355926 XAZXTBGIBKPUQA-FDDCHVKYSA-N 497.976 0.963 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)c1ccc(F)cc1 1839037929 FOOVWAOOORVKJR-QKLQHJQFSA-N 459.877 0.994 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1839350224 PNYPDRSQTJQUMG-IBGZPJMESA-N 454.321 0.641 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3-n3nccn3)CCO2)C1 1839381209 GNKDMZYBADBIGC-UTKZUKDTSA-N 463.922 0.591 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C2)C1 1840152240 BZKSVRGEAJEHDJ-IERDGZPVSA-N 475.970 0.564 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSCc3[nH]cnc3C)C2)C1 1840153289 JQEKDWSZUYGMSO-BEFAXECRSA-N 460.984 0.662 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(F)CN(C(=O)OC(C)(C)C)C3)C2)C1 1840156698 STANUVSUAIZPRF-FOIQADDNSA-N 493.960 0.656 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(Cl)c3)C2)C1 1840185619 QIOVIVCLSTUODE-NRFANRHFSA-N 452.939 0.783 50 20 JCGD O=C(CCc1ccccc1F)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840546007 XUCKJCGVFQKSPT-DEOSSOPVSA-N 470.306 0.208 50 20 JCGD COc1ccc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840653407 CBPJFRZJJNGUGO-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD Cc1cc(Br)cnc1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013442 JIMCZCDTCYRODE-UHFFFAOYSA-N 458.121 0.963 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1OC 10159370 YSNFEDHWDRYPNC-UHFFFAOYSA-N 489.510 0.725 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)cc1 18071828 ZKWAVNSJUZFVBP-OAHLLOKOSA-N 480.543 0.673 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(Cc2nc(O)c3ccccc3n2)CC1 725871381 HAKVTYPLYISLQP-UHFFFAOYSA-N 469.527 0.685 50 20 JCGD CON(C)S(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 728213728 ONHDWZLGOTVDFQ-UHFFFAOYSA-N 497.599 0.562 50 20 JCGD CC(=O)N1CCC(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1 729624237 RHIDDWMNBKBFCU-UHFFFAOYSA-N 451.549 0.674 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1)C(=O)N1CCCC1 748247637 SWUOOVKRXGXEGE-UHFFFAOYSA-N 474.495 0.277 50 20 JCGD C[C@H]1Oc2ccccc2N(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1=O 813580601 QTLZEQMYAAQRRH-ACJLOTCBSA-N 455.423 0.331 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)Cn2cccc(C(F)(F)F)c2=O)cc1OC 907467664 GFSDKZDBZDSMKM-UHFFFAOYSA-N 457.361 0.889 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)NC2CC2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1 914406315 ZGVJNPMSZWVFQI-UHFFFAOYSA-N 455.500 0.497 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NC[C@H]3COCCO3)c2)cc1 918109282 ZITALCUHDYQXLD-KRWDZBQOSA-N 464.500 0.855 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)Nc1ccc2c(c1)C(=O)NC2=O 920929627 UJLLKZIAOHURJZ-UHFFFAOYSA-N 457.468 0.821 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 921075101 RKRPIRZSJGZVEZ-UHFFFAOYSA-N 454.530 0.601 50 20 JCGD O=C(C1=NO[C@H](c2ccccc2)C1)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1778174453 ZZZLFFWHKRMFJI-URXFXBBRSA-N 463.299 0.328 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnn2ccccc12 1778488711 ODGHOENOKYHWSZ-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371193 PNYYDISIHZCYPB-ZDWFVDTJSA-N 469.546 0.345 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CS(C)(=O)=O)CCO2)C1 1780096755 HEIBNRHGUXPWKL-LJQANCHMSA-N 469.472 0.008 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(=O)ccn1C)CCO2)NC(=O)NCc1ccccc1 1780968423 KVUIQYVEJQBIAG-RUZDIDTESA-N 496.568 0.175 50 20 JCGD CN(C)[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1Cl 1782830098 BGVMVTAFEIOPCF-QPPBQGQZSA-N 485.777 0.766 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCC(=O)N1C(=O)OC(C)(C)C)CCO2 1783879119 OJSHQKUQECVVPO-ZSDSOXJFSA-N 473.954 0.996 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccc(F)cc1 1783934658 FYWCNZJWFJFYCJ-GGAORHGYSA-N 477.537 0.206 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784091298 ZGSCCPRQCUEFPP-WOYTXXSLSA-N 475.970 0.202 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc[nH]n3)C[C@@H]21 1785076476 KUKOBXVRXMVENM-XUXIUFHCSA-N 456.931 0.530 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ncccc1C(F)(F)F 1788995368 FZBSXWYKZXHJFG-ZVZYQTTQSA-N 477.248 0.687 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)C(=O)c3ccccc3)C[C@@H]21 1791249345 JBBZALQROYREJK-OKYOBFRVSA-N 451.951 0.992 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792979099 UKOSIMCGRDAJOQ-LSIGDULCSA-N 487.981 0.200 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792983806 OTIVJDPUNLSMDV-QRJUGERDSA-N 457.955 0.433 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1793091476 BPWYZKADEBIULJ-FAQVEIGNSA-N 495.536 0.308 50 20 JCGD Cc1cnn(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)c1 1793881120 PYWOSXZWFUOLNW-DFGXFYAUSA-N 469.970 0.913 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)nc1 1794426185 SHOFKNIMKOJHFE-DRXBFXEBSA-N 460.350 0.473 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1F 1795737518 QFNHOGFGPUHYRB-GFENJXEQSA-N 490.268 0.179 50 20 JCGD CC(C)(C)OC(=O)Nc1ccoc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795740260 LMHKMXCCVJJHBZ-HGKCTWBKSA-N 499.329 0.823 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1nc2ccc(C(F)(F)F)cn2n1 1795969814 WHYWYSBWKLGHCF-IQOUGMIPSA-N 461.828 0.551 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cccnc3n1)C2 1796442074 PUAREIUIPJXOEH-LOHQAQBBSA-N 464.486 0.067 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1F)C2 1797749477 ARWWECWUSYAYLO-CULMDFNYSA-N 462.869 0.390 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1ncn2c1CNS(=O)(=O)c1ccccc1-2 1798411025 FFZUYONNGGWTBP-XBCDXLOZSA-N 497.936 0.402 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C 1799364488 DMCHLBVWRPQCOL-JRBZFYFNSA-N 463.959 0.106 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1799395687 VZQZAJUOEAOGHV-KMQSCTNJSA-N 488.589 0.723 50 20 JCGD COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c([N+](=O)[O-])c1 1800793093 OEUGFDQOVAEVJM-QDMKHBRRSA-N 496.480 0.946 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 1800808008 NWOPCXYLMMVBKO-DERJNBNXSA-N 490.395 0.730 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccn(Cc3ccc(F)cc3)c1=O)C2 1800974153 NHVWDAPPYFRNMJ-NBMJBFSESA-N 492.935 0.888 50 20 JCGD CC(C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)N1Cc2ccccc2C1=O 1801010846 ZMUQYSDNEFYVMF-PLWWPAAYSA-N 499.612 0.630 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375015 KQYWIDAVBADCKR-PGRDOPGGSA-N 475.314 0.374 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)c1 1807481833 JWNMOSNLBNHNNS-UHFFFAOYSA-N 485.371 0.324 50 20 JCGD COCCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1808653406 QBUBGFOZCNBYSW-SIKLNZKXSA-N 477.330 0.238 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC2(CCCN(C(=O)CC[C@@H](N)C(N)=O)C2)CC1 1809818630 BECADHFCCSXOPJ-CVEARBPZSA-N 488.029 0.943 50 20 JCGD CC(C)(C)NCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303410 RTWWHUJRCZBKRH-JXFKEZNVSA-N 453.547 0.788 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810309321 QHZDKWRCBBYCOB-YYWHXJBOSA-N 481.557 0.705 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2c3c(nn2C)CCC3)[C@H]1c1cccnc1 1812226736 CHMSDYFMRKHIPK-VGOFRKELSA-N 467.574 0.996 50 20 JCGD CC(=O)N/C(C)=C/C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1812319062 RZZHEIWQFGYZEM-OKNGYXHYSA-N 450.304 0.121 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347912 XEZCPMQJBBSABU-CZUORRHYSA-N 466.328 0.911 50 20 JCGD Cc1cc(NC(=O)CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)no1 1817240787 QSYZPCJPHZVEKS-CQSZACIVSA-N 483.315 0.374 50 20 JCGD CNc1nsnc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470120 JJMYCGBKYNJNRB-AWEZNQCLSA-N 455.309 0.602 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)[nH]n1)c1cccc(B(O)O)c1 1817477045 XGKXLFCNTPISDB-KRWDZBQOSA-N 487.285 0.112 50 20 JCGD Cc1cnn(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c1 1819403041 TUNCUXBFSOAEMS-QGZVFWFLSA-N 451.491 0.919 50 20 JCGD Cc1cc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n[nH]1 1819403346 GFSQZYXYDAHQII-KRWDZBQOSA-N 451.491 0.988 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCCC1)CC2 1819794691 BMZPOGBWSPRCJR-CYBMUJFWSA-N 457.560 0.853 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CC2 1819797787 KDNYWMXREOPGAO-MGPQQGTHSA-N 497.581 0.768 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826088424 XHANSMRRAWWPJY-STQMWFEESA-N 452.581 0.733 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)CC3)cc21 1827052417 YUUPYCXVDMZYTA-OAQYLSRUSA-N 493.373 0.244 50 20 JCGD O=C(c1cnc(O)nc1O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052973 QWQHCHUXYHDLCC-SFHVURJKSA-N 454.292 0.115 50 20 JCGD O=C([C@H](O)CCl)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C=CCN1)CCN2C(=O)OCc1ccccc1 1829039832 JRSNHLCENBQEBY-YCRNBWNJSA-N 476.961 0.566 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830363778 KWHBRQSTDSSBGE-AOMKIAJQSA-N 492.013 0.984 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732853 BWKUZLQEKYDTCL-OXJNMPFZSA-N 471.341 0.815 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1 1830779138 NAZXJPOBKKSNGE-XAUMDUMWSA-N 491.969 0.653 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1831659172 NVPAMWLEWPZNFL-FZKQIMNGSA-N 464.009 0.711 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CC1 1831874701 USEGQXXMALLHAY-FXAWDEMLSA-N 483.610 0.822 50 20 JCGD Cc1nccn1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551161 FVVLCOMWBMUCHR-JTSKRJEESA-N 499.996 0.780 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3nc(C)cc3C)CCO2)C1 1833038545 VDYBAECLUWLKLG-DMUURETOSA-N 485.545 0.090 50 20 JCGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c(=O)[nH]c1C 1833390365 WDZZNXXWFORYCF-ZMZPIMSZSA-N 457.325 0.240 50 20 JCGD O=C(C[C@@H]1CCCCO1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833680604 NMAZUAGBILICGY-QFIPXVFZSA-N 457.380 0.511 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cc1 1834820239 RTEONTRTXHYJLL-ICSRJNTNSA-N 471.348 0.970 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1834821641 RSSOHSALCMRSHI-LJQANCHMSA-N 470.320 0.708 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1 1835939285 KGTWJNYVPOIJBS-XMMPIXPASA-N 452.316 0.367 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3ccccc3=O)CCO2)C1 1835999371 JIADVTRNZPPXLW-DNVCBOLYSA-N 456.337 0.478 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836931043 QIWLHJCEJAAMDH-UHFFFAOYSA-N 473.379 0.141 50 20 JCGD CSc1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459140 KAMBVYBMPNEMRE-JOCHJYFZSA-N 486.554 0.186 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(-c3ccccc3)[nH]n1)CCO2 1838692409 OZHBEEQHFIZNDQ-DEOSSOPVSA-N 484.557 0.520 50 20 JCGD O=C(c1ccc2c(n1)OCCO2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199800 VCANMYHQHSXDNR-KBXCAEBGSA-N 474.283 0.613 50 20 JCGD Cc1cc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)ccc2[nH]1 1839616722 MCVCDJZIQZBAGC-XMMPIXPASA-N 471.558 0.919 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(CCOC)n3)C2)C1 1839964260 LDPQRYLKVDXUSR-KXBFYZLASA-N 473.368 0.773 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1840031976 JFZNEKJRQVFBDK-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C(=O)c3cccs3)C2)C1 1840183867 FJSZTSSKOHTCLI-YHCZKZFASA-N 478.571 0.316 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1840184396 JSBFLRAUJYVYBL-QFIPXVFZSA-N 492.964 0.431 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)sc1C 1840185795 SWTIGIDPQVBURU-HXUWFJFHSA-N 453.565 0.203 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1F 1840683266 BZQCJLHKZLCHIT-JOCHJYFZSA-N 466.510 0.277 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CS(=O)(=O)N1CCCC1)C2 1841924794 AHKDANKDOXNUCS-HNNXBMFYSA-N 493.026 0.748 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2CC[C@]2(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843015011 YGQMWCHMHZUBHX-CJAUYULYSA-N 483.374 0.831 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2 1843415863 VYIXPYKYVGGSGV-MFKUBSTISA-N 486.554 0.577 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265275 MUFYCKQAENKNSJ-QGZVFWFLSA-N 472.546 0.902 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CC(F)(F)C(=O)O)C2)NC(=O)NCc1ccccc1 1845038827 XZGXSPNBPHBKCP-UHFFFAOYSA-N 467.473 0.646 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@]23C[C@H]2CCN3C(=O)OC(C)(C)C)C1 1846192228 BWNRIHICINAEKK-WAIKUNEKSA-N 463.579 0.962 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCc1nc(C)no1)N(S(C)(=O)=O)CC2 726270831 GIVZDIZIBKKRTQ-OAHLLOKOSA-N 496.546 0.217 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)cc1 727364370 UNZIHLHUULUGKK-UHFFFAOYSA-N 464.456 0.756 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CN3C(=O)c4ccccc4C3=O)cc2)CC1 728214023 VCCSKMPOZSNFEJ-UHFFFAOYSA-N 457.512 0.362 50 20 JCGD COc1ccc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1CN1CCCC1 730569330 VACFEQYYXIIUFC-UHFFFAOYSA-N 460.560 0.716 50 20 JCGD COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)c1ccc(C#N)cc1 747175427 WTJQHCVXJQGUKC-QGZVFWFLSA-N 458.496 0.561 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CCc3ccccc3)c2)CC1 749804043 RSHPVRAEXANXLF-UHFFFAOYSA-N 458.540 0.933 50 20 JCGD O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@H]12)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 790768526 UHRFYXPFMPZMSD-LNLFQRSKSA-N 495.627 0.958 50 20 JCGD O=C(CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)c1csc(N2CCOCC2)n1 912851812 IQBBKPIWXNAMFE-UHFFFAOYSA-N 493.489 0.738 50 20 JCGD N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 916125047 AZXBYWBZRRRIIC-UHFFFAOYSA-N 490.563 0.719 50 20 JCGD O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)OC2)c1cccc(S(=O)(=O)N2CCOCC2)c1 917717482 GOTLYLQRXDQQHV-UHFFFAOYSA-N 481.508 0.001 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c1 919744429 BONWLRLCCHYXNH-GFCCVEGCSA-N 470.529 0.195 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(CCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 919883639 FJRBICDBHHTWGK-HNNXBMFYSA-N 460.578 0.167 50 20 JCGD Cc1ccc(S(=O)(=O)NCc2ccco2)cc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919884353 IMCIPZPXJXVMFX-CYBMUJFWSA-N 470.529 0.198 50 20 JCGD COc1ccccc1-n1c(C)nnc1SCC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886093 UBZVCNNYXMRWNX-LBPRGKRZSA-N 454.534 0.194 50 20 JCGD Cc1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1NS(C)(=O)=O 928993911 XSERDSKGEMEFEY-QGZVFWFLSA-N 463.468 0.511 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(C(F)(F)F)cn2)C1 1777801413 HDHRTGIUWNXIBK-OXQOHEQNSA-N 486.495 0.996 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cnc[nH]2)C1 1777992389 DPDPBHRAFLULQW-VWCSSDMBSA-N 455.519 0.600 50 20 JCGD C[Si](C)(C)c1cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)co1 1778993903 FBFNZVNIUGFMQY-JOCHJYFZSA-N 456.380 0.262 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cc1O 1779371324 OVSDFBNSRSJLLF-PXDATVDWSA-N 497.552 0.770 50 20 JCGD Cc1nccnc1C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967886 BAUWDGVDIUZRED-DEOSSOPVSA-N 481.557 0.575 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1n[nH]c2cccc(F)c12 1781393046 NFUNKPRYSKIDRR-NTKDMRAZSA-N 480.305 0.823 50 20 JCGD N#Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(Cl)c1 1781967617 NXUROTZHRNMZJW-JOCHJYFZSA-N 453.691 0.649 50 20 JCGD Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc2c[nH]nc12 1782260060 IBBUZNJUEVPBTD-QHCPKHFHSA-N 463.498 0.627 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782535584 NNJPZBCKVKWCMN-WPSZSDGUSA-N 467.331 0.356 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(N4CCOCC4)cn3)CCO2)C1 1783872568 BPDVXWGFUVBMFD-UTKZUKDTSA-N 452.939 0.616 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783933287 UIERAYFFOWUAMN-NBGIEHNGSA-N 487.601 0.788 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(=O)N(Cc4cccs4)C3)C[C@@H]21)[C@H](O)CCl 1784086087 SSDQQWRZOSLJFD-CENPHQPOSA-N 469.991 0.676 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(C(=O)N(C)C)c3)C2)C1 1785285170 MZYRWSLVKRXCHK-QHCPKHFHSA-N 459.547 0.205 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)n[nH]1 1785839632 OLNSIURYSIEJOE-GRLNEQDSSA-N 469.502 0.340 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)c2n1 1786984806 LFUBZGYLKRUQAL-QSFXBCCZSA-N 478.314 0.158 50 20 JCGD COc1cccc(OC)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984902 WXEMIBDLIMYZEW-MDKPJZGXSA-N 468.315 0.291 50 20 JCGD COCCn1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)n1 1787636251 QMSBLKSCSUYFLW-XWOIHUEZSA-N 485.545 0.257 50 20 JCGD CC[C@@H](C)[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724950 SSEWKHHJYRPSLQ-JJSQAQTOSA-N 489.617 0.719 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)OC(C)(C)C)[C@H]2C1 1790989830 KPOLSDXQDCRHHU-HRZAHRDASA-N 490.561 0.625 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1791143137 WLLJZMWWONQNDF-NBOOPKSLSA-N 499.374 0.353 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)n(-c2ccccc2)n1 1795739161 YYBVHQAKHCWIBZ-BBIADKPPSA-N 474.326 0.378 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(N2CCOCC2)cc1 1796189262 RKUHFJQSYWLQPI-UADZTWIMSA-N 463.343 0.769 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1796192947 CUIIHYGZACCZFO-HTUFRPJOSA-N 477.370 0.254 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CO)NC(=O)OC(C)(C)C 1796299525 BSESHKHUPUJFNR-AICCOOGYSA-N 478.384 0.635 50 20 JCGD Cc1occ(C(F)(F)F)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1796630205 MKLMIBHCTXXKMY-ZSBFGKGUSA-N 466.221 0.804 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ncccc1-c1ccccc1 1796649799 UQFGBRJEDLYFOZ-JHDGKUDLSA-N 471.322 0.945 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3nc(CO)[nH]c3c1)C2 1798440562 QCDSPAIDHMJMDQ-QDMKHBRRSA-N 463.498 0.619 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccn1C)C2 1798522645 IARYGQSMGYSFOA-ZSBFGKGUSA-N 457.443 0.771 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799347906 WZXDUTQDASORLQ-PPCPHDFISA-N 468.320 0.152 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCC(=O)N1)C2)NC(=O)NCc1ccccc1 1799864677 GQSBRAKHQWKSDU-FCGDIQPGSA-N 456.547 0.249 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1ccccn1 1800206465 MVURVMMGCZGAFO-XGYYKPKNSA-N 467.364 0.963 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1c(O)nc3ccccc31)C2 1801012463 HCLPYDIMNFXMGB-GPVSGQMNSA-N 486.573 0.485 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1 1801447080 HAHZTNPRSRCLBP-RODWMJHOSA-N 487.420 0.588 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CCC2(CC1)OCCO2 1801502340 XUDLAIAKVIDQCZ-BJWYYQGGSA-N 457.531 0.870 50 20 JCGD COCC1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1803537807 SYPFAEWLVBYPHT-APWZRJJASA-N 452.515 0.826 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1806043048 IVMJBXATVCPEEA-YWZLYKJASA-N 476.497 0.512 50 20 JCGD Cn1nc2c(c1C(=O)N1CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]1c1cccnc1)CCC2 1807364029 FFYCXUOPGUZICD-GCJKJVERSA-N 473.342 0.617 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807368441 TUFLKGIHCUGQSP-YKSBVNFPSA-N 475.358 0.674 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376026 RFMAPPSFLPZILE-HTAPYJJXSA-N 470.298 0.666 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cccnc3C(N)=O)C2)CC1 1807379614 DRLAAMHFHPLHRW-UHFFFAOYSA-N 465.514 0.338 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)nc2N1 1807938584 WIGJMFOOLLLIPW-AUSIDOKSSA-N 499.336 0.675 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1810239345 LCZTXHKQZFCYHU-WRWLIDTKSA-N 461.567 0.168 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cccn4c(O)nnc34)C2)CC1 1810769224 KJTKMNAJBWQLMW-UHFFFAOYSA-N 463.303 0.273 50 20 JCGD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)cn2[nH]cnc(=O)c12 1811302619 ATSYZQIATZZOTC-LESCRADOSA-N 458.906 0.645 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2nn[nH]c2c1 1812298292 PBEATBLHYXGAOI-AVRDEDQJSA-N 470.298 0.666 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813091097 LDFSXQOSEWNMLO-YZGWKJHDSA-N 457.361 0.195 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ncc(Cl)cn1)CC2)c1ccc(B(O)O)cc1 1815337250 PSOWFPYRFWOQBO-ZDUSSCGKSA-N 457.708 0.806 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339562 HBIAAPXZLOPVJT-XJKSGUPXSA-N 465.344 0.944 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347644 ITLIJPFRSADGAW-HNNXBMFYSA-N 488.375 0.964 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CC(=O)NC2=O)n[nH]1 1815664316 RPTHXPPTYLAFOT-CMPLNLGQSA-N 455.313 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc[n+]([O-])c2)n[nH]1 1816057186 JWQKDZLQJSLBOA-QGZVFWFLSA-N 450.459 0.661 50 20 JCGD O=C(CNCP(=O)(O)O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1 1817235467 APAMHFWSMZKFSB-CABZTGNLSA-N 456.209 0.817 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474120 MRHLZWRXHYUVFP-INIZCTEOSA-N 460.321 0.302 50 20 JCGD N[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)c1cccnc1 1817474494 HBWYGHHLBTXDHZ-UYAOXDASSA-N 462.319 0.881 50 20 JCGD Cn1nc2c(c1C(=O)Nc1cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n1)CCC2 1821529419 AKSFAIPNXFSYHL-IBGZPJMESA-N 462.319 0.931 50 20 JCGD CN[C@H](CC(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1)C(=O)O 1826940107 DJHXNNRQISZFLE-KMXWFIRGSA-N 474.562 0.803 50 20 JCGD CN1CC(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CN(C)NC(=O)NCc2ccccc2)CC3)C1 1827272815 XSATVLQVIRUNAA-QGZVFWFLSA-N 485.614 0.963 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1829641286 OZPGREJEMOVKMK-FQEVSTJZSA-N 466.542 0.931 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C)COC1)CCO2 1830026843 SOAHAACARZLUHS-YCRPNKLZSA-N 475.970 0.611 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)C(C)(C)C)CCO2)C1 1830620952 UGPQSYOLKZQYTF-WJONJSRFSA-N 492.013 0.982 50 20 JCGD O=C(Cc1cc(Br)ccc1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732749 AAWGRLGOVBYIOI-QFBILLFUSA-N 491.766 0.753 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)[S@@](=O)c1ccccc1 1830736552 TYHITKHYGNNNMS-CYVBDOQJSA-N 458.964 0.239 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccoc3C1)CCO2 1830933447 GRJIGEOMWUBPNK-XDHUDOTRSA-N 483.525 0.153 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1831437437 ALOBILJIDVSCSX-CXAGYDPISA-N 467.382 0.380 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1832887272 FTZKSFKLPMYZGW-QHCPKHFHSA-N 487.582 0.758 50 20 JCGD C[C@](O)(C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(F)(F)F 1833640681 QJVKPHUISYLPSA-FQEVSTJZSA-N 486.495 0.184 50 20 JCGD Cn1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)cn1 1834168623 TWAOOMFCAHXXLT-KKSFZXQISA-N 485.969 0.622 50 20 JCGD Cc1nc(C)c(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1834801268 XHLWCQQFHMUDGR-UHFFFAOYSA-N 470.404 0.939 50 20 JCGD C/C(=C/C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1)C(=O)O 1835118027 IXCNPKIXBGSXSY-GPTGMBCZSA-N 472.546 0.723 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835933644 FFDZHQJCXQNZME-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD Cn1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc2ccccc21 1835936846 GMLNGUIIVDQMLV-RUZDIDTESA-N 477.326 0.242 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836128677 YUAMVTWIYMIIAY-FQEVSTJZSA-N 453.568 0.317 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cccc4nccn34)CC2)CC1 1836490148 BUOIWJPKETYUFP-UHFFFAOYSA-N 469.590 0.893 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ncsc13)CCO2 1837071172 YHKAZXZNUWXDJR-QHCPKHFHSA-N 481.339 0.360 50 20 JCGD Cc1cc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(C)c1 1837460392 FXKINQNXYSXURP-VWLOTQADSA-N 481.553 0.994 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]cc3[N+](=O)[O-])CCO2)C1 1837799022 MMEKBGFYRUVNKE-BDJLRTHQSA-N 460.285 0.561 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1 1838605142 QMWQFRDSGINESY-KKSFZXQISA-N 479.921 0.766 50 20 JCGD O=C1Cc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc2N1 1839200418 HSCHHDLIFWJRPF-APWZRJJASA-N 470.295 0.942 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])c(O)cc3C)CCO2)C1 1839466959 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CN(CC(=O)N1CC2(CCCN2C(=O)c2cc3ncccn3n2)C1)NC(=O)NCc1ccccc1 1844036183 LWSHQZKOFRTVAP-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD CCOC(=O)N(CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)Cc1ccco1 1846530381 ZTFSWPBXSNJYRX-UHFFFAOYSA-N 469.303 0.435 50 20 JCGD COc1ccc(NC(=O)COc2ccc(C(=O)NNC(=O)C(=O)NC3CC3)cc2OC)cc1 9889721 JEHQGJHVUNEYDA-UHFFFAOYSA-N 456.455 0.761 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)cc1 17407163 GDQSTILEPXPCRD-UHFFFAOYSA-N 482.584 0.763 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)cc(OC)c1OC 18227632 UTBSGVMEDRVCSU-UHFFFAOYSA-N 482.515 0.147 50 20 JCGD COC(=O)c1ccc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 28196425 AXNLHVFSQFBICH-UHFFFAOYSA-N 497.551 0.426 50 20 JCGD O=C(COC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)NNC(=O)[C@@H]1COc2ccccc2O1 728339715 ABKYVTGAXQKZJV-QRWLVFNGSA-N 497.460 0.551 50 20 JCGD CC[C@@H]1Nc2ccc(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc2NC1=O 729717665 IFOPTNMFPBCPQH-SCLBCKFNSA-N 454.439 0.973 50 20 JCGD O=C(COC(=O)c1sccc1S(=O)(=O)N1CCC(CO)CC1)NNC(=O)c1ccccc1 745499630 KSKGDLJKDXBQES-UHFFFAOYSA-N 481.552 0.759 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)NCCN2CCCS2(=O)=O)cc1 747200309 BKBBRGVJAIBZIF-LGMDPLHJSA-N 486.554 0.493 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)C1CCN(S(=O)(=O)c2cn(C)c(C)n2)CC1 747704150 XWLOYUSTYDURCM-UHFFFAOYSA-N 459.532 0.547 50 20 JCGD Cc1ccc(OCC(=O)N2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)cc1 748823813 DOCNSBVRGGZFSQ-UHFFFAOYSA-N 488.570 0.866 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1 781252220 CPEHPGIJMLIFBA-UHFFFAOYSA-N 467.887 0.825 50 20 JCGD COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)ccc1OC(C)C 912953176 TYEJGWYYEYGNQH-HUUCEWRRSA-N 453.517 0.279 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1nnc(O)c2ccccc12 913578837 DKIIQCFERCBJTL-UHFFFAOYSA-N 480.300 0.837 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(NC(=O)C(F)(F)F)cc1)c1ccc(-n2cnnn2)cc1 917727868 OUNXFXMHUINSGQ-UHFFFAOYSA-N 455.378 0.786 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cncnc1C(C)C)c(=O)n2Cc1ccccc1 918254312 BYJZVUVQABYFMI-UHFFFAOYSA-N 490.524 0.803 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)NC3CC3)CC2)c1 920766487 GKFLLJNXXSOQLY-UHFFFAOYSA-N 451.549 0.409 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H](C)OC[C@H]1CCCO1)c(=O)n2Cc1ccccc1 921023920 IFHNFHMQMVPLRV-FUHWJXTLSA-N 498.540 0.159 50 20 JCGD O=C(NNC(=O)C1CCN(C(=O)c2ccc(Br)cc2)CC1)N[C@H]1CCS(=O)(=O)C1 1317993416 FSVPEOCRJDIXMI-HNNXBMFYSA-N 487.376 0.819 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4s3)C2)C1 1777752392 KOTYJBFXLOJZGX-JOCHJYFZSA-N 451.313 0.733 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1778264078 LWXLCJJPIJYYOF-RUZDIDTESA-N 464.327 0.378 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc3cc(Cl)ccn13)CCO2 1779030059 GELPMTGENBQFDX-QFIPXVFZSA-N 483.916 0.744 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ncccn13)C2 1779372459 JISIUOYRISJLAU-WZONZLPQSA-N 478.513 0.169 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C2)C1 1780237007 PZIKDINEFJWFGS-OAQYLSRUSA-N 477.474 0.140 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969276 VODGZQMUMFKHGV-CYFREDJKSA-N 498.588 0.090 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)NC[C@@]13CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C3)C2 1781593033 YFFRJDLUAUFMNV-SEYDDUDXSA-N 496.992 0.736 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1782206908 YPWRTIOUXLSXPM-IPALMDDQSA-N 453.305 0.807 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=C/c2cnccn2)C1 1782618154 IXWDXMVOULCFLT-ROQWUKPNSA-N 465.514 0.316 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CNC(=O)C3)C2)C1 1783163311 SEBKIKANGPCBPB-SPLOXXLWSA-N 460.443 0.100 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CCO2 1783527540 CVDFMPJGEFOWOK-LXIYXOSZSA-N 464.357 0.485 50 20 JCGD 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CC(C)(C)OC(=O)N1CCN(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CC1 1804083226 FQFFHTSTYMOSDP-YYIAUSFCSA-N 458.987 0.777 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCNC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1804464569 XWUIGBBGBZFHBC-JPYJTQIMSA-N 483.573 0.609 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1 1804811646 YLAVHOYEZVTBHN-QRWLVFNGSA-N 488.508 0.207 50 20 JCGD O=C(Cc1cscn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807487922 FNVTUCGFPIGLMZ-LAUBAEHRSA-N 450.329 0.780 50 20 JCGD COc1cccc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)n1 1809968834 GJNBFGLZWQTLKB-UHFFFAOYSA-N 451.332 0.858 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1 1810303296 PSSHXCDATDQRGD-IIBYNOLFSA-N 485.508 0.756 50 20 JCGD CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1 1811552700 NWHBTXFNHSPCJH-GHTZIAJQSA-N 476.346 0.741 50 20 JCGD Cn1cc(CCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1 1817471502 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O=C([C@@H]1C=CCN1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829039828 JRSNHLCENBQEBY-SFYKDHMMSA-N 476.961 0.566 50 20 JCGD Cc1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1C 1830532968 CKXYYVQIJVVLTA-IFXJQAMLSA-N 457.369 0.758 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1830540516 QNPXAOPHJRPWJI-MEDUHNTESA-N 460.285 0.419 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1830570279 CBSQNRHUGBSSPH-IFXJQAMLSA-N 494.383 0.113 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)ccc1[N+](=O)[O-] 1830738492 QEKINSOUHJYGEZ-BEFAXECRSA-N 457.867 0.273 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2 1831701279 DZRNRZSYEJWQRE-CBNMVNINSA-N 482.264 0.169 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(OC)nc3)CCO2)C1 1832586168 VFZVPAKWJYRMTR-DYESRHJHSA-N 455.939 0.733 50 20 JCGD CC[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1834751456 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C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccc1 1837463035 YOIKKPRSEPDTAT-OSPHWJPCSA-N 467.526 0.559 50 20 JCGD Cn1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1837489346 GGOVTLICQSDFLL-UHFFFAOYSA-N 455.519 0.345 50 20 JCGD Cc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n[nH]1 1837583722 BVDJVCSZVJLZIE-JTSKRJEESA-N 499.996 0.849 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1 1838421558 CCUQOEVWCSZQDN-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1839146212 WQRFPODDWXAYMR-VBKZILBWSA-N 453.927 0.104 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(N4CCOCC4)n3)C2)C1 1840033070 RTSCMWQGEYRRGJ-KKSFZXQISA-N 497.390 0.772 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840182694 PXLMBZGWTRVMME-HSZRJFAPSA-N 463.579 0.394 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1 1840185179 MTGSBGGWCCTJKD-HSZRJFAPSA-N 458.515 0.876 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012371 IVRVMCXFWHDYQE-BWTSREIZSA-N 469.347 0.296 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@H]3C[C@@H]3N1C(=O)OC(C)(C)C)C2 1846386490 RNFITVOHEDBLBA-YESZJQIVSA-N 463.579 0.961 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)c1ccco1)NC(=O)NCc1ccccc1 1847279767 YUVSIGOATXHTDV-BBTUJRGHSA-N 455.515 0.861 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1)C(=O)NC1CC1 9889278 DHOLNAOGZZEPCY-UHFFFAOYSA-N 462.450 0.532 50 20 JCGD O=C(CNC(=O)c1cccc(Cl)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 15524926 VORSHPMJTNPFAA-UHFFFAOYSA-N 480.930 0.552 50 20 JCGD CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)C2=O 17406216 XMUZXXCWGSSJSU-UHFFFAOYSA-N 493.586 0.654 50 20 JCGD CN(C)N(C(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)[C@H]1CCS(=O)(=O)C1 728178914 MHYNSJGEKOHTEF-NSHDSACASA-N 459.468 0.356 50 20 JCGD C[C@@H](NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)[C@@H](C)N1CCOCC1 729624138 SQZVQQDVXIATJM-QZTJIDSGSA-N 497.618 0.080 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN1CCN(c2ccncc2)CC1 748342590 BIWYOVVEDCFYCQ-UHFFFAOYSA-N 488.618 0.839 50 20 JCGD O=C(NNC(=O)c1ccc(-n2cnnn2)cc1)NNC(=O)c1ccc(Br)s1 813543105 PKTPGNIJMWLBEE-UHFFFAOYSA-N 451.266 0.775 50 20 JCGD O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1I)N1CC[C@H](B(O)O)C1 864234126 NCAREPQQPYQYIM-NSHDSACASA-N 494.116 0.001 50 20 JCGD CS(=O)(=O)Nc1ccc(/C=C\C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 875251683 LSKSHTXKIYIOTF-IBWPDUFMSA-N 475.479 0.602 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN2S(=O)(=O)c2ccc(C)s2)n1 906883195 FEHWNUWVGDSGGB-ZDUSSCGKSA-N 486.597 0.908 50 20 JCGD O=C(CNS(=O)(=O)c1cccc(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 913151640 RUFJBYJOWKSOTM-UHFFFAOYSA-N 484.531 0.350 50 20 JCGD CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)o1 915063171 FTHDJWCFKZEXTD-UHFFFAOYSA-N 481.494 0.964 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H](C)C(=O)N(C)C)c2)cc1 916577542 KYOWQTKCMAQMEM-ZDUSSCGKSA-N 463.516 0.917 50 20 JCGD Cc1cc(C)c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1C(=O)O 917720684 YNRUOJFZAOIWAN-UHFFFAOYSA-N 455.514 0.875 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1 918140097 QKFZTAUIMSBLRH-UHFFFAOYSA-N 483.547 0.113 50 20 JCGD CC[C@@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1OCC(=O)NC 918222184 SJNQHXFHFFENPM-QGZVFWFLSA-N 452.475 0.882 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCS(=O)(=O)c1ccccc1 918229949 XXTQOUCYYGLQPW-UHFFFAOYSA-N 453.546 0.706 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCN1C(=O)c2ccccc2C1=O 919788667 STDSKLUEVSDAGL-UHFFFAOYSA-N 464.526 0.825 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3cccnc13)C2 1778091191 QJOPDACPJGRDQX-VFHFUPNESA-N 492.540 0.991 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)CC(N)=O)CCO2 1780095240 LHNDZRQZIROZJO-ZSEKCTLFSA-N 462.459 0.475 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CN3CCOC3=O)CCO2)C1 1780095493 PUXIKGFLHCOFEC-NRFANRHFSA-N 476.442 0.416 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780775015 UEVKXGPJMWFNBH-DKEWWPDHSA-N 486.342 0.799 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)Cc3cncnc3)CCO2)C1)NC(=O)NCc1ccccc1 1780968724 JHUMESDGZVKZHL-XMMPIXPASA-N 481.557 0.195 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1781238901 NLPVNCIGQPEEMJ-XMMPIXPASA-N 480.525 0.384 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccnc1C(N)=O)C2 1781997707 GHYFWZQXEGQCJO-VNBZBWLYSA-N 454.325 0.486 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cnc3ccccc31)C2 1782214048 KZJWOFZVKQUTSZ-HYBUGGRVSA-N 470.574 0.923 50 20 JCGD Cc1cn(CC(=O)N2CCO[C@]3(CCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)c(=O)nc1O 1782868256 ZNFSEHNRTPBIKS-JPNNDLKFSA-N 499.474 0.973 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@@]2(CN(C(=O)CNC(N)=O)CCO2)C1 1782871241 QHZDXPAXBATROY-YWMGUWEJSA-N 476.331 0.854 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(-c4ccccn4)nc3)[C@H]2C1 1785507437 OHPDNGWLHGVGPR-QRFRQXIXSA-N 481.557 0.505 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncc(Cl)cn3)[C@H]2C1 1785817571 LEVPYPJYLIBDDV-JKYBXLBGSA-N 473.921 0.857 50 20 JCGD Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)co1 1786061391 GCLUEGXROKAVQR-ZJOUEHCJSA-N 484.557 0.923 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C[C@@H]21)c1cccc(B(O)O)c1 1786984203 QCFGBIMPPZARMK-DCPHZVHLSA-N 482.733 0.803 50 20 JCGD Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(C(F)F)n1 1787736661 MKBCJUWDMLRYER-PJODQICGSA-N 477.472 0.263 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc2cc(O)ccc2n1 1787867697 GBALWOUXIPKNEY-NYDSKATKSA-N 475.310 0.527 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21 1788611611 MIHWMYZSSGXJGZ-LRGYGIHKSA-N 498.584 0.070 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4[nH]cnc(=O)c4c3C)[C@H]2C1 1789177059 LRDIOTQYHGMFHV-HNKHHVNMSA-N 451.911 0.178 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1(c2ccc(NC(=O)[C@@H](O)N3CCOCC3)cc2)CCC1 1789553331 SIGCXKLIDLKIIK-GRIZMQLISA-N 482.541 0.905 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)ccc1C 1789619757 DHXKODRXRCRILH-LRQRDZAKSA-N 467.526 0.909 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3NC(=O)NC3=O)C[C@@H]21 1790693837 PEXMTVGOUMUUQS-UGNSWCHMSA-N 487.463 0.450 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC(=O)NC1 1792578824 UZALTVAVJDORTJ-JBXGNFEISA-N 472.970 0.234 50 20 JCGD CCOC(=O)c1c(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c[nH]c1C 1793125057 KKMXTNLCPNHBDL-YYAJDYIMSA-N 455.939 0.622 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3cnccn3)c1)C2)c1ccc(B(O)O)cc1 1795735257 SOLDWKUMTOIXGO-JHDGKUDLSA-N 472.310 0.340 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC(=O)OC(C)(C)C)C2 1796439576 MSWGJIYZQGGHMY-IHHIPJHASA-N 461.519 0.442 50 20 JCGD COC(=O)[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)NC(=O)OC(C)(C)C 1800912077 QWEUDZKACYQOJN-BUONHZGMSA-N 465.906 0.567 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Br)cn1)C2 1801009659 YSRWWCNZUAJUEM-VTEUUUEMSA-N 482.379 0.349 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC[C@H](C(F)(F)F)CC1 1801994156 XRPXOZFACVMSJW-XDEXSSCRSA-N 468.281 0.938 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1804094280 NURPOKPYDGRPJX-NRXGSXMXSA-N 456.330 0.876 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1 1804417188 GGIPHYHFBFVMKM-MGPUTAFESA-N 493.484 0.205 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ncc(Cl)cn1 1805233035 VVUZIDANUVPLIN-VQIMIIECSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370887 MRVXTEHCXRPFBF-NFBKMPQASA-N 450.348 0.567 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807371347 TUTNMKBIKWHANC-HWOYEPTDSA-N 451.288 0.200 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374882 KTUXJTAGZJMEKU-PBHICJAKSA-N 488.235 0.532 50 20 JCGD CCOC(CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)OCC 1807375681 UMWYGRWLFXSDGE-XXBNENTESA-N 469.347 0.870 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOCC2)[C@H]1c1cccnc1 1808413976 DEPKQNWCUUKDEB-JUAHTANYSA-N 481.557 0.554 50 20 JCGD COCCn1nccc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1808636399 TXYREJNFPGKWKF-KNQAVFIVSA-N 477.330 0.238 50 20 JCGD O=C(O)c1cnncc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809970901 DCIJKYUBGYENFU-UHFFFAOYSA-N 452.276 0.013 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1C 1810295150 RBOZZXKGRJUZQH-VGSWGCGISA-N 476.541 0.684 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810309311 QHZDKWRCBBYCOB-DZFGPLHGSA-N 481.557 0.705 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)CC1 1810914766 SCYNACHPHSXQAM-HSZRJFAPSA-N 461.371 0.926 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(O)nc2)[C@H]1c1cccnc1 1811462270 YIZAMWROQDBKJK-MGPUTAFESA-N 461.482 0.814 50 20 JCGD CC(=O)O[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(C)C 1815343996 BACQTBVARQJPII-QAPCUYQASA-N 459.333 0.636 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccn(C(F)F)n1)CC2)c1ccc(B(O)O)cc1 1815344243 PBXQJPJTXUVNLK-LBPRGKRZSA-N 461.259 0.954 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnnn2C)n[nH]1 1816034431 FWFPHQOVOQWAIE-ZWGXDWAISA-N 452.479 0.978 50 20 JCGD CCOc1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cn1 1816133243 MNRAEWOIQLVDBT-GOSISDBHSA-N 464.291 0.898 50 20 JCGD COCCn1nccc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1817587288 WVMLJDUOSWHHIG-OAHLLOKOSA-N 469.332 0.205 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2ccnn2)[nH]n1 1818111863 LWZPBWDENVBFDN-ANDSAHIGSA-N 452.479 0.828 50 20 JCGD Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1821311383 LFTWRALXNTUOMY-NSHDSACASA-N 467.511 0.380 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@@](C)(O)CC(=O)O)[nH]n1 1822416802 PZVCHYIZNXLYFL-JLTOFOAXSA-N 452.512 0.391 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3nc4ccc(F)cn4n3)sc2C1)c1cccc(B(O)O)c1 1824390042 LQKJDZBZDHCDFV-CQSZACIVSA-N 480.290 0.544 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1 1824773846 JVGPGAFBIZNYTC-SFHVURJKSA-N 461.563 0.294 50 20 JCGD CN[C@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1)C(=O)O 1827680922 LATQGNPMESKXQB-NTAWZZOOSA-N 474.562 0.803 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccn3c(O)nnc23)CC1 1828926282 CRSXQWUSNXGKFU-LJQANCHMSA-N 492.540 0.981 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1830543202 MKEGSVPFXKYNBV-DJJJIMSYSA-N 499.387 0.857 50 20 JCGD O=C(c1ccc(OCCCO)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830730590 AIZXHYUGTTXFON-NQIIRXRSSA-N 456.923 0.118 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccc(F)cc1 1830733481 NFSJKGTXIYEDKH-LVCYWYKZSA-N 471.913 0.059 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cn1nnc3ccccc31)CCO2 1832208422 ORIJNUIYAVLGRE-OAQYLSRUSA-N 461.595 0.739 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1832840183 GQIZAHFCGYIOTO-FGZHOGPDSA-N 457.380 0.905 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CN3C(=O)CNC3=O)CC2)CC1 1833676100 RJVMRFHJIUTTAK-CYBMUJFWSA-N 472.384 0.141 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1833712967 KLGSZAAEPNGDON-LJQANCHMSA-N 477.071 0.696 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncn(C)n3)CCO2)C1 1833881928 FTXOAMKSABZNAB-NRFANRHFSA-N 488.457 0.032 50 20 JCGD O=C(Cc1ccc(Cl)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835057825 VFZUSQKVUCJOPE-HSZRJFAPSA-N 472.734 0.333 50 20 JCGD CC(C)n1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835204302 HWLAZSICEJQOTR-UHFFFAOYSA-N 483.577 0.357 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1 1835755909 UOUSDDSYBAJRKD-HXUWFJFHSA-N 485.654 0.904 50 20 JCGD Cc1cccc(C)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931925 HBJYTCGXDRDLQX-XMMPIXPASA-N 452.316 0.367 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(Cl)c1 1835934172 OGUDYVGXZNFKCS-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3scnc3C3CC3)C2)C1 1835935307 NUKZGQLWDWYCQR-QFIPXVFZSA-N 471.344 0.084 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3c3ccccc3)C2)C1 1835939862 LHHKPJRPQMDKAD-OTNCWRBYSA-N 464.327 0.240 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459375 DXUJDIUPSDMMGL-HSZRJFAPSA-N 453.499 0.377 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837461287 SOLYFYBWPVDJSA-DEOSSOPVSA-N 496.524 0.027 50 20 JCGD O=C(c1ccc(O)nc1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921313 XOMLIPUWDCCXME-UHFFFAOYSA-N 453.304 0.393 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CNC(=O)C3)CC2)CC1 1838102977 JOEPGOQQTSZPDT-KSXCTLEASA-N 472.546 0.255 50 20 JCGD Cn1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc2c[nH]c3nccc-3c21 1838483669 RINGVQIYHTWJMP-VGSWGCGISA-N 475.933 0.676 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1 1838536010 HQHRPQLOXFKZTL-KXBFYZLASA-N 456.337 0.629 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(O)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1839148784 JSAPMNUEQJFTDB-WQTXXOFMSA-N 489.997 0.832 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840106525 PGIWLUKZZHUNOA-HNAYVOBHSA-N 460.369 0.629 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C2)C1 1840149545 SFQIHUMDZBGJNJ-XLIONFOSSA-N 455.895 0.848 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(F)cc3)C2)C1 1840183287 XDRBFRZGAODQPT-YOSAUDMPSA-N 476.549 0.759 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(F)C[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014087 WAFLRHYQVVNXAL-KRWDZBQOSA-N 493.316 0.828 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265502 JNQAYGGACDVZDZ-INIZCTEOSA-N 460.535 0.805 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1 1845940936 RVJOKQXURPCSPZ-CVEARBPZSA-N 451.365 0.789 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCOCCNC(=O)OC(C)(C)C)C2 1846384024 VLJFKNRAWRXRHR-UHFFFAOYSA-N 469.583 0.494 50 20 JCGD Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=S)NCCc1cccs1 11523610 LXJKBZSSDAABFN-UHFFFAOYSA-N 457.603 0.459 50 20 JCGD CCCCn1c(CCC(=O)NNC(=O)CN(C)C)nc2cc(S(=O)(=O)N(C)C)ccc21 727761474 HMPWMPCPHWJHKQ-UHFFFAOYSA-N 452.581 0.728 50 20 JCGD CN1CCC(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 728752731 RFLXDROWCBSPBY-UHFFFAOYSA-N 453.565 0.383 50 20 JCGD Cc1oc2ncn(C)c(=O)c2c1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 750541852 AKMQGQIDXWEVAC-UHFFFAOYSA-N 459.484 0.694 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)C[C@H](C)O1 912920824 DUABQMIDVXXRGF-STQMWFEESA-N 466.482 0.630 50 20 JCGD O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 913606510 YMKXWHLSZKWFSO-STEAMIEHSA-N 472.523 0.039 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2c(C)nc3ccccn23)cc1 916650099 ZPAPDWGJMRKUSU-UHFFFAOYSA-N 460.516 0.712 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)Cc1c(C)noc1C)N(S(C)(=O)=O)CC2 916829373 IIWHQPVGXMRGGT-KRWDZBQOSA-N 480.543 0.948 50 20 JCGD COc1ccc(OCC(=O)NNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)cc1 918137861 IXUSTONIIBHORG-UHFFFAOYSA-N 465.507 0.484 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)cc1 920297375 DXSQYZIFQWHBMW-CYBMUJFWSA-N 484.556 0.585 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cc[nH]n4)n4ccccc34)C2)C1 1778373282 IBKZUHFWKJSCJE-SANMLTNESA-N 499.336 0.767 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)CC1 1778754806 NXSUICBRNJPVIM-IIDMSEBBSA-N 453.964 0.706 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1)C(C)C 1778797578 USGUTUBOJVQTMA-LUIQLVGOSA-N 461.519 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCCC(=O)Nc3ccccc3)CCO2)C1 1779028527 GAOAMWCNOOIKMW-RUZDIDTESA-N 494.552 0.938 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779294718 LHKUKLSQUGCACV-QRWLVFNGSA-N 459.616 0.553 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)n1cnnn1)CCO2 1780099175 XJTBISPENVOLPN-RNODOKPDSA-N 473.446 0.211 50 20 JCGD COC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968497 BAGBDNWFZGZJRE-HSZRJFAPSA-N 475.546 0.116 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3cnccn3)CCO2)C1)NC(=O)NCc1ccccc1 1780970470 UJZFMGCMBVVCJD-NJFIGMEYSA-N 493.568 0.666 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3cc(C)c(O)nc3=O)CCO2)C1 1783354788 WORNWGJWGHPMFH-UGSOOPFHSA-N 457.325 0.261 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](CC1CC1)NC(=O)OC(C)(C)C)CCO2 1783937047 DZRBTIGHHSNZIZ-HOYKHHGWSA-N 495.621 0.883 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccc(C(F)(F)F)cn4n3)C[C@@H]21)[C@H](O)CCl 1784090084 QIRVCXMLTAQIHG-DEQVHRJGSA-N 475.855 0.941 50 20 JCGD Cc1cccnc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785202451 YXWSTVGSXCREJL-VCOUNFBDSA-N 451.332 0.296 50 20 JCGD CC(C)c1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)co1 1785542290 USVRZWQDBZDQAF-OWQGQXMQSA-N 456.503 0.704 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1 1785623827 PAJQZUOOPFRQNX-JZKQVHKSSA-N 493.964 0.693 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)n(C)c(=O)n4C)[C@H]2C1 1787962548 WUNSVEPSOGWXSU-GGXPGOJBSA-N 464.950 0.724 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnnc3O)[C@H]2C1 1789117134 KDANRZDWOAPPLX-IXDGSTSKSA-N 485.453 0.923 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790576998 UKZPETBVSJUCEO-XEHJXZTKSA-N 451.332 0.234 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3[C@H]4C=CS[C@H]43)[C@H]2C1 1790625750 ZYFVKSLQUNYTNJ-MLOSVMDKSA-N 457.556 0.975 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnncc3C(=O)O)C[C@@H]21 1790960345 CCZVFXRWGDXVHI-HPEDKQMDSA-N 455.309 0.942 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1 1791599953 RDCZSHDMBMTWAO-HNNXBMFYSA-N 467.592 0.821 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792978894 QNHFPFNXMPMJHK-NLNMYJFZSA-N 467.950 0.738 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792982594 JYOJGEXTVQVHLO-BHLQKMAXSA-N 457.955 0.289 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2F)[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792982615 KJCBILCQPXVFEE-KVBVCBKMSA-N 489.972 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1 1793050181 RWSJGLRXVBYGIZ-GUZHFODBSA-N 485.491 0.970 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1793600110 UILVQIJRKRPSAU-CLWJZODNSA-N 481.594 0.418 50 20 JCGD CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCCNC(=O)C2)n1 1794504392 FRNUIQGYISKTFA-CWPLJXCYSA-N 477.993 0.876 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnsc1C1CC1)C2 1796440685 YASVWOIDXYLHQU-GRSZLDEUSA-N 471.543 0.753 50 20 JCGD COC(=O)[C@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1796445590 FGCJWBBVMLCXIO-QKLKPHDQSA-N 487.557 0.689 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1cc(C)cn1)C2 1796446136 MUQHTMXREFWLJL-UXLXASSBSA-N 455.519 0.476 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc2c(c1)CCCO2 1797243543 RESZVTLUNQGCKX-FEJSZKPUSA-N 479.537 0.456 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(-c2cc[nH]n2)n2ccccc12 1797321286 LZACISBKILSTAX-MRSFGVLCSA-N 499.336 0.526 50 20 JCGD COC(=O)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)s1 1799808578 FWJKPZWUWLDULO-BJWYYQGGSA-N 456.329 0.709 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2 1800763368 YODCEXDGYRRUKM-AUGJRDSBSA-N 490.395 0.731 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)nc1)C2 1801009589 PIQCMGAPKYGFTF-ZSBFGKGUSA-N 457.453 0.677 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](Cl)COC)[C@H]1c1cccnc1 1803506782 LWOGVWFAYOCTFD-IWCQGFGOSA-N 460.984 0.669 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1804295730 ICOHUOQIHNLFSR-AIEDFZFUSA-N 461.943 0.681 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc1 1807369584 PEAIZBGLCZJPDX-WMZHIEFXSA-N 473.342 0.856 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1CC[C@H]2CCC(=O)N2C1 1807736638 VEAFTVBHJKPHSB-JXKFMYIUSA-N 490.369 0.482 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1 1808390812 KPHDBNZSCQJBEW-UZUQRXQVSA-N 485.545 0.786 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810295324 SGQWAXKOXKGONR-AHRSYUTCSA-N 467.530 0.314 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1 1810302107 GEHAZVQPAYJZKB-YWZLYKJASA-N 485.508 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1 1811315592 MMKLTNLDDAJPKI-OXQOHEQNSA-N 468.514 0.898 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnn3ccncc23)[C@H]1c1cccnc1 1813069674 AJTBBXMKJIXHBC-VGSWGCGISA-N 464.530 0.817 50 20 JCGD CCCNC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470053 HMZDCXPSSYOWEO-GOSISDBHSA-N 455.324 0.702 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)c1ccco1)CC2 1819796996 LBPUYJKCZYHBOE-LLVKDONJSA-N 483.510 0.390 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2 1820117764 BJAIXUGPBXQCQJ-QWHCGFSZSA-N 452.581 0.733 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)NC(=O)c1cnccn1)CC2 1825999886 GCZCZDMWIMBPLQ-SRVKXCTJSA-N 466.951 0.917 50 20 JCGD N=C(N)SCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551729 TUELMJIWNOGSQT-KKSFZXQISA-N 498.005 0.665 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F 1830152032 YRKTUBKZMBYFOQ-JOCHJYFZSA-N 466.510 0.277 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1830544365 WIFBYLOJLMGTAP-ACJLOTCBSA-N 473.324 0.048 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)C(C)(C)C)CCO2 1830630262 JFDNLKDHSKOFGZ-XXBNENTESA-N 493.513 0.997 50 20 JCGD CCc1c(Br)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)nn1C 1830722577 DLCKQCUILZHVGN-UGSOOPFHSA-N 493.786 0.415 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc(C)c(O)nc3=O)C2)C1 1831660123 YHCKQHGNSRRDOZ-QRWLVFNGSA-N 456.927 0.121 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800285 CITYZTUPQUQFCP-LJQANCHMSA-N 493.417 0.557 50 20 JCGD Cc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1835153700 ZXBGYEASSPGDKR-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD Cc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835737063 JPTXFNNAHAZBDO-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](COC(C)=O)OC(C)=O)CC2)CC1 1835754507 KMIDMTBFPVFKIS-OALUTQOASA-N 475.970 0.307 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1 1835831412 PEEMPWVDLKUHPM-QAGSOJJJSA-N 497.556 0.062 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccncc34)C2)C1 1835932231 UXBDUGGCFOENEP-VWLOTQADSA-N 475.310 0.298 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(F)(F)F)C2)C1 1835935247 KGDAZXLXLZIRHZ-NRFANRHFSA-N 493.247 0.164 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnc4s3)C2)C1 1835936746 BGTIQAKZTDDERW-HSZRJFAPSA-N 481.339 0.360 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)cc1 1837460442 GHBBTVFJEOYBOM-AVRWGWEMSA-N 481.553 0.867 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1F 1837460638 IHQQGZPBXFZZCZ-HSZRJFAPSA-N 487.488 0.217 50 20 JCGD CCOc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1 1837921184 JHRJWHOSQPLERG-UHFFFAOYSA-N 482.346 0.481 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3[nH]cnc3-c3cccnc3)CCO2)C1 1838498351 KQPDELSXGHKDFX-IIBYNOLFSA-N 463.922 0.796 50 20 JCGD O=C(c1ncc(Cl)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839197788 IJKIVERZHUDLFN-ABAIWWIYSA-N 451.680 0.891 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)C(=O)c1ccccc1 1839198560 ITMSRSBSIKKSDQ-FXAWDEMLSA-N 486.338 0.906 50 20 JCGD O=C(c1nc2ccccn2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199386 NSWNFBGVJGPWKD-GUYCJALGSA-N 456.272 0.490 50 20 JCGD CC(=O)NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839744152 RIWSJNVBZPMTPP-DRTMAPTHSA-N 476.480 0.854 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1839961580 BODMKXVAHXFDFF-MAUKXSAKSA-N 464.426 0.665 50 20 JCGD COc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1OC 1840034738 VZZBNGIOWSKKKH-YJYMSZOUSA-N 472.336 0.952 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3scnc3C(F)(F)F)C2)C1 1840183581 NARQIXLMNOSCFJ-SFHVURJKSA-N 493.508 0.605 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2cccc(OCC(F)(F)F)n2)C1 1842198198 BXPRQHJWSUARDV-UHFFFAOYSA-N 463.221 0.833 50 20 JCGD C[C@H](Br)C(=O)N1CCCC12CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2 1846179975 ISJZUQYAYFIVFA-RYUDHWBXSA-N 461.357 0.742 50 20 JCGD C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)CCN1CCN(c3ccccc3)CC1)C2=O 15314604 SHVCXJGAINEIIP-HOYKHHGWSA-N 470.574 0.847 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)c1 25315987 XOGNXQMBRQWRIB-UHFFFAOYSA-N 486.597 0.858 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2cccc(C#N)c2)o1 728825414 ZLUAUOFKOASQQX-OAHLLOKOSA-N 460.468 0.942 50 20 JCGD COc1cc(Br)c(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1O 730568981 IFRAOIRBWPMBAH-UHFFFAOYSA-N 458.294 0.198 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)sc1Br 744471277 NMAXTSOGCZXSEN-UHFFFAOYSA-N 496.390 0.526 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)cn1C 747697923 UUCRUDQNTGMKFM-UHFFFAOYSA-N 450.477 0.499 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)NS(=O)(=O)c2ccccc2F)cc1OC 750301680 IENYPUVQCKZZNK-LBPRGKRZSA-N 483.474 0.514 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)cc1 825548797 GLQYGMYKNSFMFN-UHFFFAOYSA-N 465.532 0.960 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 831088962 QNPVUHVSLUAVHO-INIZCTEOSA-N 483.886 0.149 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN2S(=O)(=O)c2ccc(C)s2)n1 906883189 FEHWNUWVGDSGGB-CYBMUJFWSA-N 486.597 0.908 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 913154117 FOOZYEOCLDLBJL-INIZCTEOSA-N 493.546 0.663 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 913416379 BFGJKBDODHLOBK-QGZVFWFLSA-N 463.468 0.129 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)c2cccc(NC(=O)CSc3nncn3C)c2)C[C@@H](C)O1 917362405 HCBFZKKKXDGQBL-GASCZTMLSA-N 475.575 0.806 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn3cncc3c2)C1 1779114747 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSCC(=O)O)C[C@@H]21 1785079448 LXDVKSUEYYYYRJ-AJNGGQMLSA-N 494.010 0.916 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)C=CC3=O)C[C@@H]21 1785079521 OVNRPQMMSUZSBE-VGWMRTNUSA-N 498.964 0.023 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnc(Cl)c3)[C@H]2C1 1785445426 IATXXTDHIISCTI-LIKXFGNHSA-N 473.921 0.857 50 20 JCGD Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(C(F)(F)F)o1 1786979957 UDGMUGWBJSVYHZ-BPUTZDHNSA-N 481.236 0.589 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4cccs4)on3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981126 UGNVPHPBHXUTOG-KNBMTAEXSA-N 481.339 0.990 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3cnccn3)C[C@@H]21 1787508482 KHYIWSFRDIAHAY-ZMPVTECMSA-N 482.545 0.391 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncccc3Br)[C@H]2C1 1788961522 DEDBEGZSGLCEIH-DZKIICNBSA-N 482.379 0.810 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc(F)c3F)[C@H]2C1 1790982018 OHQWFZQCHSNFDD-FNHZYXHNSA-N 473.480 0.799 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-n4cncn4)c3)C[C@@H]21 1791293795 JQHPBQKAOJUOOW-IHPCNDPISA-N 469.546 0.234 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791445607 KCLMWFJNKKHQSB-NWZJSZKRSA-N 450.344 0.839 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)CC1=O 1792975423 RJBCWPATPFUSNM-BFMVXSJESA-N 463.962 0.846 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CCN3CCCC3)nc1)C2)[C@@H](O)CCl 1792978227 LKQVEJOIFQHQLH-HNJRGHQBSA-N 450.967 0.523 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCS(=O)(=O)c1ccccc1 1795301738 QRJHUFYSYYOLAF-LORHWOILSA-N 458.964 0.694 50 20 JCGD Cn1ncc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c1C(F)(F)F 1796190780 LJTUWBDVEVZIPG-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)N1C[C@H]2C[C@H]2C1 1797636719 WDIFOULFKQULHG-SVKQTEAVSA-N 498.628 0.262 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1cc(C)on1 1797833590 XDNRSVCOGBDJAK-SVLBOUJUSA-N 454.487 0.720 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(F)F)cc1 1799588963 HJJXNGQYLWPVOI-CCWDJLKJSA-N 454.474 0.864 50 20 JCGD CC#C[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccc(O)cc1 1801053884 SAANFNRXPBKZKT-RGKFVRLKSA-N 491.548 0.791 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1cccc1 1801256578 OJRLZPUQJZRXAX-WRHDZBKDSA-N 482.585 0.985 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1805024133 GOAANANGCBWHFC-SNRMKQJTSA-N 480.974 0.941 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CNC(=O)c2ccco2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371389 TWAPPMRGVMQDOR-GCJKJVERSA-N 476.298 0.104 50 20 JCGD COCc1oncc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807377113 XZRPPMYJRMWZRF-UTKZUKDTSA-N 464.287 0.529 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1 1807416446 FQUULKVENWGQCM-DVECYGJZSA-N 478.557 0.746 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2cnnn2)[C@@H]1c1cccnc1 1808416304 LLUHHDDKIGYGGN-QGAZACGHSA-N 478.517 0.469 50 20 JCGD CC(C)CNC(=O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1808446705 BHPHUHPOHQUJSO-APWZRJJASA-N 467.530 0.172 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cn2ncccc2n1 1809358364 YZJUYJBQDDAVNY-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD O=C(c1cnc2snnc2c1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809977692 NSIOGLFUROGVAH-UHFFFAOYSA-N 465.344 0.925 50 20 JCGD COc1ccc([C@H](O)C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1 1815347697 KZPWXLKMPOYXAD-UZLBHIALSA-N 481.339 0.791 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361772 RGXQSUIZJNTLSN-XJKSGUPXSA-N 466.328 0.911 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)COc2cccnn2)[nH]n1 1819404295 GGMVFGCMEBKTKY-MRXNPFEDSA-N 465.474 0.583 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n1 1819550932 WOHYQIWOVAQXIR-LJQANCHMSA-N 492.345 0.696 50 20 JCGD CCOc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)nn1 1820371143 HGEVJGINRUSNQN-SFHVURJKSA-N 464.291 0.898 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3ccn(C(F)F)n3)sc2C1)c1ccc(B(O)O)cc1 1820619924 PREKJGQFALXMTR-GFCCVEGCSA-N 461.259 0.954 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826088420 XHANSMRRAWWPJY-OLZOCXBDSA-N 452.581 0.733 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924503 VMENSTVPOCNLBO-BEFAXECRSA-N 456.547 0.609 50 20 JCGD C#CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1829263350 WPLNKQZUTDKJLY-RUZDIDTESA-N 475.310 0.065 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725651 LNQYDCWLXXSTNL-IERDGZPVSA-N 467.906 0.041 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830731245 IPDSYQUFANOOKG-QRWLVFNGSA-N 460.886 0.513 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(N4CCOCC4)n3)CC2)CC1)[C@H](O)CCl 1833310528 MAMLNYWVJWDBMA-HXUWFJFHSA-N 480.009 0.703 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833599093 CRDBRJKVXSFFRZ-BEFAXECRSA-N 459.952 0.573 50 20 JCGD C/C(=C\c1cccs1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933864 FIJCDFRSSBUGMO-XUUSCSPLSA-N 470.356 0.601 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3OC(F)F)C2)C1 1835941521 NBXXTSNNHHVUAI-QHCPKHFHSA-N 490.268 0.352 50 20 JCGD O=C(c1cnc2cc(Cl)ccn12)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836368167 ZSBUTEYMVRVXTR-BEFAXECRSA-N 457.314 0.657 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1836670971 NHUYPUXOXCMLEG-LBPRGKRZSA-N 496.366 0.456 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ncc(Cl)cn3)CC2)CC1 1837356541 CQZLBIZILDKLCJ-UHFFFAOYSA-N 472.738 0.736 50 20 JCGD CC(C)c1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)co1 1837457070 UQXPJKOBTDGKGV-QFIPXVFZSA-N 472.502 0.180 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838418000 SJCJIXWRYKQNQN-XIKOKIGWSA-N 485.360 0.609 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1 1838740287 IQRICUVNUTXBST-IAGOWNOFSA-N 450.985 0.816 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C34CC(C3)C4)C2)C1)NC(=O)NCc1ccccc1 1839054157 JACUYLVOIULONA-VZTJNBFISA-N 485.585 0.589 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C3CCCC3)C2)C1)NC(=O)NCc1ccccc1 1839054423 YKNZGKDPGXWXFV-VWLOTQADSA-N 487.601 0.979 50 20 JCGD Cc1cc(F)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839285594 FSBDCFKJQMPATB-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(F)c1 1839292367 AGTFZMGGKQNKLJ-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1839963822 XNCUYNQDWQYYDK-LPHOPBHVSA-N 462.385 0.339 50 20 JCGD COCCn1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1 1840032735 IYVJEFKLJUTCFC-KBXCAEBGSA-N 459.341 0.383 50 20 JCGD CCOc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1OC 1840086397 PFSAENCJFGFTAU-HTAPYJJXSA-N 470.950 0.693 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)n1cnnn1 1840479685 FOFSCHIKOAFEOU-DHJRUUKHSA-N 487.467 0.576 50 20 JCGD CCCNC(=O)CCC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841538904 RXZDTPLSFXFETQ-UHFFFAOYSA-N 472.590 0.842 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1C[C@H]2C[C@H]2N1C(=O)OC(C)(C)C 1847574381 YKKDBGCKWYJWBU-DISONHOPSA-N 463.579 0.959 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)cc1OC 1847973386 QVSQFPOJVVJMEC-PMACEKPBSA-N 452.316 0.832 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1848098437 BDNXXHVPJWPSMW-KKUMJFAQSA-N 459.975 0.693 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)NCc2ccccc2)c1 10214593 LRJPURNIBMEKHU-INIZCTEOSA-N 451.526 0.361 50 20 JCGD CON(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 14895637 UKNVQWUZIZUMFZ-UHFFFAOYSA-N 476.920 0.244 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(F)c(F)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1 16128125 SUQYEQCTHGIEPC-UHFFFAOYSA-N 461.468 0.609 50 20 JCGD O=C(COC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1ccc(Cl)cc1 19178112 GXJXYLWMDXUOHR-UHFFFAOYSA-N 470.869 0.716 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 728379192 IJUXHMQLFWLOHQ-WMZOPIPTSA-N 499.636 0.822 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1nccn1C)N(S(C)(=O)=O)CC2 728752308 DUPQTLRAKSTCLW-OAHLLOKOSA-N 480.547 0.217 50 20 JCGD Cc1ncsc1C(=O)NNC(=O)NCCN=c1ncnc2n(C)[nH]c(Br)c1-2 729624478 WPNGNGOTUWIZJF-UHFFFAOYSA-N 454.314 0.320 50 20 JCGD COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)N2CCOCC2)c1 745996310 SQAKWPCIXWUPHU-UHFFFAOYSA-N 465.326 0.060 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H](C)c1c(C)noc1C)c(=O)n2Cc1ccccc1 749842726 JEOXGIZKDTWFFB-CQSZACIVSA-N 493.524 0.984 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 789858409 ZDIFDCHLNAWSCW-UHFFFAOYSA-N 474.495 0.277 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(S(=O)(=O)NC2CC2)c1)[C@H]1COc2ccccc2O1 844254564 WAPQRUQZIXYMFK-QGZVFWFLSA-N 453.498 0.277 50 20 JCGD O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 913606509 YMKXWHLSZKWFSO-LNMJFAINSA-N 472.523 0.039 50 20 JCGD COCCOc1ccc(CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cn1 916512736 PBZYDIQTCJSWBG-UHFFFAOYSA-N 465.532 0.566 50 20 JCGD CCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 917725902 VTLRLZRLZHPAOR-UHFFFAOYSA-N 481.961 0.404 50 20 JCGD O=C(COc1ccc(CCNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1)NC1CC1 918020354 RPUDLSIOBJBPPW-UHFFFAOYSA-N 488.570 0.824 50 20 JCGD O=C(CCC(=O)c1ccc(I)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919886486 UHUZRYIZXFSCME-GFCCVEGCSA-N 479.296 0.772 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccn4cn3)C2)C1 1778048728 ABVFGQRPWKKCRX-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cn4cc(Cl)ccc4n3)CCO2)C1 1779030153 GVDGZLGJGJUSKK-JOCHJYFZSA-N 483.916 0.744 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCCN3Cc3ccccc3)C2)C1 1780886763 MTFUBOSSBAOHMC-RPLLCQBOSA-N 491.397 0.865 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)cc3Cl)C2)C1 1781487681 IVXPFOMQTQNJLI-XMMPIXPASA-N 494.744 0.963 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1782036973 LSUWULLIACHKPC-XMMPIXPASA-N 466.299 0.300 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1OC 1783935094 PEGNENQGWJXMOB-HSZRJFAPSA-N 462.547 0.829 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCC(=O)N1C(=O)OC(C)(C)C)CCO2 1783938063 RDFKJFFYELGWGE-WAIKUNEKSA-N 495.577 0.115 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784084162 MKQXTIQSSLPTCH-QAETUUGQSA-N 477.986 0.497 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3COc4ccccc4O3)[C@H]2C1 1785039750 HGKMGCFGWPGHAE-QMHYAUOFSA-N 481.509 0.118 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(=O)O)ncn3)[C@H]2C1 1785640081 UYRHXUSSBXKUTA-ASHKBJFXSA-N 455.309 0.799 50 20 JCGD CC(C)(C)n1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)n1 1785699309 NUOTYSQNGQRCOL-QRFRQXIXSA-N 454.336 0.225 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccccc3F)[C@H]2C1 1786512364 PEGJLIMUQTXHEB-QSFXBCCZSA-N 455.490 0.660 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4ncccc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786981673 FALHFTQARTVRSK-NDXORKPFSA-N 460.299 0.217 50 20 JCGD C[C@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1787486410 CZCCHJYAIQOOMO-PYTWLRIVSA-N 473.559 0.236 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccccc3)C[C@@H]21 1787508880 NPXKJUMFSKAFGS-QARUKCAUSA-N 465.510 0.983 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788140173 LSESLAPXQPUPEO-UHFFFAOYSA-N 463.259 0.919 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3nccn3)C[C@@H]21 1789221834 JIHAAMGYJLVHKM-FNHZYXHNSA-N 472.458 0.405 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C[C@@H]21 1790961004 DPMCKYWEDLNNML-MNXVOIDGSA-N 467.324 0.184 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1791236803 ZMTFLEBGWJDKAA-XPWOUSNISA-N 499.568 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3snnc3C3CC3)C[C@@H]21 1791290941 FIVCAYUEHKEWRZ-KKUMJFAQSA-N 450.565 0.382 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)C[C@@H]21 1791293719 DPTPDIYPMGARBG-QSFXBCCZSA-N 490.561 0.627 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1793647849 YRXMYQGUQAESGN-ORDFZIBCSA-N 459.971 0.965 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC(=O)N(C2CCCC2)C1 1794030171 NYRLERBGTKFBIV-ONIAQPFYSA-N 468.558 0.728 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)nc1 1794427341 HJDHRRGHBHQECU-RDBQEKCUSA-N 464.313 0.379 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1ccc(N2CCOCC2)cn1 1794440627 DZMLCVLUROMDRK-CCWDJLKJSA-N 467.364 0.906 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(=O)n1C)NC(=O)NCc1ccccc1 1794931336 ODZKEPWEXDIDIC-ACDBMABISA-N 480.569 0.983 50 20 JCGD Cc1cccc(C)c1SCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734225 KCXOFVLZWOQZIM-HATOLVCRSA-N 468.384 0.979 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1796321372 CVRYTIIYBOLPHH-KXKJGPMZSA-N 461.469 0.908 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ncsc1Br 1796492930 DHHGSDBFBOVZRY-DABQJJPHSA-N 480.149 0.102 50 20 JCGD COc1cc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(C)c1 1797754118 WJCWLZAGZDNXLZ-VPTLXERWSA-N 467.526 0.828 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1cc(C)on1 1797829626 KMFROMGXGOXONK-OQMKEHIESA-N 457.325 0.476 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccnc1C(N)=O 1799037835 WEXVLUKAMWKEDA-CRWXNKLISA-N 480.953 0.959 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1F 1801011888 PTUOMXCQZXPFIQ-USGNIVHTSA-N 478.521 0.579 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O 1801289207 OPZWRFATZVVWQK-IMPMIVQMSA-N 470.368 0.220 50 20 JCGD C=CC[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)NC(=O)OC(C)(C)C 1801930486 LCTBCOOBBFNFOS-SUWCGCSTSA-N 495.621 0.809 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360717 LVTKJKWVPUDCLL-HNAYVOBHSA-N 464.247 0.026 50 20 JCGD NC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1 1807363815 BUVGXWSWJMOLBO-IRLDBZIGSA-N 472.310 0.494 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365111 VTJPMGOZYNWZAX-WMZHIEFXSA-N 473.342 0.928 50 20 JCGD CCn1nc(C)cc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365224 XCCXOYYZCJLRKD-KNQAVFIVSA-N 461.331 0.920 50 20 JCGD O=C(Cc1ccc2ncnn2c1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807400975 NWMJIAABNOBGRA-HYBUGGRVSA-N 484.325 0.366 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2csnn2)[C@@H]1c1cccnc1 1810293269 BNZWOUUXJDEVAE-SUMWQHHRSA-N 452.500 0.565 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@H]1c1cccnc1 1810305044 IQBLGQNCHPNAOD-KKSFZXQISA-N 485.508 0.985 50 20 JCGD 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O=C(NC[C@@H]1CCN(C(=O)[C@H](O)Cc2ccccc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372364 DSXZCWFQYRNXFC-QTJGBDASSA-N 473.338 0.685 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCCn2ccnc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374058 HVEDYKDWTFTEAG-NZQKXSOJSA-N 461.331 0.758 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)n1cccc1C=O 1807389108 UVUCDUOFJADFMR-MONBJTKQSA-N 474.326 0.956 50 20 JCGD CN(CC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)C(=O)c1ccccc1 1809977518 IOJYESAVNSODIS-UHFFFAOYSA-N 477.370 0.983 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc2n(n1)CCC2 1809979798 BCPCZPNAUWTCNL-GCJKJVERSA-N 459.315 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1 1810303463 SHLLOWZWLMZYJL-FOIQADDNSA-N 482.932 0.950 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1 1810564334 ISSWDTVXSSDTNB-CAOSSQGBSA-N 459.316 0.929 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1 1812393596 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O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CC2)c1cccc(B(O)O)c1 1815361087 WMOJOMPFDNDHPA-OIISXLGYSA-N 482.371 0.450 50 20 JCGD CCOc1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1 1817473064 BLLAXJRTRQPDAF-GOSISDBHSA-N 464.291 0.898 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819560608 DACYTWJOSNNOPE-RDTXWAMCSA-N 455.324 0.700 50 20 JCGD CN1CCCC[C@@H]1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1822592626 ACKQFYAFWKKVFN-MLGOLLRUSA-N 457.560 0.852 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cccc([N+](=O)[O-])c1=O)CC2 1826089688 LRIPSXFVYGLDCR-GFCCVEGCSA-N 491.530 0.198 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1 1828832087 XGGIPQKTVMBMQI-QGZVFWFLSA-N 470.253 0.705 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CN)C2)C1 1829341121 XHYMJWFQCDNWCK-UTKZUKDTSA-N 452.939 0.651 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)C1 1830428786 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1oncc1C)CCO2 1838394396 NYIOCPRVMJIEIH-MNQDVBFDSA-N 458.475 0.187 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)n(C)n3)CCO2)C1 1838835012 GZPRIEICCGTFAD-UGSOOPFHSA-N 459.341 0.672 50 20 JCGD CCOC(=O)C1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)CC1 1839202383 DMEVKFDLGHTPDJ-LRDDRELGSA-N 451.289 0.477 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(O)O)C2)C1 1839743654 IYLXMXSAPNPVDG-ULXKQSRTSA-N 480.315 0.123 50 20 JCGD O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)Cc1ccccc1)CCO2 1839960739 LEHTUFOLLVDYGE-GJYPPUQNSA-N 459.312 0.737 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1840081797 ITYJUZRKYNEHAS-DENIHFKCSA-N 495.013 0.547 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=CCN(C(=O)OC(C)(C)C)C3)C2)C1 1840149974 CVKBQZSLJLCFTK-JTSKRJEESA-N 487.981 0.874 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=CCN(C(=O)OC(C)(C)C)C3)C2)C1 1840149977 CVKBQZSLJLCFTK-VGSWGCGISA-N 487.981 0.874 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSCc3[nH]cnc3C)C2)C1 1840153292 JQEKDWSZUYGMSO-KXBFYZLASA-N 460.984 0.662 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCOc3ccc(F)cc3)C2)C1 1840183114 RTTZZEJQRLLTLX-HSZRJFAPSA-N 480.537 0.424 50 20 JCGD C[C@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC=CCC1 1840554740 HXLSGRLKEDOUOM-GOTSBHOMSA-N 457.531 0.502 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)CCO2 1840882627 LPPHBSOAOLHIPA-WBYLCXCBSA-N 489.997 1.000 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1Cc3ccccc3C1)CCO2 1840943411 YOPQSGLBOJYMCD-SECKTWPTSA-N 493.564 0.992 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCC(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841347654 BBUMJPVIXDVNNU-OAHLLOKOSA-N 463.959 0.347 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)[C@@H](O)C1 1841351075 FMXWMKZWORXXMR-SIFCLUCFSA-N 459.971 0.798 50 20 JCGD O=C1CSc2cc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)ccc2N1 1843318782 IFHNKFUWTWCBFG-UHFFFAOYSA-N 451.313 0.541 50 20 JCGD C/C=C/C(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1845962446 SCTLJGCYRKCCMH-XZXOBPBMSA-N 471.363 0.582 50 20 JCGD C[C@@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1cccn1 1846619356 ILYLEWWZIXYIPD-SFHVURJKSA-N 453.547 0.994 50 20 JCGD Cc1cn(CC(=O)N2CCCC23CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)c(=O)nc1O 1846967153 QVVFVWWENJLQRF-AWEZNQCLSA-N 483.953 0.593 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1 9930789 WKPXRVVTPRIECL-KRWDZBQOSA-N 471.601 0.766 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)C1=CN2CCS(=O)(=O)N=C2C=C1 15762863 PDQUJCCMQUXXMV-NSHDSACASA-N 469.317 0.861 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCN(C(=O)CN(C)C)CC2)cc1 728203501 WSHDSDCWXXAULC-RGEXLXHISA-N 493.568 0.573 50 20 JCGD COC1(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CCN(C(=O)OC(C)(C)C)CC1 728329946 ABKINWDRNVWCAO-KRWDZBQOSA-N 493.513 0.933 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N(C)Cc1ccccc1 728372482 RKTBNTVTLHIVJK-QGZVFWFLSA-N 495.579 0.712 50 20 JCGD Cc1ncsc1C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C/c1ccccc1 729453508 DVOZRXRFBFLLFQ-KUCQQTCKSA-N 486.597 0.606 50 20 JCGD CCOc1c(Br)cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1OC 730568906 GIVPGPDVNZZIFU-UHFFFAOYSA-N 486.348 0.891 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C(=O)CN3C(=O)CCC3=O)CC2)N(C)c2ccccc21 749572814 RVOBOKWBBHNVOS-UHFFFAOYSA-N 492.536 0.477 50 20 JCGD CC(=O)N[C@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CCCC1 765863451 UCJCBEKEYLMQFQ-NRFANRHFSA-N 480.587 0.482 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(F)c2)c2ccccc2c1=O 913597103 RNXDSAJUXXDJFF-UHFFFAOYSA-N 461.475 0.685 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CN3CCCNC3=O)c2)cc1 915260324 AFFDNNIJNCJRLP-UHFFFAOYSA-N 461.500 0.672 50 20 JCGD CN(C)C(=O)N1CCC(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 915808055 KCCKAMMTBCJDMN-UHFFFAOYSA-N 495.602 0.181 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2 916148590 IQLQWDMXUKASMA-QGZVFWFLSA-N 491.522 0.949 50 20 JCGD COc1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c(OC)c1 918235177 NLVPNSMMSNYJIU-UHFFFAOYSA-N 464.548 0.861 50 20 JCGD CNC(=O)COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1OC 919688715 BLXJFJKHMCEMLS-UHFFFAOYSA-N 464.500 0.145 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1778407354 CTIPMIWVNDSIQJ-HSZRJFAPSA-N 451.263 0.744 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1779181202 YMXFLBPCRBDXLJ-AGRHKRQWSA-N 458.346 0.661 50 20 JCGD O=C(c1n[nH]cc1I)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2 1779544759 SWXFGNOWZJJIMW-MFKMUULPSA-N 456.643 0.992 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(CO)on3)C2)C1 1780390896 NUFXSOXLBACTAN-MGPUTAFESA-N 472.926 0.743 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1 1781882444 CKJDYLQQEYISFG-QHCPKHFHSA-N 454.531 0.893 50 20 JCGD COC(=O)CCCCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782276113 ORVYCOWYUNAYGF-HYBUGGRVSA-N 474.363 0.617 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)C[C@](C)(O)CC(=O)O)C2)C1 1783929614 IGAYSFHLNXSZLS-VXKWHMMOSA-N 493.469 0.579 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)N1C(=O)OC(C)(C)C 1783932926 KQXMPRCQSVHHKX-XFAGBWLFSA-N 495.621 0.977 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1ccc(Br)nc1)CCO2 1783935724 VYPHWQBXAJZPLY-FQEVSTJZSA-N 482.379 0.590 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1cc(F)ccc1[N+](=O)[O-])CCO2 1783939573 JUEONBXQSOMBFT-NRFANRHFSA-N 465.482 0.479 50 20 JCGD COC(=O)CCCCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1784050734 YNXVWQPMQRIZTR-QFIPXVFZSA-N 461.519 0.252 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CCO3)cc1 1784156059 GOWWARNIZWTVOG-JOWQQVNMSA-N 495.536 0.980 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1784287732 NCZQSVAKOSOBMA-WAIKUNEKSA-N 452.515 0.402 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1785691029 HYGPQWYVJDIQNB-KZDUYQQSSA-N 463.934 0.764 50 20 JCGD NC[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)c1ccccc1 1786924092 YVHXONYBHWBULH-OFCAXSSNSA-N 466.542 0.021 50 20 JCGD CCOc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786981840 BQXDSEOBWVBLKI-VDGAXYAQSA-N 453.304 0.067 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(OC)c1 1786983822 UCJHDKVPZRTNGI-APTRMMRNSA-N 496.369 0.610 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3noc4c3CCCC4)[C@H]2C1 1787307167 NWMJSDHBODITGO-IXDGSTSKSA-N 468.514 0.459 50 20 JCGD Cc1nccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)n1 1789726826 VKCPPQNZIHBPCZ-ONTIZHBOSA-N 495.584 0.725 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789922015 BGEBJGGOCJGBEN-MZGVZZPPSA-N 492.367 0.910 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)c3ccccn3)[C@H]2C1 1790587623 ICOXEBWLNBNPKI-BWJWTDLKSA-N 467.364 0.963 50 20 JCGD COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1C 1791122052 AUAGMAGLPMOUHL-ZJOUEHCJSA-N 460.575 0.899 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C(N)=O)cc3)[C@H]2C1 1791895719 OOPMCXOHPLNJRI-OZPLSILQSA-N 480.525 0.513 50 20 JCGD Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc2c1-c1ncccc1OC2 1795935946 BGWOKBBBBWMGLX-KPEUIFRASA-N 460.918 0.782 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CS(C)(=O)=O)nc1 1796079000 XRLZMTRVFUWULA-YALNPMBYSA-N 459.952 0.083 50 20 JCGD O=C(CCS(=O)(=O)c1ccccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796191195 JYOAOOHQIBFAQR-ACDBMABISA-N 470.356 0.482 50 20 JCGD Cc1cc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)[nH]c2cc1C 1797751557 GDRMZGMUFPLYTQ-YVWYUNDQSA-N 477.525 0.695 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1CCOC1=O)C2)NC(=O)NCc1ccccc1 1799871407 ASUCCPOKVYDQBR-ACDBMABISA-N 486.573 0.813 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H](O)CN1C(=O)OCc1ccccc1)[C@@H](O)CCl 1804189271 FUDQPQGESQRLOF-XSEPRYCASA-N 479.961 0.996 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)NC[C@@H]2CCN(C(=O)[C@@H](F)Cl)[C@@H]2c2cccnc2)n(C)c1=O 1804390787 XIJHRVXZVYJAGL-YSVLISHTSA-N 491.911 0.069 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1806342235 LINRCELFQJQHGP-DYVFJYSZSA-N 452.309 0.424 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1 1807358633 MPHDSCVORZNTRY-ZQIUZPCESA-N 459.894 0.386 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1C 1807376174 UCUTUSDLKQUCBY-LAUBAEHRSA-N 463.303 0.137 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCS(C)(=O)=O)[C@@H]1c1cccnc1 1808416250 IXEHESRUINFVGR-YVIKVBFHSA-N 488.570 0.656 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810307532 DNAWUKQFZVCHRZ-MMOPVJDHSA-N 476.541 0.933 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cn1 1810438013 RYFDTPDTRTVRMH-UHFFFAOYSA-N 499.398 0.465 50 20 JCGD COCc1oncc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813071806 XIDGUWATECNQLI-HRAATJIYSA-N 458.519 0.909 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@@H](CNC(=O)CNC(N)=O)[C@@H]1c1cccnc1 1814220592 COYDXYAPBJDMQL-ZOBUZTSGSA-N 482.969 0.888 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)CC2)c1ccc(B(O)O)cc1 1815337271 QHUUMVGQHAEPRC-JTQLQIEISA-N 489.212 0.404 50 20 JCGD C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCS(=O)(=O)CC2)n[nH]1 1815672284 AVRRFGCUHYXKMF-TZMCWYRMSA-N 476.397 0.916 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817473982 JQAFFTCJMDTNPM-CXAGYDPISA-N 462.337 0.076 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817477411 YVSGHSUOQOHJRT-CXAGYDPISA-N 458.280 0.957 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4c(c3)CNC4=O)sc2C1 1819373597 FMQCPNUESKMMNN-CQSZACIVSA-N 470.555 0.985 50 20 JCGD COCCn1ccc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n1 1819402696 HJRIGGBSWAINTI-SFHVURJKSA-N 481.517 0.871 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819513734 JNCNSUCPYKILMT-IFXJQAMLSA-N 491.317 0.004 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1824524840 QWACXAHUULKZGP-JXFKEZNVSA-N 464.393 0.280 50 20 JCGD COC(=O)C12CC(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)CC3)(C1)C2 1827053106 BWJMBQJCXYCUIT-NWSMCOELSA-N 468.359 0.943 50 20 JCGD CNc1nsnc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827056427 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O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)Cn1cc([N+](=O)[O-])cn1)CCO2 1832795909 HVYFMAKTHZHUTM-MRXNPFEDSA-N 460.285 0.033 50 20 JCGD O=C(CCc1ccccn1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833881627 OEVWMFPQCVNKCA-UHFFFAOYSA-N 464.375 0.579 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(C)n1)CCO2 1834047132 TWFHOEZFOOLUIU-OINMWHHXSA-N 468.514 0.594 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(O)n3)CCO2)C1 1834187643 SDLBUXGTSVKBSB-KSFYIVLOSA-N 498.964 0.989 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834800053 RQPHJSFCHQFEJL-UHFFFAOYSA-N 493.373 0.219 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cn2cc(F)ccc2n1 1835565903 ISOCJGAEYHRNPG-UHFFFAOYSA-N 493.348 0.652 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1835643937 ICUPKYLMVICMIQ-KRWDZBQOSA-N 463.373 0.408 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CC[C@H]3CCOC3)CC2)CC1 1835737523 YVFIFNJMIWEGEY-KRWDZBQOSA-N 472.590 0.687 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1 1836967136 ONTSQXIIVMBMLH-KUHUBIRLSA-N 471.352 0.767 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)C(=O)N(C)C)CC2)CC1 1837812868 OCKOHYIZQUIMRW-BUVRLJJBSA-N 460.535 0.207 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1838472663 WHXAOERMCNSSRN-MGPUTAFESA-N 496.362 0.575 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1F 1838914791 XIXWLUVPLRFLBK-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(F)CC3)C2)C1)NC(=O)NCc1ccccc1 1839054403 XBMCGOLDJMPPMJ-QFIPXVFZSA-N 477.537 0.291 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)CCO2 1839080546 AKZZNAXYCGPQRG-JJDSTIRJSA-N 486.407 0.875 50 20 JCGD O=C([C@@H](F)Br)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1839198449 DTGDPZQMKWFWDU-PRHODGIISA-N 483.184 0.489 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201643 DISPNDJUPHDAON-KDOFPFPSSA-N 458.284 0.546 50 20 JCGD Cn1nc2c(c1C(=O)N1CCOC[C@@]3(C1)CN(C(=O)[C@H](F)Br)CCO3)CCC2 1839202435 FKVPKDKIPFDKTE-MAUKXSAKSA-N 459.316 0.669 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3ccoc3c1)CCO2 1839535456 WTIWNJJAHMFXHS-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCN3C(=O)OC(C)(C)C)C2)C1 1840149919 BQAUYOOGYRUPCO-CKJXQJPGSA-N 475.970 0.706 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4ncccc4c3)C2)C1 1840182519 LLEKRPIVEDZWLH-VWLOTQADSA-N 483.569 0.607 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4c(s3)CCC4)C2)C1 1840183777 ZGAQVFLFTPDAEZ-QFIPXVFZSA-N 464.588 0.680 50 20 JCGD CSc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1840303597 VUCKOYWJYTYOTA-XMMPIXPASA-N 499.593 0.720 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1Cl 1840732099 KIKPJXPOIXZBCD-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2 1840813719 QJERPSHSMSJAPA-LWROZRRASA-N 456.503 0.271 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(CC(C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)=NO2)C1 1841353788 PLCUOKNZYLBWNH-BTYIYWSLSA-N 470.954 0.945 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1nccnc1C(N)=O)C2 1841924694 RMDGISDDAUNGDI-LBPRGKRZSA-N 466.926 0.525 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CN2CCCC2=O)C1)NC(=O)NCc1ccccc1 1842831200 AKXIPEHJMSZHOG-UHFFFAOYSA-N 456.547 0.158 50 20 JCGD COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)nc1Br 1844613105 PZHYOAAJOGJJJL-UHFFFAOYSA-N 474.120 0.663 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccccc1C(N)=O)C2)NC(=O)NCc1ccccc1 1845039130 HYNHPIIDJPMMTO-UHFFFAOYSA-N 478.553 0.949 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@]23C[C@@H](CO2)N(C(=O)OC(C)(C)C)C3)C1 1845078707 MNSOXXOREAFSCZ-HJPURHCSSA-N 479.578 0.341 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCn2cnc3sccc3c2=O)cc1 10471351 RPUQHPNRTPAENF-UHFFFAOYSA-N 463.541 0.625 50 20 JCGD COc1cc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc(Cl)c1OCC(N)=O 14346602 SZOGFPHIQGKMDM-UHFFFAOYSA-N 459.846 0.534 50 20 JCGD COCCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)OCC(=O)NNC(=O)c1ccc(C)cc1 19420011 MKERXBLECBUOOI-VWLOTQADSA-N 494.504 0.925 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CN3CCC[C@H]3CO2)c1 729618280 IZMAXFBPHXEJCH-DLBZAZTESA-N 453.565 0.524 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccc(C#N)cc1 747176075 JGKAOQHGCDBPLE-VUVZNRFTSA-N 490.563 0.713 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2ccc(-n3cnnn3)cc2)cc1 747408911 DQEAKPSSVIBPLQ-UHFFFAOYSA-N 471.528 0.706 50 20 JCGD COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CC1 748697359 DLYCYOSKWBOZCP-UHFFFAOYSA-N 483.591 0.387 50 20 JCGD Cc1nnc(NNC(=O)[C@@H](NS(=O)(=O)c2ccc3c(c2)OCCCO3)C(C)C)nc1O 817277191 CPUYDJHVDCXGRN-HNNXBMFYSA-N 452.493 0.493 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)Cc1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1 825624751 QUJYGRLBMLXQGH-UHFFFAOYSA-N 492.554 0.527 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 859422169 OWZLGWBVJASLTD-GOSISDBHSA-N 462.484 0.253 50 20 JCGD O=C(NNC(=O)[C@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1csc(N2CCOCC2)n1 892845705 FSSOUZWDRXFHKV-GDBMZVCRSA-N 479.559 0.723 50 20 JCGD O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 913151391 GPNOVZXJRCAPMI-UHFFFAOYSA-N 484.531 0.350 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CCn1cc(Cl)cn1 917541491 GYICREXAWCNMEC-UHFFFAOYSA-N 469.951 0.728 50 20 JCGD O=C(NNC(=O)c1ccc(F)cc1Br)C1=NN([C@H]2CCS(=O)(=O)C2)C(=O)CC1 918339523 QDNMCEQVBMWCAO-JTQLQIEISA-N 475.296 0.515 50 20 JCGD CSCC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919885575 MEKOZSOBZRKVHX-FZMZJTMJSA-N 462.981 0.709 50 20 JCGD Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)c1 919886160 QXJQAIPGPYTLEP-MRXNPFEDSA-N 466.541 0.927 50 20 JCGD CCCCNC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 920823189 UVODQBMQRXYYAH-AWEZNQCLSA-N 468.985 0.552 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)C1=CC=CN2CCS(=O)(=O)N=C12 921235103 VTAIBARQKVNUFS-UHFFFAOYSA-N 455.290 0.473 50 20 JCGD Cc1c(N(C)S(=O)(=O)c2cccc(C(=O)N3CC[C@H](B(O)O)C3)c2)c(=O)n(-c2ccccc2)n1C 1329670481 AVASJCNKMFXVTK-SFHVURJKSA-N 498.370 0.998 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778092572 IZTDXCNEPNVGJQ-JETUKDQUSA-N 460.579 0.975 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3Cc4ccccc4O3)C2)C1 1778243786 MFGQNBMNEAOMIH-CRTHCGSASA-N 465.510 0.954 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1778788505 GORJDOFUBVGAMK-XYAYVLSKSA-N 478.452 0.766 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cncc3cnccc13)CCO2 1779032607 OEBGIPQOVFDXEO-HSZRJFAPSA-N 461.482 0.386 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)C/N=C/c3ccco3)C2)C1)NC(=O)NCc1ccccc1 1779139970 PFIZPPSZMPMDLV-OTUOEDBFSA-N 496.568 0.875 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097817 MIYICDXSLQRCBP-XMSQKQJNSA-N 492.485 0.115 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)cn2[nH]cnc(=O)c12 1781334935 RMAGIIKCJULDSA-SUMWQHHRSA-N 456.272 0.465 50 20 JCGD Cc1c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nc2ccc(Cl)cn12 1782494845 NPTQHVJKZXXBRU-HSZRJFAPSA-N 482.733 0.733 50 20 JCGD CCC1(C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)COC1 1782949415 BIKQAUSFAHWULA-DEOSSOPVSA-N 473.574 0.589 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Cc3cnc[nH]3)NC(=O)OC(C)(C)C)C2)C1 1784313523 CQIZDWNJFKWLGJ-HYFFOGBASA-N 499.996 0.929 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21 1784439570 ZWVCHVBFZIRVOD-MRLBHPIUSA-N 468.414 0.325 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1785596437 TYEIHVQBJXIJHD-ZYKLXPEUSA-N 499.373 0.279 50 20 JCGD Cc1cncc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786980130 MHYZCTRWBLBHTH-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)C(=O)CC4)C[C@@H]21)c1cccc(B(O)O)c1 1786985137 NOQXTYXFEAFQNK-HARLFGEKSA-N 462.311 0.402 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3OC(F)F)C[C@@H]21)c1cccc(B(O)O)c1 1786986450 BYEZOHKWFUCFOP-QSFXBCCZSA-N 474.269 0.875 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21 1788638574 DRLGSCBNMXJVBM-OLFNHAQQSA-N 463.325 0.244 50 20 JCGD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(-n2nccn2)c1 1789291314 OXBXJTJRUJQGLW-HARLFGEKSA-N 489.341 0.163 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3cc(=O)n4[nH]cnc4n3)CCC2)cc1 1791599967 NYWGRNRKHQRMNE-UHFFFAOYSA-N 466.502 0.538 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1792187104 CHDAXDHSKRADGU-UVBQOVKKSA-N 469.941 0.452 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1792778721 MLTFGGIZFPCKGF-XYYYAOKXSA-N 482.375 0.540 50 20 JCGD O=C(C#Cc1ccc(Cl)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1792834517 RJCIDZVSNYLBNK-OPMZPASUSA-N 452.703 0.275 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(Cl)cc1)C2)c1cccc(B(O)O)c1 1795737769 QYVQAQGFDZSDOG-HGKCTWBKSA-N 456.691 0.106 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2c(n1C)-c1ncccc1OC2 1795936986 VOTFZDZCLIZQMR-FAQVEIGNSA-N 496.568 0.556 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797953884 OBMSFKCMSHDYIV-IVSAIRAKSA-N 459.616 0.313 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1COc3ccccc3O1)C2 1798440796 SLXHDPNIWXQIHP-IGMJJTELSA-N 451.483 0.777 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn(-c3cccc(F)c3)n1)C2 1800973998 JWJWZTCATHOMMR-RMHZUWNSSA-N 451.886 0.863 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccncc1C(F)(F)F)C2 1801011169 KKSFXJACGPOQAJ-IVWMJMPLSA-N 457.453 0.677 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc3n[nH]cc13)C2 1801013374 RJIMKPIWDYSBBV-KSPBDQMDSA-N 463.926 0.188 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1804199443 XYDASUSSWHRDMN-AOIWGVFYSA-N 456.996 0.835 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)CNC(=N)N)[C@@H]1c1cccnc1 1807059330 ZSBGHALKFSHTIF-QRWLVFNGSA-N 483.485 0.718 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CN2CCNC2=N)[C@@H]1c1cccnc1 1807112571 MFZHVESFNUIGOH-KMFMINBZSA-N 451.369 0.958 50 20 JCGD CCc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1F 1807369487 LOXSIHADICDYTH-IERDGZPVSA-N 465.294 0.819 50 20 JCGD COc1cnc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1807371308 SDCFHGHWHIYDNX-UTKZUKDTSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(c2)CNC3=O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375998 RAODPDARMXYZOC-CVDCTZTESA-N 484.321 0.638 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377273 ZZBFCAABCTWNNT-FXAWDEMLSA-N 486.297 0.143 50 20 JCGD O=C(Cn1cc(Cl)cn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807410645 RXZQFGPSKBPIEX-LAUBAEHRSA-N 467.722 0.631 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnc3ncccn23)[C@H]1c1cccnc1 1809333189 HQYHQWYXWZLZOH-LAUBAEHRSA-N 464.530 0.817 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1810099926 MJFIJVLOPYBNQE-YSVLISHTSA-N 457.325 0.937 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810306413 YTYIBGSHZIBMGQ-OXQOHEQNSA-N 497.556 0.924 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1 1811206587 ZDNZVTGXTVTBSD-UWJYYQICSA-N 461.287 0.193 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1 1813072805 GQJBLTDLKAJTNF-VGOFRKELSA-N 464.530 0.817 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc3cn[nH]c3cn1)CC2)c1ccc(B(O)O)cc1 1815344401 XNFMBZOTTMTRPT-CQSZACIVSA-N 462.300 0.634 50 20 JCGD CNc1nsnc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815347613 GQOZKZFYUOAZIK-NSHDSACASA-N 458.334 0.256 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1(Br)CC1)CC2)c1cccc(B(O)O)c1 1815360576 UPTRUNVTBYLXKE-GFCCVEGCSA-N 464.150 0.976 50 20 JCGD COCCn1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)CCC(=O)NN(C)C)CC3)n1 1817618370 PBFMXNYDRNSHKT-CYBMUJFWSA-N 463.564 0.585 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCN(C(C)=O)CC2)n[nH]1 1818967755 YLFHIZZNRCIVOI-WBVHZDCISA-N 454.959 0.820 50 20 JCGD NC(=O)c1ccccc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1821159780 XVJUCIAGRMVJSC-LJQANCHMSA-N 461.287 0.808 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc(Cl)cn1)CC2 1826085338 NEZAUVKLWNXFOH-LBPRGKRZSA-N 453.956 0.978 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052290 SSASSKLTRMSBNE-FCHUYYIVSA-N 488.346 0.095 50 20 JCGD CCOC(=O)C1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1827053317 KNYYOWPENSKOTA-HXUWFJFHSA-N 456.348 0.943 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc3ncnn3c2)CC1 1828734577 ZFYHELPWTFFCNO-NRFANRHFSA-N 461.331 0.956 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1830246411 DNMBDPZIYUDDND-HSZRJFAPSA-N 482.434 0.380 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COCCOCCOCCOC)C2)C1 1831658534 WEEUPRDWRHEALP-UGKGYDQZSA-N 495.013 0.547 50 20 JCGD Cc1n[nH]cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549588 VDOWJLYBMSQJGZ-KKSFZXQISA-N 485.969 0.920 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)n1 1832765116 YBNXDDXQRJEPTA-LJQANCHMSA-N 456.337 0.874 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CN3CCOCC3)CC2)CC1 1833262229 KVWAUUJWOSBMNP-INIZCTEOSA-N 459.429 0.921 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(OCF)cn1)CCO2 1833568850 QVLYPDOCQLKGEO-KRWDZBQOSA-N 461.288 0.637 50 20 JCGD CCc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1F 1834039892 HRVSONCOPXGNNJ-UHFFFAOYSA-N 465.574 0.669 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801276 VCOJZAOQUSPRIZ-NRFANRHFSA-N 457.380 0.125 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCO3)CC2)CC1 1835117954 AXSHSCVQANMQIL-NTRYICDMSA-N 458.563 0.871 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(CN(C(=O)CC3CC3)CCO2)C1)NC(=O)NCc1ccccc1 1835220467 HAQJMFJKCZSGDE-XMMPIXPASA-N 473.574 0.589 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCCC4)CC2)CC1 1835570960 PCBNKSGQHLGFND-UHFFFAOYSA-N 494.600 0.717 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c[nH]1 1835927209 MHUHRHBGGJCFFF-DEOSSOPVSA-N 469.347 0.376 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccccc3Cl)C2)C1 1835931684 XDIFGVWZXRBSSP-JOCHJYFZSA-N 458.707 0.404 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc(C)c1C(=O)O 1835939533 RPVCXYHWPURPLT-RUZDIDTESA-N 496.325 0.065 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837164478 IGHBJZGICRNNKY-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3c3ccccc3)C2)C1 1837460354 CNJLDTBEKTUNDV-RLSLOFABSA-N 479.537 0.559 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1837711626 MBXGZQPRUBBIMV-NRFANRHFSA-N 465.579 0.774 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc2)C(=O)C1 1838992825 OYDYJNJVBGNUPB-GCJKJVERSA-N 478.933 0.469 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)s1 1839034092 OWJJUVZNNNKWHU-IFXJQAMLSA-N 460.936 0.133 50 20 JCGD C[C@@H]1C[C@@]1(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839091395 FCEPFSWQQCHPTL-UKDVSSAZSA-N 487.601 0.835 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839156585 VHQISLMSELYRAB-HRAATJIYSA-N 453.923 0.298 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)no1 1839201274 TWFBRWKFHCKFGW-DOTOQJQBSA-N 477.287 0.459 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3occc3c1O)CCO2 1839564576 VNSDYGNTMAYYDP-DEOSSOPVSA-N 480.282 0.202 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1840033229 YETXSMBITZMPMT-SGTLLEGYSA-N 468.308 0.288 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccc3F)C2)C1 1840183366 ZNLJMWIBBSOAEU-NRFANRHFSA-N 470.929 0.922 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)ccc(O)c3F)C2)C1 1840185208 NNBDCCYUSFKYNY-OAQYLSRUSA-N 470.473 0.113 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1841392606 DCKDJDXUNFXOGC-IBGZPJMESA-N 483.374 0.973 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)COCCOCCNC(=O)OC(C)(C)C)C1 1841435281 YQUAUMHAXUJCLD-UHFFFAOYSA-N 499.609 0.121 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cccc(N3CCOCC3)c1)C2 1844265089 UJOPFBWQPLOXSL-UHFFFAOYSA-N 464.526 0.653 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CNC(=O)C(F)(F)F)C2)NC(=O)NCc1ccccc1 1845039343 GGKUMHPMSKWZQR-UHFFFAOYSA-N 484.479 0.215 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)COc1cccnn1)C2)NC(=O)NCc1ccccc1 1845039455 QFTUBZFDMWRVRL-UHFFFAOYSA-N 467.530 0.405 50 20 JCGD CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12 9863666 SCNRTLZNPAISBI-UHFFFAOYSA-N 472.527 0.895 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc3c(c1)OCO3)c(=O)n2Cc1ccccc1 15991383 HVWCDXVOFXOBSK-UHFFFAOYSA-N 490.476 0.618 50 20 JCGD CN(C)N(C(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)[C@H]1CCS(=O)(=O)C1 728176176 KIBICHQADMCJEI-KRWDZBQOSA-N 459.590 0.132 50 20 JCGD Cc1ccc(-c2csc3ncn(CCC(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(=O)c23)cc1 729275502 OUJVZSGMFWMKIM-CYBMUJFWSA-N 477.568 0.909 50 20 JCGD CCN(CCNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)C(=O)OC(C)(C)C 729617415 NVRZECGAOXIYMC-UHFFFAOYSA-N 485.611 0.901 50 20 JCGD COc1cc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCSCC2)ccc1OC(C)C 730582484 BWCIULLTZXPLGG-UHFFFAOYSA-N 460.578 0.805 50 20 JCGD O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)C(=O)N1CCCC1 748247972 ZNCMHYREDFCDEA-UHFFFAOYSA-N 451.277 0.595 50 20 JCGD NS(=O)(=O)c1ccc(NCCC(=O)NNC(=S)NCCc2cccs2)c([N+](=O)[O-])c1 838843427 ZCOKIHXALIRWFG-UHFFFAOYSA-N 472.574 0.844 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(C)n(C)c1C)c(=O)n2Cc1ccccc1 901383826 YMOFEZIYUHHRPW-UHFFFAOYSA-N 477.525 0.844 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@@H](NC(C)=O)C(C)C)N(S(C)(=O)=O)CC2 913161450 MVUWVEAPUBZAET-JXFKEZNVSA-N 484.575 0.261 50 20 JCGD CCc1ccc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1S(=O)(=O)N1CCOCC1 913632582 FPNVLCKPKKAAPS-IBGZPJMESA-N 475.523 0.871 50 20 JCGD CN(C1CCCCC1)S(=O)(=O)N1CCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1 914825714 IYUCFXXEBBTZLU-UHFFFAOYSA-N 491.578 0.144 50 20 JCGD C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1 915475327 IPAMXEVRXWMHBB-LBPRGKRZSA-N 469.903 0.617 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)ccc1Cl 915789151 RYKVITMJEUYAKV-VXGBXAGGSA-N 456.908 0.314 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](Cc1cccc(F)c1)n1nnnc1C 916134569 PXKWLQRBAKRISM-MRXNPFEDSA-N 474.522 0.967 50 20 JCGD CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(S(=O)(=O)NCC(=O)O)cc1 916337482 HWGXQHOUTCCXLQ-UHFFFAOYSA-N 467.529 0.497 50 20 JCGD O=C(NCc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 916649095 IJUDMXKPOHSYSS-JXFKEZNVSA-N 490.538 0.814 50 20 JCGD CCN1C(=O)c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2S1(=O)=O 917515757 JFJXNJFMRPNMMR-UHFFFAOYSA-N 480.524 0.176 50 20 JCGD C=CCNC(=O)c1cccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 917721472 VADQJMMZJVNSDJ-UHFFFAOYSA-N 480.568 0.541 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1 920030291 XQVPSJVKNLSOPE-ZPHJMFTNSA-N 474.477 0.900 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccnc2N2CCN(C)CC2)cc1 921248389 XLFRVCUNTVBCBN-UHFFFAOYSA-N 489.602 0.293 50 20 JCGD CCOc1ccsc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029622 VYMFGRWNPMDQKX-OAQYLSRUSA-N 459.528 0.903 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@H]43)C2)C1 1779045506 FZJLAVVARLHDHF-CIEVZJJWSA-N 464.352 0.698 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)N1CSCSC1 1779447403 FRHIOISZOFMLKZ-ZWDAVXSWSA-N 493.460 0.537 50 20 JCGD Cc1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn2[nH]cnc(=O)c12 1780019564 FRZLJVDEYYCIJE-CXAGYDPISA-N 456.272 0.465 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1781987685 UWCVYXOFYZLKEG-OAQYLSRUSA-N 465.482 0.859 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782159092 IQMXSUNJNOELPV-IRSRUACTSA-N 499.568 0.568 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C[C@@](C)(O)CC(=O)O)C1 1782204589 QPIRMHBWBPQVEK-XBRHDNQBSA-N 491.545 0.250 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnc3nc1O)C2 1782213189 AKDXWQADKGHWND-HOYKHHGWSA-N 484.557 0.836 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)n2cncn2)C1 1782529394 RFAQJDSSUBFQNX-HJHYLCBESA-N 470.534 0.487 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1 1782809298 YBPSOSJIQNUKJC-WEMPKCCASA-N 451.951 0.051 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1 1783404665 QYNXSBAVEYHAOV-DFBJGRDBSA-N 463.538 0.934 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NO1)CCO2 1783933189 DIGXTTBFRYFGNA-AUSIDOKSSA-N 457.531 0.383 50 20 JCGD CCc1nn(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1Cl 1783936271 LRMDNKDVVLBLDI-HXUWFJFHSA-N 454.959 0.452 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21 1784439572 ZWVCHVBFZIRVOD-YTFOTSKYSA-N 468.414 0.325 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1784502135 LZBXYSNWGZMVFA-CJFMBICVSA-N 497.600 0.695 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)[C@H]2C1 1785331920 IDUVIAJRSIQTMG-QYOZUGBQSA-N 468.938 0.226 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ncccn34)C[C@@H]21 1787509124 UJVWEZTUHGDFKV-BRZMCFHBSA-N 478.513 0.457 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4c(c3)CCCO4)[C@H]2C1 1788197112 IWDHJPSXQICQFU-ONTIZHBOSA-N 472.586 0.907 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H]3CNc4ccccc4O3)[C@H]2C1 1788551600 OXJHQUNEVOXVRI-NYUBLWNDSA-N 473.574 0.602 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCCO4)C[C@@H]21 1788610081 BYFKRQQICPLBMZ-DCPHZVHLSA-N 481.509 0.363 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cnccc4[nH]3)C[C@@H]21 1788611235 PTGLYVCHGUYYPB-ROOHIHILSA-N 463.498 0.469 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1788642993 OAVHNMVQODQJOM-UHFFFAOYSA-N 485.371 0.540 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCNC(=O)c3ccc[nH]3)C[C@@H]21 1788765965 XOCGTYDXCYPXRR-BQFCYCMXSA-N 450.612 0.966 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccccc3F)[C@H]2C1 1790966891 QXASYIZUSCCADB-VHFSOBRXSA-N 471.489 0.497 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(C)c1 1792099585 OYSRXWOULZJMCA-IHPCNDPISA-N 474.558 0.748 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1C[C@H]1c1ccc(F)cc1 1792808371 MHIORGCUPIYAAI-OHJZQYHNSA-N 452.291 0.512 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)C(C)(C)S 1792982532 GXCYTDZFXFSRBN-XLWJZTARSA-N 480.027 0.777 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(=O)c(OCc2ccccc2)c[nH]1 1794223659 MYHPJKZRXWWJGG-NNNWTRQLSA-N 475.929 0.757 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N[C@@H]1C[C@@H]3CC[C@H](C1)N3C(=O)c1cccc(B(O)O)c1)C2 1796193244 XJSXLZYUZKNFHQ-FFGOWVMKSA-N 494.357 0.254 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn(C)cc1C(F)(F)F 1796678956 WAWWCPOIVJIKEV-IVWMJMPLSA-N 459.469 0.620 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1797694582 IIAARHRWUHQKJE-RBGFHDKUSA-N 490.001 0.416 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1[nH]nc2c(Cl)cccc12 1799076508 CCOVLXHAQYVHKR-NXCRSVRDSA-N 497.943 0.661 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2 1799259533 VGPYXVNXIOSKGQ-HGKCTWBKSA-N 473.643 0.969 50 20 JCGD O=C1COc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)cc2N1 1799349000 FOCFOUHJBQIMHR-OXUXUCFPSA-N 456.268 0.911 50 20 JCGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)nc2ccc(Cl)cn12 1801012794 LXUQSQJPCNFTIK-USGNIVHTSA-N 476.965 0.872 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1F 1805145939 UKIHDUGXDJZJET-HNAYVOBHSA-N 480.504 0.895 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1cc(=O)n2[nH]cnc2n1 1807357388 GAMFSMQWVMBPCH-CQDKDKBSSA-N 478.282 0.823 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnnc(Cl)c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360585 CMCSLZHHGHNLIQ-UZLBHIALSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)Cc2ccccc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372363 DSXZCWFQYRNXFC-QPTUXGOLSA-N 473.338 0.685 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)[C@H]1c1cccnc1 1807744561 XKCMYRCRCJHCEK-MTXNFPGFSA-N 484.601 0.861 50 20 JCGD CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808408207 HEWAFNBNFHQZLB-QOZRKGCKSA-N 488.570 0.656 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnc2ncccn12 1809331126 QBDNOASSOMTRJV-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD COCCOCCOCCC(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809974672 ZLPNTYDSFOTJMR-UHFFFAOYSA-N 476.379 0.281 50 20 JCGD CCC1(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)COC1 1810304560 DWZTUOXPPMCECC-LPHOPBHVSA-N 452.515 0.826 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc([N+](=O)[O-])[nH]1 1811611974 NEJPTRMSVDNHOX-OXJNMPFZSA-N 463.259 0.631 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)CC1 1817471745 YTIJIQSPGUTEDN-FQEVSTJZSA-N 468.367 0.033 50 20 JCGD O=C1CCc2ccc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)[nH]n3)nc2N1 1817810637 PXGGVEKGFZAPFX-LJQANCHMSA-N 488.313 0.989 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)CC1 1818638807 LSHNNRFZFLFZTG-YPMHNXCESA-N 464.997 0.326 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cnn2ccncc12 1818733591 HQGOELHBMSXFCW-GOSISDBHSA-N 459.275 0.752 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826088568 YHYPQFXSMKSOMN-NWDGAFQWSA-N 453.569 0.136 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1830535406 NSYHMNWNOOMEOF-MGPUTAFESA-N 485.379 0.622 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)[C@@H]2C1 1830735004 CBIGOXVHWYZLPK-BSQBWSPESA-N 487.981 0.155 50 20 JCGD CC1(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CN(C(=O)OC(C)(C)C)C1 1830737119 AJGHAVNVVAZZJT-ZHRRBRCNSA-N 489.997 0.690 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833313833 VEFHWVNIKJALSY-JXFKEZNVSA-N 464.994 0.976 50 20 JCGD Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cs1 1833818737 NYQBYHKZSYEMEN-UHFFFAOYSA-N 470.404 0.559 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCS(=O)(=O)c3ccccc3)CCO2)C1 1835146265 MKKJLGXPGBHMBZ-GHTZIAJQSA-N 488.990 0.561 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H](N)c3cccnc3)CCO2)C1 1835823783 AMJWPEFJTMCVBG-MDYRTPRTSA-N 469.380 0.959 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937470 YKLTYMVBQRHRGL-SANMLTNESA-N 494.353 0.004 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)c2c1 1836923726 QKIMBLYHDSANTO-RUZDIDTESA-N 493.325 0.240 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837438445 YRAIIRASFOZPJM-HOIFWPIMSA-N 489.997 0.832 50 20 JCGD CCC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)n1cccc1 1837457623 LFTCKDLATAYNHI-HYBUGGRVSA-N 484.557 0.598 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1cccs1 1837461134 OVYIXDGTXPVRLW-NYHFZMIOSA-N 473.555 0.620 50 20 JCGD Cn1nccc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837486624 BKAUKKFRAGOGCK-UHFFFAOYSA-N 455.519 0.345 50 20 JCGD CCc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1837722005 KDNWLDLIUMJOBN-OAQYLSRUSA-N 474.543 0.088 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])CCO2)C1 1838601776 UCVTUARHZHUBCE-VBKZILBWSA-N 487.893 0.633 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1 1839199154 RMMUYZNJEVIYLI-SJLPKXTDSA-N 460.300 0.780 50 20 JCGD C[C@]1(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC=CCC1 1840554742 HXLSGRLKEDOUOM-XZOQPEGZSA-N 457.531 0.502 50 20 JCGD C#CCCCC(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1846373362 PBQHMEGNOTYBER-NRFANRHFSA-N 497.401 0.809 50 20 JCGD Cc1nc(CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cs1 25166537 LMDAEWWPJMZOSC-UHFFFAOYSA-N 452.558 0.795 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cnc21 727221887 BFURMBWBAMRHKN-UHFFFAOYSA-N 497.693 0.550 50 20 JCGD O=C(COC(=O)CNC(=O)NCc1ccc(Cl)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 728341596 AGEYVJJNLCRJFR-KRWDZBQOSA-N 476.873 0.670 50 20 JCGD O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)C1CCN(c2ncccn2)CC1 729044918 OIIVKMKTSWLXKD-HXUWFJFHSA-N 453.547 0.924 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)cc1 743845320 IIPFAAYDZTXUAV-UHFFFAOYSA-N 497.533 0.400 50 20 JCGD COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)NNC(=O)C(=O)NC(C)C 744446721 LHXLGZHMSPXCGS-UHFFFAOYSA-N 460.512 0.732 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCNC(=O)Cc1cccc(F)c1 748825254 QXXVBIVNUPRSOB-UHFFFAOYSA-N 464.523 0.730 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 751206081 BNHFCCJBDHROJJ-CYBMUJFWSA-N 495.539 0.634 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccc3n[nH]cc3c2)C1)c1ccc(-n2cnnn2)cc1 751293606 BFEWJEYUGYOGLV-MRXNPFEDSA-N 459.470 0.852 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)c1ccc(-n2cnnn2)cc1 913155944 IQYZJTUWPGGCIO-UHFFFAOYSA-N 451.468 0.555 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc(-n4ccnc4)nc3)nc2)CC1 916236358 GZBPRRAIRRPYMX-UHFFFAOYSA-N 471.547 0.425 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccnc(-n3cccn3)c2)cc1 916394188 GGNZOWAORXEEOQ-UHFFFAOYSA-N 457.516 0.727 50 20 JCGD O=C(Cn1nc(-c2ccccc2)ccc1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916743058 FCCGNHAKGAQNLE-UHFFFAOYSA-N 497.533 0.392 50 20 JCGD O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916828457 IILRPZJHNYLIML-UHFFFAOYSA-N 489.466 0.748 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1 920226612 PSNVZNMFFHPVLV-UHFFFAOYSA-N 478.527 0.409 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H](CO)NC(=O)c2cccc(Br)c2)cc1 920646588 IBDGFKOPCDLGTH-INIZCTEOSA-N 478.299 0.853 50 20 JCGD CN1C(=C(C#N)C(=O)COC(=O)C2=NC=CN3CCS(=O)(=O)N=C23)N(C)c2ccccc21 923866799 JZUWCHVGQPRGRD-UHFFFAOYSA-N 454.468 0.390 50 20 JCGD CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2)CC1 1337481681 QNKREODXFBZFDV-UHFFFAOYSA-N 463.498 0.867 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)CC2)CC1 1778321084 JYDHGZSLGDAHCD-NFBKMPQASA-N 485.025 0.139 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1779028448 LSQOYNFCQIGOOY-JOCHJYFZSA-N 455.519 0.394 50 20 JCGD C[C@@H](C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)N1CSCSC1 1779147332 RRZQTVUHZJIUKX-VBKZILBWSA-N 480.616 0.172 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374986 JHOBFEDYMDGNFX-SWWFSWNPSA-N 482.541 0.675 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(Cl)nn1 1779627723 VYDUXKVAGFNPCX-DYESRHJHSA-N 458.711 0.251 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)COc3cccnn3)CCO2)C1)NC(=O)NCc1ccccc1 1780968913 ITBYZIIGFPZPID-XMMPIXPASA-N 497.556 0.032 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1781238899 NLPVNCIGQPEEMJ-DEOSSOPVSA-N 480.525 0.384 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1783343450 JFXNBVSRGVMTET-TVSHIAKJSA-N 483.363 0.996 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1 1783950183 LDTXBNLGBIAXCV-OALUTQOASA-N 466.362 0.992 50 20 JCGD COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1OC 1784846056 OMTFQXQBPSKFQK-PTLVVNQVSA-N 496.369 0.610 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cnc[nH]3)[C@H]2C1 1785221425 VCKMAEUXIUAZIU-YKNBRYRPSA-N 455.519 0.456 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(C(F)(F)F)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981084 QBPGRLSTWQFKTR-JVPBZIDWSA-N 477.248 0.687 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc(OC)c1C 1786981832 AXKWUUDOKRCMNR-NYDSKATKSA-N 482.342 0.599 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3occc3Br)C[C@@H]21)c1cccc(B(O)O)c1 1786983313 MZFZRQRAKYWSKF-QRTARXTBSA-N 477.120 0.629 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C[C@@H]21)c1cccc(B(O)O)c1 1786983995 JMWOXGSSEAAZCQ-OHEPNIRZSA-N 465.290 0.894 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)[C@@H]1SC(=N)NC1=O 1787495954 WERXPRHLXOARNG-BLDNINTCSA-N 456.641 0.620 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)CC1 1787507604 IOZVSOZGPHKJOD-RPIBGLMYSA-N 459.503 0.053 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])c4c3OCO4)[C@H]2C1 1789289291 HNKSVRMRHGVJKH-QRTARXTBSA-N 491.501 0.290 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c(O)cccc34)C[C@@H]21 1791293976 VFEDQJOBAYKSDM-QSFXBCCZSA-N 469.542 0.907 50 20 JCGD O=C1CCc2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)nc2N1 1796105785 SVJYBLRGAQXJEX-JLUCKKNBSA-N 455.284 0.860 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796189819 FEPMIDDGHBJEFD-FCGDIQPGSA-N 457.336 0.628 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(OCCCO)cc1 1796191806 ASQCHEKSLPGDKX-WKCHPHFGSA-N 452.316 0.693 50 20 JCGD CCc1nn(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1Cl 1796441244 NTOZSEYXFNBSKQ-FXOZFUDCSA-N 489.964 0.973 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2 1796889550 CDMPVVQUAMMZSD-RMUFRZIHSA-N 490.561 0.644 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3c(F)cccc31)C2 1797748730 YORSRBNOGOJHON-YEZVWNJWSA-N 480.500 0.682 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnn1 1798055468 CDPOTDIHJBSOMI-XRGAULLZSA-N 453.927 0.812 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)cc1)C2)NC(=O)NCc1ccccc1 1799097232 KUTYVQFVBPWYRY-JHDGKUDLSA-N 481.553 0.942 50 20 JCGD CCN(CC)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1 1800302248 YNGKKNWSDSPRIQ-CBJLPSGESA-N 479.386 0.653 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 1802028963 GZQOIALZJUVKNS-ILOCAZANSA-N 481.594 0.368 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C12CC(c3ccccc3)(C1)C2 1802217347 SKKYWRADVVFNBC-LJAOBULASA-N 460.339 0.692 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)C2 1802338025 MUQLOSBVYQPTEI-CWQOZTLDSA-N 481.594 0.225 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc(O)nc(O)c3C2)[C@H]1c1cccnc1)[C@H](O)CCl 1803141135 LOTKEXBUZUXQOX-OLUCIUBSSA-N 475.933 0.693 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@H]2CCC(=O)N2)[C@@H]1c1cccnc1 1806819859 TZQBBBYAJRBKOT-JBKKHTOXSA-N 465.514 0.500 50 20 JCGD Cc1nnsc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365138 WADOPOAXVLCFJG-WMZOPIPTSA-N 451.317 0.555 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807365832 PPWPCKIARPUWPE-BVSLBCMMSA-N 450.348 0.565 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C(F)(F)C(F)F)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807367263 XYTBFDIIRGVBKU-GOEBONIOSA-N 453.201 0.981 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCCn2ccnc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368500 UKSRNWGPAYNVLY-NFBKMPQASA-N 461.331 0.758 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373704 DOMIHPPOOHGQFW-SNJCGAMXSA-N 491.353 0.836 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807615724 IJIQXEUZZOLQQT-CTNGQTDRSA-N 496.373 0.994 50 20 JCGD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc(O)n1 1808334543 XZYAZSGRIWFFEM-GCJKJVERSA-N 460.299 0.804 50 20 JCGD O=C(C#CC1(O)CCCCC1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809978382 BQPMXSHDMQSKGW-UHFFFAOYSA-N 452.360 0.910 50 20 JCGD Cc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810293201 AVUDPCKTHUEROM-OXQOHEQNSA-N 462.514 0.755 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)Cc2cscn2)[C@@H]1c1cccnc1 1810301916 DVUPFWHJGYZBBY-UIAACRFSSA-N 494.581 0.426 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1 1810303637 UFPMNVVLXQFQHE-JXFKEZNVSA-N 485.508 0.756 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810306409 YTYIBGSHZIBMGQ-JXFKEZNVSA-N 497.556 0.924 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)Cn2cc(C)c(O)nc2=O)[C@H]1c1cccnc1 1813038373 YNGVKUFQVOQGRF-RYRKJORJSA-N 463.922 0.612 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1 1813074358 YAXOWXJIHLHZSZ-NTKDMRAZSA-N 478.557 0.746 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)COc2cccnn2)[C@@H]1c1cccnc1 1813075217 XZKDNBXVLJBECK-HTAPYJJXSA-N 455.519 0.329 50 20 JCGD N[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccccn1 1815011996 PJAISEGOEJUGEO-KSSFIOAISA-N 451.317 0.144 50 20 JCGD Cc1cc(C(=O)NCC(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)no1 1819798081 UFCMZZUMCFZCGR-LLVKDONJSA-N 498.525 0.094 50 20 JCGD CCn1nc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1C 1820770166 VNOMMADIDQOMMD-OAHLLOKOSA-N 453.333 0.887 50 20 JCGD CC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)CC2 1822841102 HXQIDAYYVPEPJR-MNOVXSKESA-N 493.977 0.520 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2 1826083898 VAKZSKYOKNCEEJ-LLVKDONJSA-N 464.508 0.233 50 20 JCGD Cn1cc(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)cn1 1827052770 DVKYBPZTOJFWTM-QFIPXVFZSA-N 452.364 0.966 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1830535665 RVMSBOHJXMUDKW-YJYMSZOUSA-N 469.336 0.282 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830724793 CJTRRAOHVFSYJQ-GCKMJXCFSA-N 475.970 0.512 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@H]1OCCc3ccccc31)CCO2 1831249172 FNTMKVGZIIIREL-PXDATVDWSA-N 488.585 0.520 50 20 JCGD COC[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1831629772 MDRBTIMOMIUCQB-NTKDMRAZSA-N 491.589 0.072 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832074702 FZNWNHAOCFPGDN-URZJWIJPSA-N 489.997 0.832 50 20 JCGD Cc1csc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1832979204 DGTJGFDPSMVAGP-QHCPKHFHSA-N 472.372 0.439 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)n1 1833330644 MDTWWOOSASZLIZ-IBGZPJMESA-N 469.336 0.895 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1ccnc1 1833376724 NHHRDIMHKIGLQI-MRXNPFEDSA-N 468.562 0.328 50 20 JCGD O=C(c1ccc(N2CCOCC2)cn1)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1833618141 XGOGJXMLEGLUIY-HXUWFJFHSA-N 473.357 0.792 50 20 JCGD O=C(Cc1cccs1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834856459 WNZIHYDEWHVPLJ-UHFFFAOYSA-N 455.389 0.856 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1835045848 OCFCFQCCLSFBSH-IRXDYDNUSA-N 477.002 0.043 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(F)(F)F)CCO2)C1 1835323033 GNNCYOSCKXSQLW-SFHVURJKSA-N 459.425 0.098 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(-n4cnnc4)cc3)CCO2)C1 1835498286 CDGUNNXUZRDXNT-RXVVDRJESA-N 463.922 0.591 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1 1835939225 ICXDBZSJEDVSHK-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@](C)(Cl)CCl)CC2)CC1 1836400097 VCLQXIDAPAOKOV-YLJYHZDGSA-N 465.422 0.945 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1837041175 TXEOFFVSVIZDDX-UHFFFAOYSA-N 453.584 0.226 50 20 JCGD O=C(c1ccc2ncnn2c1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837170371 OPSXQYVUJYWLDV-WMLDXEAASA-N 456.272 0.490 50 20 JCGD Cc1cccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457755 POJCIXYFJXWIMG-XMMPIXPASA-N 467.526 0.306 50 20 JCGD COc1cccc(OC)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460069 RVBGBKULCREZOM-DEOSSOPVSA-N 499.524 0.086 50 20 JCGD CCc1ncsc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460260 YRFWRXFQJQSAHH-NRFANRHFSA-N 474.543 0.088 50 20 JCGD O=C(c1ccc(Br)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837826037 AVCNTABLWXSULX-YOEHRIQHSA-N 462.728 0.514 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2 1838862393 OVLYWBICWHNZQF-JOCHJYFZSA-N 475.452 0.347 50 20 JCGD COc1cccc(OC)c1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838883009 MUDSMAOLGVHDPR-QHCPKHFHSA-N 478.546 0.147 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1839153367 XRDYZCIQQHANDS-QZTJIDSGSA-N 457.318 0.431 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1839153908 VSOMLUOPCLUSCZ-VQTJNVASSA-N 484.340 0.396 50 20 JCGD O=C([C@H]1CC[C@@H]2CCC(=O)N2C1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202171 WJHIOPIEVWNZFU-MVWRLGRASA-N 476.343 0.534 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)CCO2)C1 1839450429 NNOFELUZTZVGBU-DYESRHJHSA-N 484.937 0.985 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1[N+](=O)[O-] 1840187313 RXTXHPFQHWBZAY-JOCHJYFZSA-N 493.517 0.046 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F 1840527498 BFACYZHMCPCFGT-HSZRJFAPSA-N 480.537 0.206 50 20 JCGD C#CCCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1840843335 KTDKOIWQKHEQHB-DEOSSOPVSA-N 471.558 0.202 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)CCO2 1840882623 LPPHBSOAOLHIPA-DOWNOZBLSA-N 489.997 1.000 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCNC3=O)C1 1842563860 KWHXANAIEYWTPN-UHFFFAOYSA-N 482.453 0.591 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)[C@@H](O)C1 1843981167 BMQLQRLUSKCTCY-SIFCLUCFSA-N 459.971 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)Cc1ccc(Br)cn1)C2 1844263658 CVJVJSCKEPZXII-UHFFFAOYSA-N 473.331 0.902 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263729 NYVKYIMBVQHDIA-UHFFFAOYSA-N 466.498 0.776 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)NC(=O)CO3)C2 1844264368 LFXICDSAMCTOHH-UHFFFAOYSA-N 450.455 0.147 50 20 JCGD CCCC[C@H](NC1=NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 22193017 UHHMUVSBVNEGDO-KRWDZBQOSA-N 482.526 0.721 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1 725870367 GKOYQWVAHWKYMH-UHFFFAOYSA-N 467.479 0.332 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)c1 726710863 VYKCRIJTPGGBCY-UHFFFAOYSA-N 457.491 0.177 50 20 JCGD Cc1nc2cc(O)nn2c(C)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 747337500 SBRSYTIHEAKVCH-UHFFFAOYSA-N 460.516 0.696 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1OC 768921549 XTPWOMPQLMQVJA-UHFFFAOYSA-N 461.456 0.092 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 838617630 YCTBFXJZIRDQBJ-NSHDSACASA-N 489.290 0.868 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)C1CCN(c2ccc3nnnn3n2)CC1 904494637 IZQGUZAJLYNMDO-UHFFFAOYSA-N 488.892 0.402 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 914829833 YTUNIHPIVWYAAT-WCQYABFASA-N 474.333 0.011 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)Cn2c(O)nc3ccccc3c2=O)cc1OC 915402475 MYOVOJBPGASQMQ-UHFFFAOYSA-N 456.411 0.124 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC[C@H](Cc3ccccc3)N(C)C)nc2)CC1 915901725 YWGRMDJEITVJLT-IBGZPJMESA-N 475.619 0.817 50 20 JCGD COc1cc(Br)c(S(=O)(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OC 919960912 LKDRZCSTHXUUJL-QMMMGPOBSA-N 472.339 0.146 50 20 JCGD COc1cc(NC(=O)C(C)(C)C)c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1OC 920745615 MIQZKOHHUCDRGB-NSHDSACASA-N 456.521 0.820 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@@H](F)CN3C(=O)OC(C)(C)C)C2)C1 1778080037 IBDSNEIYGNFGMS-SAHWJRBASA-N 499.584 0.537 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)[C@H]1SC(=N)NC1=O 1778085864 WQRQYYATEGRVMI-PZISXKGQSA-N 479.372 0.993 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1778382900 VNQBAEJRBNKNEQ-DJJJIMSYSA-N 468.352 0.634 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1F 1779028519 FUYSUNOLQQTVOG-JOCHJYFZSA-N 457.462 0.590 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1 1779034009 IJADEOQXGCNWSK-NVIZVJJSSA-N 451.483 0.548 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccnn2)C1 1779650952 INIZTTSTTYYTCK-GULKHOJOSA-N 453.503 0.738 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1 1779689980 IQDAVDRUIBQCJR-HSZRJFAPSA-N 476.497 0.023 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CNC(=O)C1)CCO2 1780098141 CYWMZLJFFZFXCR-SPLOXXLWSA-N 460.443 0.100 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1780401369 MCKBAJGBBJPJKU-QHCPKHFHSA-N 454.336 0.464 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@H]3CCC(=O)N3C2)C1 1780608471 APFKBKHXPHTHTN-XRAJMZMQSA-N 498.584 0.214 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCc3noc(-c4ccccc4)n3)C2)C1 1780892239 FVGPDFDRUWZVNC-XMMPIXPASA-N 484.557 0.872 50 20 JCGD C=C(C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2)C(F)(F)F 1781805592 OGROUOAPGJIJTC-DNVCBOLYSA-N 455.437 0.931 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1783666330 JMMGFUXAHYCZRI-NVXWUHKLSA-N 455.321 0.577 50 20 JCGD COC(=O)N(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)Cc1ccccc1 1783687375 UPIGWUKYSJYHPZ-LAUBAEHRSA-N 453.923 0.685 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1783848260 UVVOEONJKKWVJA-JKOZEPOUSA-N 455.914 0.680 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1783934926 LYYXDSHBBHGEBC-QFIPXVFZSA-N 466.510 0.659 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCC(=O)N1C(=O)OC(C)(C)C)CCO2 1783938061 RDFKJFFYELGWGE-MWTRTKDXSA-N 495.577 0.115 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784086146 GNSVGCXKFYSMNA-LLLHUVSDSA-N 453.923 0.840 50 20 JCGD C=C(Oc1ccccc1O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1787501788 QPWAPXAOUUIGCP-JLMWRMLUSA-N 466.299 0.258 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508364 HCNAFTXTXOOPER-GNOJTZLFSA-N 459.547 0.673 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc([N+](=O)[O-])cc2c1OCC2 1789218028 IHTZHCHUVJJBTB-NDXORKPFSA-N 495.297 0.117 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncnn3C)C[C@@H]21 1789221082 UDBXMIAKONKRLB-OWQGQXMQSA-N 472.458 0.556 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4ccnn34)[C@H]2C1 1790344990 IQYSVOHVKLFHBC-DCPHZVHLSA-N 463.498 0.240 50 20 JCGD COc1cc(Cl)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1792028220 OGQZIUVLKJKJKJ-JHVJFLLYSA-N 472.734 0.936 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC(=O)N(Cc3cccs3)C1)C2)[C@@H](O)CCl 1792975333 NVIYREIXKXYZOQ-FEZYCPBGSA-N 455.964 0.286 50 20 JCGD CCOC(=O)c1c(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c[nH]c1C 1793126343 DWKZXMCDVOIUGH-BBIADKPPSA-N 497.357 0.016 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](N)c1ccccn1 1795613551 UKBPDUHLWRNBEL-YQMDMEMYSA-N 483.481 0.818 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cccnn2n1 1798419902 YAGMVQCOYDHVQU-DHMDNZFNSA-N 464.486 0.067 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(Br)ccc1O 1798837375 AQGMKDBOHIPZLR-HBCWATKFSA-N 489.131 0.352 50 20 JCGD Cc1cc(C)n(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)n1 1799094929 KHXXLOKDLCLCFQ-RUMRUAAYSA-N 497.600 0.436 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(O)c1)C2)NC(=O)NCc1ccccc1 1799097560 PBIKNFFLYHTKQG-HATOLVCRSA-N 482.541 0.337 50 20 JCGD Cc1nc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)o1 1799097696 ULDYGSZBBCWWLZ-CEQLMSFQSA-N 484.557 0.841 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)[C@H](C)Br)C3)C2 1800327021 YZYBIHIWLHGMNY-JGFGOLAASA-N 497.390 0.995 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1802053439 ZNFWQMAAVRGJFG-AENRVVEGSA-N 459.971 0.985 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cl)COC)C2 1802087052 GZSHERNROAWSIR-JKJDWNRSSA-N 491.969 0.286 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803141714 TVANDBMRTKAAGP-XMTFNYHQSA-N 484.981 0.963 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803611961 BWCCBVZEOWYRON-UQOODKLHSA-N 454.531 0.807 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359762 DLZNYUNRNIBEJO-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(=O)c2ccccc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371208 RCXQMCIYNANFBG-IFMALSPDSA-N 457.295 0.964 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3c(c2)CNC3=O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376007 RAODPDARMXYZOC-XXBNENTESA-N 484.321 0.638 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807376369 YMSCSMVLWYHBFZ-WGGBDISSSA-N 474.326 0.944 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CNC(=O)N(C)C)[C@@H]1c1cccnc1 1808407494 AKADTGXOXFBMMV-PFWGCWTJSA-N 482.545 0.493 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2C[C@@H](O)C2)[C@@H]1c1cccnc1 1808417955 UKDIWRPHXAWRIL-ARTNPVLRSA-N 452.515 0.992 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnc2ncccn12 1809331130 QBDNOASSOMTRJV-WIYYLYMNSA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc3c(c2)CNC3=O)[C@H]1c1cccnc1 1810037267 BKORPBVDSJUQIB-HTAPYJJXSA-N 499.531 0.957 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc([N+](=O)[O-])[nH]1 1811611976 NEJPTRMSVDNHOX-OXQOHEQNSA-N 463.259 0.631 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CS(=O)(=O)N2CCCC2)[C@H]1c1cccnc1 1813030560 JJCRJCYRELABRM-LNLFQRSKSA-N 472.995 0.767 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOCC2)n[nH]1 1817148335 BXJFFXGXUCMIQA-QGZVFWFLSA-N 456.507 0.046 50 20 JCGD Cn1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c2c1CCC2 1817476648 YFIWCZADCABMPW-IBGZPJMESA-N 462.319 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccn3c(O)nnc23)n[nH]1 1817966796 UDYVQTPKLZLMQM-MRXNPFEDSA-N 490.484 0.776 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4nncn4c3)sc2C1 1819180783 KVGZZTFZBQLAON-CYBMUJFWSA-N 456.532 0.785 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@H]3c3cc(NC(=O)c4cnccc4C(=O)NN)n[nH]3)CC2)CC1 1819404078 XBNYTWXSFVSTEU-IBGZPJMESA-N 495.588 0.494 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1821736435 VXNLCBCBSUSWSH-QGZVFWFLSA-N 494.273 0.166 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@](C)(Cl)CCl)sc2C1)C(=O)C(=O)O 1822869294 IAMIHWZYYYVKCL-VPTHRUTESA-N 451.332 0.834 50 20 JCGD COc1cnc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn1 1826176284 VTYSIHVDKNSRLT-HXUWFJFHSA-N 452.320 0.712 50 20 JCGD Cc1cnn([C@@H](C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1 1826744823 OVJTUVRBENNLNI-XJKSGUPXSA-N 453.333 0.815 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1828966500 ADYRHEDWJDKTOI-ZJBJCVSYSA-N 497.955 0.566 50 20 JCGD CC(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1830017968 HMOGNQDFIONRFO-XMMPIXPASA-N 491.589 0.214 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)N1CCN(C)CC1 1830237851 IKSIKUDLJPVZDZ-WMZHIEFXSA-N 470.423 0.236 50 20 JCGD Cc1cc(Br)cnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724007 BVHOQMYFLFDCOC-KBXCAEBGSA-N 476.755 0.822 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830724651 AJMBTBJJCUWFEA-JLTOFOAXSA-N 463.959 0.346 50 20 JCGD C[C@H](Br)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1831651324 SJDOQCQVEQMIND-SMDDNHRTSA-N 466.340 0.829 50 20 JCGD Cc1cccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1832242704 JYOGHPZJPWIQDE-RUZDIDTESA-N 481.553 0.696 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C3=NN(C)C(=O)CC3)CCO2)C1 1832371440 PUWVUOMEEFFEDZ-SCLBCKFNSA-N 459.341 0.082 50 20 JCGD O=C(C(Cl)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833028138 KZYUZALJBXKFFB-JEOXALJRSA-N 475.329 0.253 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)n1 1833035598 LZFWUGWXRMWWCQ-LIRRHRJNSA-N 457.369 0.987 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)CC1)[C@@H](O)CCl 1833308494 UNWJMQBFBWNFLM-FXAWDEMLSA-N 451.951 0.998 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C1CCC(CO)CC1 1833721404 ROMAGFXWDZKPRR-UHFFFAOYSA-N 471.407 0.350 50 20 JCGD Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cs1 1833819108 ALRZYWWIUSLECH-UHFFFAOYSA-N 464.636 0.939 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1834823008 DJNZSWSAHNXATO-SFHVURJKSA-N 457.325 0.521 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1[nH]nc2ccncc12 1835018746 XEMNWBOQPDBVBY-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737234 YRJLEOKLTPRINO-UHFFFAOYSA-N 482.589 0.534 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc4cccnn4n3)CC2)CC1 1835738003 PTRIPADWHIIHSM-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD O=C(C[C@H]1CCCCO1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837049893 YHUAQLZPNGJPHH-JOCHJYFZSA-N 458.364 0.938 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1 1837458831 FFZGQYAJWVNLCH-NRFANRHFSA-N 474.905 0.117 50 20 JCGD CN(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837460202 XMLURWFVJQPFSD-XMMPIXPASA-N 482.541 0.135 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3CS(C)(=O)=O)C2)C1 1837712267 MDZJPMRLNBBWKM-OAQYLSRUSA-N 499.662 0.548 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1 1837713074 FXDBTAQINZIUGU-JOCHJYFZSA-N 461.591 0.852 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1C(=O)OCCO)CCO2 1838568576 JFGIEBMQDCCQGJ-QHCPKHFHSA-N 494.617 0.757 50 20 JCGD O=C(c1cnc(OCF)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839197715 GLKBXAJOKBELKE-XJKSGUPXSA-N 465.251 0.543 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C#N)ccc1F)CCO2 1839422501 XOQNKLPJQGGJQN-QFIPXVFZSA-N 461.494 0.140 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn(C)c3=O)C2)C1 1839963003 XEPVAZAKFVMIBP-HNAYVOBHSA-N 456.337 0.629 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1840154997 MHXNDWZBXBULRL-KUHUBIRLSA-N 455.874 0.192 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCOc3ccccc3)C2)C1 1840183530 KDZLJWLUVIFNEL-HSZRJFAPSA-N 462.547 0.285 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC(F)F)cn3)C2)C1 1840183620 PTDNKJHITIJFRL-NRFANRHFSA-N 485.488 0.126 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1 1840184833 FXJZOEVFGGCATR-QFIPXVFZSA-N 495.508 0.106 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840895011 AMVBGERTAIVHAV-ACJLOTCBSA-N 464.009 0.711 50 20 JCGD CCc1[nH]nc(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)c1I 1841350492 GJWCXLBWLADVPZ-SNVBAGLBSA-N 466.707 0.993 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)c2cc[nH]n2)C1 1841698770 LPZBGUFUPNMEPR-IBGZPJMESA-N 497.361 0.043 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(Cc3cccs3)C2)C1 1841979044 PGRHJHGOTDPCBL-OAHLLOKOSA-N 482.566 0.612 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2nc3ccc(C(F)(F)F)cn3n2)C1 1843155377 YQUXNTIEVBKYAN-UHFFFAOYSA-N 473.220 0.559 50 20 JCGD CC[C@@H](CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)NC(=O)OC(C)(C)C 1845234562 QXSBONFMNXKRTI-SFHVURJKSA-N 459.352 0.877 50 20 JCGD O=C(CN1C(=O)CNC1=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1 1845940560 XHPMQJSTPSGYLZ-HNNXBMFYSA-N 463.332 0.748 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cc1cccs1)c(=O)n2Cc1ccccc1 15812987 KINPZXWFAZLCBI-UHFFFAOYSA-N 496.549 0.506 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1Br 725909397 LPBPXLGBVRWOPD-UHFFFAOYSA-N 461.319 0.349 50 20 JCGD CC(C)(C)NC(=S)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 726141862 OREYJUJMBBJFGM-CYBMUJFWSA-N 485.053 0.715 50 20 JCGD O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1 726862187 HCOJIDXNXOTELD-QFIPXVFZSA-N 469.523 0.964 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727100186 OXUPMSYNHRIMPU-UHFFFAOYSA-N 459.264 0.310 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@@H]2Nc3ccccc3S(=O)(=O)N2)c2ccccc2c1=O 727752728 IJROTIAVTDYCTC-QGZVFWFLSA-N 456.484 0.298 50 20 JCGD N#Cc1cccc(C(=O)NNC(=O)NCc2ccccc2CS(=O)(=O)N2CCOCC2)c1 728941042 LQUCXMDPVSBWMO-UHFFFAOYSA-N 457.512 0.864 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(CC(=O)N2CCCc3ccccc32)CC1 731365779 PJGWJFOECCTTEF-UHFFFAOYSA-N 484.582 0.816 50 20 JCGD C#CCNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)cc1 811831535 MWYSSACJEWGNGJ-UHFFFAOYSA-N 479.898 0.878 50 20 JCGD COc1cc(N2C[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2=O)cc(OC)c1OC 914406142 PRPAQKRSHOXJCA-AWEZNQCLSA-N 481.469 0.502 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)c1 914602644 HIEWBRTXGYVDAZ-UHFFFAOYSA-N 498.558 0.935 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cccc[n+]1[O-])N(S(C)(=O)=O)CC2 916158989 BSYPDWGQDUVOCQ-MRXNPFEDSA-N 464.500 0.047 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cnn(-c2ccccc2)n1 916550160 OTBZVJDRQGXETG-UHFFFAOYSA-N 484.538 0.682 50 20 JCGD Cc1cc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc(S(=O)(=O)N2CCC(C)CC2)c1C 919886295 VDSANPFYCLWYGT-QGZVFWFLSA-N 486.616 0.855 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NN=Cc2nc3c(c(O)nc(=O)n3C)n2C)cc1 920360789 VLGDTPKXPVUMDK-UHFFFAOYSA-N 453.488 0.557 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2 1778091884 AZZRQMDCVSTEHJ-CRAIPNDOSA-N 480.425 0.711 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)no1)CCO2)NC(=O)NCc1ccccc1 1780969048 UGFVDSXIYNQOMC-JOCHJYFZSA-N 472.502 0.170 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1781339983 KPMZPKRTHTWBHD-KKSFZXQISA-N 473.643 0.944 50 20 JCGD N#Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ccc1Br 1781902194 CQLOVPYYSSUQAR-QFIPXVFZSA-N 498.142 0.758 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1 1782514014 DVRVNGPNFJSMCX-DEOSSOPVSA-N 478.509 0.327 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)(Cl)Cl)C2)C1 1783270431 UZZQKIPLJDSJAF-HNNXBMFYSA-N 450.710 0.499 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(Cl)c1 1785121788 JNAFLNDCQGUHSX-JOCHJYFZSA-N 458.707 0.786 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785544956 FQNKZNPXXFMKRZ-JKSUJKDBSA-N 454.401 0.913 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](Cl)COC)CCO2)C1 1785575789 CQXUWVUERBQKHN-QYWGDWMGSA-N 457.955 0.987 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)C(=O)OC(C)(C)C)[C@H]2C1 1786622809 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COc1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1O 1792805402 XRSASPXPDLVTAU-MUJYYYPQSA-N 453.499 0.894 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)[C@@H](O)C1 1792981317 JJLKDZRQUXUNFK-WHDKQWSOSA-N 489.997 0.184 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C1)C(=O)NC[C@H]2C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl 1793117485 ONKZVFMGMCCDDY-WRDSOISUSA-N 499.008 0.598 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cocn1)NC(=O)NCc1ccccc1 1794938986 XXSOEOFFCOLWSU-XEMDLRDOSA-N 456.503 0.224 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732697 BDEKHCSRXKWXCB-HNJRGHQBSA-N 487.362 0.039 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1Cl 1795736934 PBLVKTYVRSRLHY-CWPLJXCYSA-N 458.707 0.545 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796190798 MWBYQTYNLDSUNQ-REPLKXPHSA-N 465.315 0.892 50 20 JCGD 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O=C(c1cnc2ncccn12)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059962 YOZFZVXALPLXMD-HXUWFJFHSA-N 461.331 0.956 50 20 JCGD Cc1nn[nH]c1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551807 UVEBVQQJTMYGTN-HTAPYJJXSA-N 490.948 0.779 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(CN(C(=O)C#Cc3ccc(Cl)cc3)CCO2)C1 1830470498 XZZKHYDKLMCLIZ-HSZRJFAPSA-N 476.961 0.521 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1830539046 ZSKDPIIOKSVENB-LIRRHRJNSA-N 472.336 0.497 50 20 JCGD O=C(C1CCN(c2ccccc2)CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830719837 LXQZEHKCBLCKRQ-NZQKXSOJSA-N 465.978 0.959 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830735025 CBIGOXVHWYZLPK-YGRDSASPSA-N 487.981 0.155 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1831654163 RENFFYVJRPBBMU-BXTJHSDWSA-N 463.959 0.693 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833411879 UCBORHYGRSFMBY-VGOFRKELSA-N 478.933 0.556 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)n2)CCCN1 1833724199 LUFMNUYXRXIULZ-GHTZIAJQSA-N 483.928 0.012 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cnnc(Cl)c1 1833891434 DUJYYEQDDLXCEV-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD CO[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccc1 1834579198 PNAQLQFRQVEJSK-DEOSSOPVSA-N 479.386 0.939 50 20 JCGD COc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1OC 1834798346 KGVVVEUSKHAIOQ-UHFFFAOYSA-N 496.373 0.278 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4nccnc4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798486 BNBHNFXTDQNORH-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800683 YBAZRUDFYRHHST-JOCHJYFZSA-N 456.396 0.036 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cc(O)nc(O)n1 1835076589 SARHKIOZFARMOO-AWEZNQCLSA-N 460.304 0.764 50 20 JCGD CC(C)(C)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835612656 QDBKXDFSORVEAT-AOMKIAJQSA-N 491.029 0.963 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926633 VWADTDLZCAELLM-XMMPIXPASA-N 469.347 0.014 50 20 JCGD O=C(c1cccc(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931298 LYZRXLRYNSGROX-QFIPXVFZSA-N 458.707 0.404 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4cc(Cl)ccc34)C2)C1 1835937161 QLAWPQBQMRGDAT-XMMPIXPASA-N 497.744 0.885 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836128678 YUAMVTWIYMIIAY-HXUWFJFHSA-N 453.568 0.317 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc3c(c1)CCCO3)CCO2 1836683180 MIUJOTIDTTXKQX-RUZDIDTESA-N 488.585 0.384 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccsc3)C2)C1 1837457590 KMQXWRUSUOHJHI-OAQYLSRUSA-N 459.528 0.059 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)c(F)c3)C2)C1 1837460196 XEXHNRBCSREYLQ-JOCHJYFZSA-N 475.452 0.347 50 20 JCGD O=C(c1ccnc(Br)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1837810382 IPOLOEWSKKYWFQ-CXAGYDPISA-N 462.728 0.514 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)no1 1837919185 OJKPAZSELBQXDF-UHFFFAOYSA-N 455.320 0.843 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3Cc4ccccc4O3)CC2)CC1 1837920156 FNXAWMAGAGRFKA-DEOSSOPVSA-N 478.354 0.982 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838383137 AMFFYCRGKCBKCC-INIZCTEOSA-N 468.599 0.066 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)C(=O)OC(C)(C)C)C2)C1 1840151665 KBLSWBFVSQXXMF-FOIQADDNSA-N 463.959 0.564 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C2)C1 1840154076 KPUXZJSSEMVENP-UWJYYQICSA-N 483.905 0.854 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(C)(C)C)nc3)C2)C1 1840182895 KXCSCZUBNKIHIL-XMMPIXPASA-N 475.590 0.822 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccs3)C2)C1 1840183463 FXYMIZHTPQBXCB-OAQYLSRUSA-N 452.577 0.510 50 20 JCGD COc1ccc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185078 HTPKHVHYXROHOU-QHCPKHFHSA-N 462.547 0.447 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)Cn1ccncc1=O)C2 1841925434 UVFZFWNKQAVUKF-AWEZNQCLSA-N 453.927 0.579 50 20 JCGD O=C(c1ccc(Br)cc1O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011893 HTLHHAJLEXQKIY-UHFFFAOYSA-N 459.105 0.965 50 20 JCGD C[C@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)N(C)C(=O)OC(C)(C)C 1844264756 DTKIZIGDFSPECJ-CQSZACIVSA-N 460.535 0.758 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038855 AXHVGRNQUIDNKA-SFHVURJKSA-N 468.562 0.464 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCc1ccc(O)nn1)C2)NC(=O)NCc1ccccc1 1845039365 IMUNUAFMRONAMB-UHFFFAOYSA-N 481.557 0.664 50 20 JCGD O=C(Cn1ccc2sccc2c1=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1848181120 MPTTVJXDGLYWRT-ROUUACIJSA-N 451.313 0.258 50 20 JCGD O=C(COC(=O)c1sccc1S(=O)(=O)N1CCOCC1)NNC(=O)c1ccccc1 12597872 ZZFMEQCGPKJKRW-UHFFFAOYSA-N 453.498 0.387 50 20 JCGD CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1 726275174 YVWGVBSWHITXCG-UHFFFAOYSA-N 473.555 0.903 50 20 JCGD CCOc1cc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)ccc1OCC(=O)N1CCCCC1 728384372 HNTFHQYIPOCDCR-MRXNPFEDSA-N 467.544 0.672 50 20 JCGD C[C@H](Oc1ccc2ccccc2c1)C(=O)NNS(=O)(=O)c1cnc2c(c1)c(O)nc(=O)n2C 728502660 QCYCWGLXEFHUDI-LBPRGKRZSA-N 469.479 0.964 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)NC2CCCC2)c1OC 744060467 CRKUDSJFWDOGJJ-UHFFFAOYSA-N 456.521 0.611 50 20 JCGD CCCCn1c(CCC(=O)NNC(=O)C(=O)NC(C)C)nc2cc(S(=O)(=O)N(C)C)ccc21 744446966 QPQAWJDTKOMJAH-UHFFFAOYSA-N 480.591 0.691 50 20 JCGD Cn1c(CCC(=O)NNC(=O)N2CCOCC2)nc2cc(S(=O)(=O)N3CCCCC3)ccc21 745988319 XNPIQIOMMNZUNP-UHFFFAOYSA-N 478.575 0.754 50 20 JCGD N#Cc1ccc(C(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)cc1 747173113 OVGGIZHXCXYSFZ-INIZCTEOSA-N 454.464 0.957 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)N[C@]3(C[C@H](C)CC(C)(C)C3)C2=O)n1 763949508 QSRBMESOEHEWCT-GTJPDFRWSA-N 479.559 0.821 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(Br)cc1 825615119 IYUBKPQRBKKOQR-UHFFFAOYSA-N 471.333 0.996 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)c2ccccc2S(=O)(=O)N2CCOCC2)cc1 915008291 GGGHFBPGOQXXII-UHFFFAOYSA-N 461.496 0.634 50 20 JCGD CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)COc1ccc(Br)cc1 916580172 HICVEUYJJAVEOF-UHFFFAOYSA-N 451.343 0.830 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3c(C)nc4ccccn34)CC2)cc1 916737169 KOMAKZIGUADNDB-UHFFFAOYSA-N 470.555 0.719 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1c[nH]c2nccc-2c1 1777896567 BJIJUBCKXFFHPO-HYBUGGRVSA-N 462.315 0.636 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CCCC4=O)C2)C1 1777925677 MMYQWEUOLQHHGH-RUZDIDTESA-N 477.521 0.961 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccncn1)C2 1778091087 MVRHYBRBTUHUFQ-VWCSSDMBSA-N 453.503 0.738 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778113878 GFBMEJDMLTUBAC-APWZRJJASA-N 450.001 0.895 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CSCc3[nH]cnc3C)C2)C1 1778912035 OJKLNMXGQFOJCJ-XDEFOSFOSA-N 487.586 0.915 50 20 JCGD Cc1cncc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779028912 POESQLLQNLVNGZ-QHCPKHFHSA-N 452.515 0.465 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1779029503 YGGYEELKNDFEOR-XMMPIXPASA-N 451.527 0.988 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1779374551 OIODTJIZWBAEGQ-HBUWYVDXSA-N 472.315 0.503 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1780778536 LRGTVGLNPFQSRB-GXYOHSSGSA-N 477.986 0.376 50 20 JCGD CN1CCC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)C1 1780967881 AUXYVKOXSYWCPX-OFVILXPXSA-N 486.617 0.504 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)[C@H]1CCCS1(=O)=O 1781656153 YJVIVXJJYQBWLH-BRXULGCHSA-N 455.346 0.768 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1782100748 NHOSEBAQAJTCIM-QFIPXVFZSA-N 469.259 0.046 50 20 JCGD CN1CC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)C1 1782748766 ATMCNBIJSATPGQ-PXDATVDWSA-N 486.617 0.408 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCc3ccc4c(c3)OCO4)CCO2)C1 1783934027 SUNUHDUMHRAPEP-HSZRJFAPSA-N 460.531 0.551 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)CC(=O)Nc1ccc(F)cc1)CCO2 1783935951 YRFCNNHNJHJUCL-QFIPXVFZSA-N 463.510 0.357 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncsc3Br)C[C@@H]21)c1cccc(B(O)O)c1 1786982962 IUZKZLUDKBDYCI-QEJZJMRPSA-N 494.176 0.493 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3F)[C@H]2C1 1787195451 SYIFJNVRVALZQI-VOSSUDFCSA-N 456.478 0.948 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)[C@@H]3CCCS3(=O)=O)CCC2)cc1)c1ccc(B(O)O)cc1 1788143863 ZWDJUKXESZNCMN-IBGZPJMESA-N 456.329 0.691 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(O)c1 1789481164 FBBFSANWBZJITH-GMVOTWDCSA-N 469.498 0.306 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C[C@@H]21 1791254770 RMPKQJLMXFYRNB-SIRPWMCASA-N 477.986 0.760 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccoc1I)C2)[C@H](O)CCl 1792977692 ZVETUERDLXIPOJ-RBLKWDMZSA-N 468.675 0.687 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792982876 UNLBCVCTHZCBCT-RPUYLAQPSA-N 459.971 0.823 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1C(=O)c2ccccc2C1=O 1793862116 HOXAWMRUPKNCEM-CSHUHZATSA-N 463.918 0.516 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ncc(OC(F)F)cc1Cl 1794401539 AAXFTHYEPMDNMK-FVCICTRLSA-N 495.675 0.533 50 20 JCGD O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2 1795114858 FOIHFEBSPOSPNG-QHBPRCKVSA-N 455.334 0.744 50 20 JCGD COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1 1795732460 HREQAZNNVITQBS-BBIADKPPSA-N 452.316 0.211 50 20 JCGD Nc1nc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)ccc2s1 1795737426 FPPVZXJNGUGQFG-CCWDJLKJSA-N 466.328 0.075 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc(C)c1C(=O)O 1795741251 OVGLJTODTAQODI-RMFSNUHRSA-N 466.299 0.198 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1cc(Cl)ccn1 1797906270 SXZPDNIJGOKTMN-DBWKPXFBSA-N 474.905 0.016 50 20 JCGD CCS(=O)(=O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798521710 WWPBVZBWNJXQDG-HBCWATKFSA-N 483.499 0.158 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C/C(=O)NCc1ccco1 1798571230 ZEYIGEFDJPYEFC-MSFXKQMLSA-N 466.498 0.403 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)[C@H]2OCC[C@H]21 1800768541 PQEOXWBBNHWWNY-UATDDVEISA-N 487.981 0.200 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCC(=O)Nc1ccccc1)C2 1801009045 MXRDQYWLJNAJHO-MRSFGVLCSA-N 473.574 0.758 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(c1)NC(=O)CS2 1801077399 YIPSROKEYZOIKU-BTTYYORXSA-N 481.538 0.690 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1 1804421186 NLYVHNAPECUKEJ-IERDGZPVSA-N 472.506 0.265 50 20 JCGD COc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1807360612 CRPGKOXMJQVDOB-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1 1808895294 QCBWGWNBXGAGGB-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1 1810302787 NAGXZEGWUNRFMJ-KKSFZXQISA-N 490.524 0.693 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1 1810303849 ZBVWQBPVJZDAET-KKSFZXQISA-N 474.525 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)COc2ccc(O)nn2)[C@@H]1c1cccnc1 1812353223 MDFJZGJPBQGATL-AOMKIAJQSA-N 471.518 0.035 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CNC(=O)CNC(N)=O)[C@H]1c1cccnc1 1814231746 VSVPRSYWALKYBR-MGPUTAFESA-N 484.469 0.903 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCSCC2)n[nH]1 1814415178 FQWZAQNNFMORMQ-KRWDZBQOSA-N 472.575 0.763 50 20 JCGD N[C@H](CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1cccnc1 1815172705 PDPPANQXUCBDGJ-IAGOWNOFSA-N 465.344 0.534 50 20 JCGD CCOc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1 1815343595 CKVDSNQYUITAJB-CQSZACIVSA-N 467.316 0.551 50 20 JCGD Cc1cnc2c(C(=O)N[C@@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)cnn2c1 1815344117 IOWDWUQEKXKZLK-OAHLLOKOSA-N 476.327 0.714 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3nccc4nc[nH]c34)sc2C1)c1ccc(B(O)O)cc1 1816898826 VFMHICNNTXLNSQ-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CC(F)(F)C(=O)O)n[nH]1 1818025579 CAZXSQOMMAIKQZ-CYBMUJFWSA-N 465.417 0.824 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc2n(n1)CCCO2 1819087495 CHUKHEZEXFVAKY-GOSISDBHSA-N 464.291 0.688 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C(=O)Nc1cccnc1)CC2 1819797585 GEJNHEUANOCPSE-LLVKDONJSA-N 480.510 0.401 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)sc2C1)c1ccc(B(O)O)cc1 1822623963 WQUONSFFIGSLRW-USXIJHARSA-N 482.371 0.450 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nncn3c1)CC2 1826088615 YWFSRMVBQPOTDF-ZDUSSCGKSA-N 456.532 0.785 50 20 JCGD O=C1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](O)CCl)CCN3C(=O)OCc3ccccc3)C2)N1 1828551152 KTYOUPFWWLVHTB-PMAPCBKXSA-N 492.960 0.317 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(O)nc(O)n2)CC1 1828926786 RXJIFRIRPKOYAK-KRWDZBQOSA-N 469.502 0.433 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1828957425 NTJIFCPYTJYTEA-UXHICEINSA-N 482.578 0.474 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n1 1829063205 KIRXPFNFLUKSKK-QFIPXVFZSA-N 494.401 0.900 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1829114590 JTJCCBNLTZSPDZ-BASWRVNGSA-N 488.589 0.891 50 20 JCGD CNC(=O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1831279426 IYBGHSAXVRSQND-UTKZUKDTSA-N 482.375 0.585 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1 1833263541 SXIGTLDEGFDAQY-ZDUSSCGKSA-N 470.416 0.922 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccnc3OC)CCO2)C1 1833508098 BEPHCJPICKUXEI-FZKQIMNGSA-N 457.325 0.729 50 20 JCGD O=C(CCc1ccc(F)nc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833793360 FDSSSJLYHUVFAD-UHFFFAOYSA-N 482.365 0.719 50 20 JCGD Cc1ncsc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834223098 OKDHAIARNIBULL-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4n[nH]cc4c3)CC2)CC1)c1cccc(B(O)O)c1 1834799955 IKAPQICCIJYROY-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1834800009 OLYOBCQYEDFMIQ-UHFFFAOYSA-N 481.406 0.817 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccnc3Cl)CC2)CC1)c1cccc(B(O)O)c1 1834800239 ABVJDDPMPXHOQT-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)n1ccnc1 1834800359 DHODNIJAFTUKIJ-QGZVFWFLSA-N 453.352 0.009 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1 1834818720 CEUSDXJOWGPQIT-LJQANCHMSA-N 466.336 0.673 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Cl)CC3)CC2)CC1 1835080388 KRMWKLUTCNXGIO-QGZVFWFLSA-N 467.007 0.764 50 20 JCGD O=C(/C=C/c1cccs1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928421 OPQKCBGXJKOZDW-DORXLWPQSA-N 456.329 0.211 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2 1836625082 OJFFCNMRWOVACN-LEWJYISDSA-N 484.280 0.354 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836990075 REBFYOVKIDLPRG-UHFFFAOYSA-N 474.363 0.710 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)CN)CC2)CC1 1837089543 PJUGJUXAKPDBEY-IRXDYDNUSA-N 476.018 0.403 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837171194 DDLBWJLSWCFCDB-HNAYVOBHSA-N 466.336 0.973 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccoc3)C2)C1 1837457170 ZBGVSFMSZLEBSV-BIWRPXHWSA-N 455.471 0.062 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837461427 VWIATLOMHOWOJA-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840182429 JCFFYSLDLLZKJJ-UUOWRZLLSA-N 476.574 0.628 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185090 IMTDXSSDMLSTJX-JOCHJYFZSA-N 495.508 0.485 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCN2C(=O)c2ccc(F)cc2)C1 1841307962 REIBLTGNTSSIOC-FQEVSTJZSA-N 494.527 0.946 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843011645 ZUPXRTQEHNLDFK-QHCPKHFHSA-N 475.326 0.533 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)NC(=O)c1ccccn1)C2 1843417116 YAZGBNALDKJGJE-SCQWWOTGSA-N 465.514 0.537 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)c1c(C)nc2ccccn12 21200048 PFQGUDXYDXSKGK-INIZCTEOSA-N 487.538 0.646 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCn2cnc3c(C)cccc3c2=O)cc1 26772644 MZKNOARWXQZPOE-UHFFFAOYSA-N 471.539 0.872 50 20 JCGD O=C(NCCS(=O)(=O)N1CCOCC1)NNC(=O)c1ccc(COc2ccccc2)o1 109636452 LGQLRBJUUGMPJU-UHFFFAOYSA-N 452.489 0.465 50 20 JCGD CC(=O)N1CCN(CCOc2ccc(CCNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)cc2)CC1 728134063 HFLUNWNFPIJZJD-JOCHJYFZSA-N 481.619 0.153 50 20 JCGD C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C 728178707 BYOWHTWFDMDSKF-AAEUAGOBSA-N 457.496 0.865 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNc3ccc(S(=O)(=O)NC4CC4)cc3)CC2)cn1C 728211618 ZAKGJIGPYGRQHM-UHFFFAOYSA-N 496.615 0.713 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)CC1 728213968 SSHHLKMCEZMKGX-UHFFFAOYSA-N 456.528 0.627 50 20 JCGD C[C@@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 728960099 UKSUGJYTHVNNJJ-GOSISDBHSA-N 472.594 0.452 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1 745988392 ZLOVTDKNBGWPTE-UHFFFAOYSA-N 460.472 0.756 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC(=O)N1CCN(c2ccccc2)CC1 749221623 RTSZMHNVWUUXKN-UHFFFAOYSA-N 487.586 0.581 50 20 JCGD CN(C)C(=O)CN1C(=O)C(=NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c2cc(Br)ccc21 750936191 OKGPARZOITWXKK-LLVKDONJSA-N 486.348 0.074 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(=O)n(Cc3ccccc3)n2)cc1OC 847192444 OAJNFHUWIIVOMV-UHFFFAOYSA-N 466.450 0.927 50 20 JCGD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)c1cccc([N+](=O)[O-])c1 866740127 JWXAVWVQOIYSAY-UHFFFAOYSA-N 454.486 0.681 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(Cc2ccccn2)C1)c1cccc(S(=O)(=O)N2CCCC2)c1 914882003 ZBVKJMGXTPFNOQ-KRWDZBQOSA-N 471.539 0.676 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC[C@@H]1CCCO1)N(S(C)(=O)=O)CC2 915879495 DEWDXWKDEXNSEJ-HOCLYGCPSA-N 470.548 0.462 50 20 JCGD CC(C)C(=O)NCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 915906757 NSXMASGHGFGAOH-UHFFFAOYSA-N 461.544 0.881 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)cc1 918552172 OLIMKPOJOWEBLW-QGZVFWFLSA-N 484.490 0.722 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1)N[C@@H]1CCS(=O)(=O)C1 919887016 XHTFRBIBQIQMKL-QWHCGFSZSA-N 474.486 0.658 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 920006729 QUWRALNBGIHRQZ-UHFFFAOYSA-N 451.476 0.859 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1csc(COC)n1)c(=O)n2Cc1ccccc1 920851117 IIPINMRVHBMDRB-UHFFFAOYSA-N 497.537 0.492 50 20 JCGD Cc1oc2cc(O)ccc2c1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1777883379 STOOPWILBWBADC-DEOSSOPVSA-N 464.283 0.884 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCNC(=O)C1)C2 1778095354 WREKECNEIHMTJA-ZVJVYNAXSA-N 472.546 0.161 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1scnc1C(F)(F)F)CCO2 1779031762 XHFKRVLAMICBNV-SFHVURJKSA-N 484.460 0.918 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)nc(O)n3)CCO2)C1 1780097665 DGUOLHAVHIYLPQ-OAQYLSRUSA-N 487.425 0.479 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnoc1)CCO2)NC(=O)NCc1ccccc1 1780969397 ZDSFTGXBUYUAHN-JOCHJYFZSA-N 456.503 0.464 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)[S@](=O)c1ccccc1 1782681485 RAFBPWVQUMXFAE-RPKDZRGRSA-N 470.356 0.006 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 1785531470 XURBDHUGNTUHTI-JOCHJYFZSA-N 486.460 0.419 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C(C)(C)CNC(=O)OC(C)(C)C)C2)C1 1785737837 UZQONHYTXRMGHK-QHCPKHFHSA-N 483.610 0.740 50 20 JCGD Cn1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc2ccccc21 1786979719 NRHKFMRAZORCMD-LEDOBFOHSA-N 461.327 0.765 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(-c4ccccc4)ns3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979800 IGOOXPSDADHMIO-IHPCNDPISA-N 492.366 0.792 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccn4n3)C[C@@H]21 1787508726 HQIMNKBLFVJVDR-HRZAHRDASA-N 478.513 0.457 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(Br)cc1F 1792690573 PCZHDNFQNJIPIE-HBCWATKFSA-N 491.122 0.785 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1793053143 OYFFMSDRUWUPGI-GTYSZEQSSA-N 496.333 0.882 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)n[nH]1 1795689387 DEAFONPJVOAATI-WJNVRWDZSA-N 457.915 0.451 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)n1 1797910540 VRWULYUSWWQTJR-XOIINTDNSA-N 455.353 0.661 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1noc(-c2ccccc2)n1 1799043017 FGJCSYLYSKIYQZ-FEJSZKPUSA-N 484.557 0.632 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c(O)cccc12 1800096081 XTYSXSJMJMPITC-VTEUUUEMSA-N 476.493 0.456 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)cc([N+](=O)[O-])c1 1800662676 XQFLBVKCSCUOOY-BTTYYORXSA-N 454.443 0.865 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)(C1)C2 1800699059 MBKPVBIWAKQIIW-ULCYKIJUSA-N 499.373 0.017 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccccc3[C@@H]1O)C2 1801008877 GCOBGGIQWBTKGU-JIAAILLZSA-N 458.559 0.245 50 20 JCGD Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)o1 1807472011 XKLVHAIQBWLXQU-FOIQADDNSA-N 464.486 0.334 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)n2cnnn2)[C@@H]1c1cccnc1 1808416305 LLUHHDDKIGYGGN-VXUYBBFXSA-N 478.517 0.469 50 20 JCGD CN(C)c1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cn1 1809971433 XJZUVPRMRQEJKU-UHFFFAOYSA-N 450.348 0.986 50 20 JCGD CC(=O)c1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n[nH]1 1813071639 VRLKYROUFYSPDQ-KKSFZXQISA-N 455.519 0.700 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1 1813072862 HHYKSBVAXPENGB-VAIOGVLKSA-N 456.547 0.295 50 20 JCGD O=C(CN1CCSCC1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815347616 GXNWQRDXTLBXFG-HNNXBMFYSA-N 460.390 0.098 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)COc2cccnn2)[nH]n1)c1ccc(B(O)O)cc1 1817475719 RGDHSQRLULMINE-QGZVFWFLSA-N 450.264 0.264 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ncn(C)n2)[nH]n1 1818111407 JSBPQHYNVVRHJH-ZIFAQYRBSA-N 452.479 0.978 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CC(F)(F)C(=O)O)CC2 1819796919 IBXLTMYFNSSKFQ-QMMMGPOBSA-N 468.442 0.477 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)C=CC2=O)n[nH]1 1822528375 KXJZLKPSEXLEAY-IXBOPPFXSA-N 480.485 0.461 50 20 JCGD C[C@H](Br)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1827401675 REVFTEAQXZECSZ-SMDDNHRTSA-N 466.340 0.829 50 20 JCGD Cc1nn(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1F 1830535380 NDHOKTOFTYJMLV-XIKOKIGWSA-N 461.332 0.969 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)C1CC1 1830727761 DEIUKHSNFRLXOS-XFQAVAEZSA-N 475.970 0.346 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2n1 1830731509 KGQRMUHZTYJYBZ-QRWLVFNGSA-N 452.895 0.241 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1cccc(Cl)c1 1830733554 PFBPAHYSXYJDSN-DBXWQHBBSA-N 488.368 0.573 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1832396517 KDOJUNXKIZXWBT-IBGZPJMESA-N 450.366 0.034 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1833712751 AKKVOZBDYIJDGL-UHFFFAOYSA-N 493.468 0.073 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CSc3ccncc3)CC2)CC1)c1cccc(B(O)O)c1 1834800211 ZYAHWCOZQOKTQO-UHFFFAOYSA-N 482.415 0.739 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834800416 GTBVQCPEPVCLDN-DEOSSOPVSA-N 495.385 0.294 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(N2CCC(NC(=O)Cn3ccnn3)CC2)CC1 1834897420 YVLDKPQUKVVRBG-UHFFFAOYSA-N 499.528 0.997 50 20 JCGD Cc1cc2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)[nH]c2cc1C 1835930699 VBKTXXSZXSMPJM-VWLOTQADSA-N 492.341 0.243 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N3CCN(C)CC3)CC2)CC1 1836372899 LAGVRQIPQISHNI-PXNSSMCTSA-N 458.047 0.448 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3ncncc3c1)CCO2 1837028098 ZKZFOIGDRIEALE-HSZRJFAPSA-N 470.530 0.073 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1837669422 URQPYCKNQSCNHO-CLCXKQKWSA-N 462.385 0.779 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1 1838528031 AZWAOHHIULNKCI-ZYRMUBPZSA-N 489.481 0.483 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838727190 SRPHXSWVINBHFV-MRXNPFEDSA-N 470.567 0.920 50 20 JCGD COc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1OC 1838841028 FQRRXLJNGWAGGC-CRAIPNDOSA-N 476.299 0.859 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3CS(C)(=O)=O)C2)C1 1839143540 ZORMHKGUTQKUPR-OXQOHEQNSA-N 473.979 0.714 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839154924 CEQUYOSCCISDOI-NSISKUIASA-N 490.388 0.150 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622549 JUWPAHHPBWULEB-UWJYYQICSA-N 469.970 0.042 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2 1839961548 AXBPJGBDRVGVAD-RVBASHTNSA-N 458.353 0.475 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1 1840035084 FTLRIUIFFKZJEF-FZKQIMNGSA-N 464.357 0.751 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCN3C(=O)OC(C)(C)C)C2)C1 1840149922 BQAUYOOGYRUPCO-QYWGDWMGSA-N 475.970 0.706 50 20 JCGD C[C@@H](Sc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182727 RDIAVRRFQVWLLY-JPYJTQIMSA-N 478.615 0.997 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(Cl)c1 1840734295 FVIMBCSPIGAEOG-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012839 URDFMNQLNXKPFW-MZNJEOGPSA-N 469.347 0.653 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(Cl)cc3nn[nH]c13)C2 1844264707 YPSKSWWMSQUZLU-UHFFFAOYSA-N 454.878 0.741 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCc1cnn(C)c1)C2)NC(=O)NCc1ccccc1 1845038739 NAXKGLSAHNURIJ-UHFFFAOYSA-N 467.574 0.902 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1845274299 SONNIHACTONKHJ-UHFFFAOYSA-N 452.471 0.994 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CSc2ccccc2[N+](=O)[O-])C1 1846302795 GVGGOQKXJGRYQQ-UHFFFAOYSA-N 455.301 0.884 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 1847712216 CIHILLQFLYWMMO-QMMLZNLJSA-N 476.537 0.549 50 20 JCGD CSc1nc(C)c(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c(=O)[nH]1 14326320 JITBOPVUWJQTQC-UHFFFAOYSA-N 453.546 0.444 50 20 JCGD COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2)cc1 15639448 GIEQCXKKUHFGGC-OAHLLOKOSA-N 481.552 0.716 50 20 JCGD COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 23712640 ATYVZTZRAFSLSR-UHFFFAOYSA-N 482.540 0.202 50 20 JCGD O=C(COC(=O)[C@H]1CCCN(C(=O)N2CCCC2)C1)NNC(=O)[C@@H]1COc2ccccc2O1 116786932 PTAKTTGWUZYTOC-YJBOKZPZSA-N 460.487 0.445 50 20 JCGD COc1cc(C(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)ccc1C 725874024 UZNZCZOWUUUVTK-UHFFFAOYSA-N 459.528 0.994 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=S)NCc1ccc(S(N)(=O)=O)cc1 726443689 KDOYFAHRLKMCQN-UHFFFAOYSA-N 470.602 0.245 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(-n3ncc(C#N)c3N)cc2)c1 727241375 ZLCUVCONHHSAAI-UHFFFAOYSA-N 453.484 0.651 50 20 JCGD C[C@@H](CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)S(=O)(=O)c1ccc(F)cc1 729129559 BJOIFFHGIGQHLK-UGSOOPFHSA-N 480.470 0.909 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1 729277013 RCNLPKHCXULHIS-MFKMUULPSA-N 461.338 0.139 50 20 JCGD O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNC(=O)c2cnn[nH]2)cc1 729456423 KHEZRHALYFPYAT-CQSZACIVSA-N 456.488 0.302 50 20 JCGD CC[C@@H](NC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1)c1cccc(S(N)(=O)=O)c1 729612582 FKDIVRVXKDPVQJ-GOSISDBHSA-N 497.599 0.745 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCS(=O)(=O)N2CCSCC2)nc1 730672569 GQROQFATNDYNLS-UHFFFAOYSA-N 480.638 0.117 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)C(=O)NC2CC2)c1 744463571 LPQIZOLQDPUHKE-UHFFFAOYSA-N 461.338 0.519 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)c1csc(N2CCOCC2)n1 749161295 KWXPZTXMFFHNPY-CYBMUJFWSA-N 471.586 0.656 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccc([N+](=O)[O-])n1C)N(S(C)(=O)=O)CC2 761418553 ZQYVEFSTIRLDKB-HNNXBMFYSA-N 495.514 0.661 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(S(=O)(=O)NC)c2)c1 916485842 JCOAINXENPNIJD-UHFFFAOYSA-N 497.599 0.769 50 20 JCGD CCc1ncncc1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 918017193 QNJADAIQLFLLFK-UHFFFAOYSA-N 476.497 0.242 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2cccc(OC)c2O)cc1S(=O)(=O)N1CCOCC1 919757120 ZMRGMEIQQUUZOK-UHFFFAOYSA-N 465.484 0.505 50 20 JCGD O=C(NNC(=O)c1ccccc1CS(=O)(=O)c1ccccc1)N[C@H]1CCS(=O)(=O)C1 1318356201 HABIUEBURKQQES-HNNXBMFYSA-N 451.526 0.792 50 20 JCGD O=C(NCC(F)(F)F)C1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 1338563142 USFQUWWGMNUGQA-UHFFFAOYSA-N 457.457 0.824 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@@]4(CN(C(=O)CCBr)CCO4)C3)c(C)n2n1 1777781479 XBEPPRQXKZVZBA-GOSISDBHSA-N 451.325 0.970 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)no1 1778075262 IDAJBXSPGPPUJD-OPAMFIHVSA-N 478.550 0.199 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1)N1C[C@H]2C[C@@H]2C1 1778863294 ZBLQCZJODNKZPR-XTOGBABISA-N 498.628 0.503 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032487 LKPDUKYAPVDCOA-IZHWHUGBSA-N 498.515 0.086 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cccc(C(F)(F)F)n3)C2)C1 1779509118 UTHBGJRBTOHAQN-HXUWFJFHSA-N 463.221 0.538 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1F 1780110863 QXPJLJMVUOTCFX-DEOSSOPVSA-N 484.289 0.440 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Br)ccc3O)C2)C1 1780561163 WZPFTSIQBZALAS-HXUWFJFHSA-N 483.363 0.971 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1 1781860889 KQNCKHXFBSCTCG-USBNGQNGSA-N 454.293 0.350 50 20 JCGD CC(C)(C)OC(=O)N1CCc2nc[nH]c2[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1782849520 HOVOTTDEHPAXMQ-JLDZCNIISA-N 497.980 0.674 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1783169661 DTSZCJROKHJCLG-IAMHBRQHSA-N 460.959 0.473 50 20 JCGD O=C(CCOc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1783790450 WRIFMSGCEZRMKO-HSQYWUDLSA-N 470.306 0.568 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)nc1Br 1783935447 UIEAWCOPRXORKK-FQEVSTJZSA-N 498.378 0.669 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCBr)C[C@@H]32)nc1 1785708598 SLHFEGSNXSPSQK-NOLJZWGESA-N 474.377 0.863 50 20 JCGD COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1786419210 RXKZCZXXPJQWJZ-VJBMBRPKSA-N 466.343 0.601 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Nc3cccnc3)C[C@@H]21 1787508756 IQGLBUQMNOKUHJ-UIDQRWSASA-N 481.557 0.996 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)[C@H]2C1 1789928923 ARGMXRPURLQYEO-KSWRQPAISA-N 477.986 0.496 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21 1791252857 SQZDDKUNRNLSKC-RPVAFNKOSA-N 468.938 0.226 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1793646000 GSIZJHQIWIFNFL-VPEYGQHGSA-N 459.971 0.965 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1794141915 BPNOMQYXIGWIRK-QEOTZNIISA-N 474.986 0.908 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1794142098 MGDSZWDYSMFNGX-RGHULWKBSA-N 476.958 0.821 50 20 JCGD CC(C)(C)OC(=O)N1Cc2[nH]nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)c2C1 1794522852 POHPKTXRZBBSEA-NOXHYTERSA-N 483.953 0.463 50 20 JCGD CC(=O)c1ccc(OCCCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795737648 GBOIZLJHTPRVBJ-GQEURGSBSA-N 494.353 0.631 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)C2)c1cccc(B(O)O)c1 1795737853 ZXQLHPFZCSNRRZ-UVNIEQTBSA-N 470.281 0.652 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796192420 JIRWQZFKGWVWKY-IYWMVGAKSA-N 469.347 0.535 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCCn1ccnc1C)C2 1796445735 INRSQOXTPJHFPM-MQRYTSQFSA-N 469.546 0.695 50 20 JCGD COc1ccc2c(/C=C/C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)c[nH]c2c1 1797142208 GUPKAGUVYHDCLI-XDKWTVRRSA-N 489.337 0.773 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)ccc1Cl)C2 1797752765 FPFAKXAUYLYVRK-KSPBDQMDSA-N 461.881 0.995 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN(C)C(C)=O)C2 1798522688 MNCKTOSPGNCSGB-VPTLXERWSA-N 476.486 0.592 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)cccc1Cl 1798806943 SDVDXEUSGXWXCS-KSPBDQMDSA-N 461.881 0.995 50 20 JCGD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1803870850 ZHJXFANWQDNDNM-GCJKJVERSA-N 460.299 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CN2CCCCC2)[C@@H]1c1cccnc1 1806887430 QYUNIRCSYJGUCR-GCJKJVERSA-N 465.558 0.886 50 20 JCGD O=C(NCCC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)c1ccc[nH]1 1806975983 XWGQLQIHWKJCBD-UHFFFAOYSA-N 466.347 0.359 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807369324 GPZKQXODAIBXFP-PIPMEXSNSA-N 461.331 0.614 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373936 VHWFBCHQKLMGRY-PBEJRMEISA-N 452.320 0.882 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)[C@@H]2C=CCN2)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1808221287 YIMTYJMNTFRBIB-GPXNEJASSA-N 491.596 0.962 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810295272 RUWSGMZBLHBGEY-GUYCJALGSA-N 481.542 0.607 50 20 JCGD CC(C)NCCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303758 VMFVNMWKNBWWOZ-UWJYYQICSA-N 453.547 0.788 50 20 JCGD Cn1cccc1C(=O)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813474442 DYJYIKBDBKTNFU-WIYYLYMNSA-N 460.299 0.302 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361096 XCQOGSOIPSYOSS-BBRMVZONSA-N 465.344 0.944 50 20 JCGD C[C@H](Br)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCS(=O)(=O)CC2)n[nH]1 1815672282 AVRRFGCUHYXKMF-JSGCOSHPSA-N 476.397 0.916 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1817187342 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CC(=O)N/C(C)=C/C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1831079663 WVUNVCBNNXFART-UPTIQUDWSA-N 456.547 0.958 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832723710 BBNLKOFQHMCPRA-OAQYLSRUSA-N 452.939 0.533 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cncc(N(C)C)c1)CCO2 1833361111 HVNQQWXBOQDKTO-VNSNFZHPSA-N 497.556 0.352 50 20 JCGD Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1C 1833369026 HWUPBPWBTPBVAC-UHFFFAOYSA-N 482.589 0.155 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CC(N)=O)CC2)CC1 1833521326 VHSZLWRQUJCDGA-HIFQEXITSA-N 473.578 0.204 50 20 JCGD CCOc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835931210 IOEZDHBUVOVBFD-DEOSSOPVSA-N 468.315 0.149 50 20 JCGD CCCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835931401 QWZHGNLTURMXJM-VWLOTQADSA-N 466.343 0.703 50 20 JCGD Cc1nc2cccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2s1 1835936891 IEEFHSLMSFNJKC-XMMPIXPASA-N 495.366 0.668 50 20 JCGD Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1837417061 PRJZDSBMABYMJY-UHFFFAOYSA-N 451.332 0.996 50 20 JCGD CCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528414 WCTLFXVVAQABDG-NRFANRHFSA-N 465.459 0.627 50 20 JCGD O=C(c1cc(Cl)cc2nn[nH]c12)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838617822 JFLGDIMWEYSEPW-KDOFPFPSSA-N 458.302 0.281 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)c(F)c1)CCO2 1839011119 LQQGPNJBQPEVMQ-NRFANRHFSA-N 454.474 0.408 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC(=O)Nc3ccc(F)cc3)CCO2)C1 1839030404 MJMXWFQIRQNMGK-LAUBAEHRSA-N 471.913 0.865 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839133290 JBLYMJGTDNZWBW-KNQAVFIVSA-N 465.909 0.973 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1839146743 VCSNHYLLPDSWQS-YWZLYKJASA-N 451.911 0.418 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)C1=O 1839200300 IDNJNNXPQAAAKT-DNVCBOLYSA-N 484.278 0.582 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1839350225 PNYPDRSQTJQUMG-LJQANCHMSA-N 454.321 0.641 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1 1839514418 MURUYXNDYKLOJC-IERDGZPVSA-N 464.906 0.659 50 20 JCGD Cn1ncnc1C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839743298 IMKQPSIBBUUGSQ-AGBQBWRISA-N 472.452 0.770 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CSCC(=O)OC)C2)C1 1839962570 KUATXJRAAZYIEL-DYVFJYSZSA-N 467.382 0.523 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCN3C(=O)OC(C)(C)C)C2)C1 1840149920 BQAUYOOGYRUPCO-GCKMJXCFSA-N 475.970 0.706 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cn4nc(C)sc4n3)C2)C1 1840150732 PSQKRCGQHWYDNU-DNVCBOLYSA-N 471.967 0.352 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1 1840152266 CWLSQNJFHDHUQJ-JQVVWYNYSA-N 451.951 0.411 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1 1840185220 NSAXDSRKAKJCJR-XMMPIXPASA-N 484.557 0.520 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn2[nH]cnc(=O)c12 1840188867 HWXSPIDUTKYPDE-GOSISDBHSA-N 458.302 0.205 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc(C)on3)CCO2)C1 1840367677 FFLKBDAHUWQXKB-OLCUMFGGSA-N 472.502 0.116 50 20 JCGD CN(CCCC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)C(=O)OC(C)(C)C 1843015321 DDUJUWYUCUEYFF-UHFFFAOYSA-N 459.352 0.831 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc3nnc(Br)n3c2)C1 1843126448 LRTHQPHRQJHRJT-UHFFFAOYSA-N 484.119 0.302 50 20 JCGD Cc1c(Br)c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)nn1C 1844264549 GUNNHEHVPCWWSS-UHFFFAOYSA-N 476.335 0.620 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039950 XKYOMKRBDBOLKN-HXUWFJFHSA-N 472.590 0.841 50 20 JCGD CCn1nnc2c1[C@H](C(=O)N1CC[C@H]3[C@@H]1CCN3C(=O)[C@@H](O)CCl)CN(C(=O)OC(C)(C)C)C2 1847556834 QEIMJFIIKZHARV-IWCQGFGOSA-N 496.996 0.934 50 20 JCGD Cc1cccc(C)c1N1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)CC1=O 1848090549 JGPHSBSDJJIZAJ-BVSLBCMMSA-N 475.354 0.852 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1 15639530 BLYWGUUWPKCVRT-IJEWVQPXSA-N 487.600 0.558 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)NCCCN2CCCS2(=O)=O)c2ccccc2c1=O 726276391 DNHWVDNAHXNHLZ-UHFFFAOYSA-N 478.575 0.956 50 20 JCGD CN(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCN(c3ccc(F)cc3)CC2)c1 727761457 GMCJGQIKEGTXGF-UHFFFAOYSA-N 463.535 0.659 50 20 JCGD CCOc1cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)cc(Br)c1OCC(=O)N(C)C 728437489 RUFWHNMHUKACEN-LLVKDONJSA-N 493.380 0.703 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2C[C@H](O)CN2C(=O)c2ccc3c(c2)CCC3)n1 728730841 XVIZRGNCUVDPJL-ZWKOTPCHSA-N 486.550 0.449 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)Cc3cccnc3)CC2)cc1 728892683 CIOFUZPSPHCMAP-UHFFFAOYSA-N 473.555 0.393 50 20 JCGD Cc1cccc(N2C(=O)N[C@@H](CCC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)C2=O)c1 730868092 YUFZWNBLUHBJDU-QFBILLFUSA-N 496.476 0.731 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccccc1F 821719119 QBFAFXWXYADHLR-GPZRYRNASA-N 483.543 0.980 50 20 JCGD O=C(CSCC(=O)N1CCOCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 912643333 VDLBQRQHYOYBTP-UHFFFAOYSA-N 484.600 0.214 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccccc2O)o1 915062354 VEWWIXRILDLSRI-CYBMUJFWSA-N 451.457 0.776 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)cc1 915880779 ZEIUPODDKDUOLQ-GOSISDBHSA-N 494.595 0.947 50 20 JCGD O=C(NCCNC(=O)c1cccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916443467 IHGSHPOLYIRVKF-UHFFFAOYSA-N 460.516 0.240 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCC(=O)N[C@H]1CCS(=O)(=O)C1 916635996 LNICPQPKFXIWPA-YPMHNXCESA-N 491.364 0.240 50 20 JCGD CNC(=O)COc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1OC 919679323 VAKMHILLERUOKO-UHFFFAOYSA-N 469.542 0.793 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)c(C)n2n1 1777784280 FPWKPAFDDNZTHX-RHSMWYFYSA-N 455.288 0.875 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)CC1 1779374614 SLRYJAPHYQCSEK-VGOFRKELSA-N 473.530 0.156 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C=N/O[C@H]2CCCCO2)C1 1779423901 ZHLSFLSBHOJWDE-MRRRHBFGSA-N 488.545 0.342 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779564981 YOXGOZJQCUFWSK-LSRZYVKLSA-N 481.557 0.708 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1780117795 POWUXEWTHJXKOY-HSZRJFAPSA-N 482.302 0.098 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1780286891 KVUHTEOJIXABMW-XMMPIXPASA-N 460.299 0.514 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)C1CC1)C2)NC(=O)NCc1ccccc1 1780558957 NGCBLZPEHLAVDS-CJFMBICVSA-N 485.585 0.826 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)C2 1780708716 AJLQKMXILUJSHJ-XKGFGPFHSA-N 453.971 0.988 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969669 PBWHDFSEZZHHOV-NBGIEHNGSA-N 497.600 0.695 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CCSC(=N)N)CCO2)C1)NC(=O)NCc1ccccc1 1780969986 PRZWJULZZDOTEG-QFIPXVFZSA-N 491.618 0.179 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cnc4ccccc43)C2)C1 1783749494 XYUODJWOUOVABS-HSZRJFAPSA-N 463.498 0.179 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCS(=O)(=O)c3ccccc3)CCO2)C1 1783875262 HCTROMGQKNYQOQ-FXAWDEMLSA-N 458.964 0.934 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@]13C[C@@H]1CN(C(=O)OC(C)(C)C)C3)CCO2 1783937058 NZQQPGPZFGXWRQ-UOKFIYJESA-N 493.605 0.446 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)CCO2 1783940167 UXLJLHHIYDRKAI-QQMNAOGKSA-N 481.594 0.493 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCNC(=O)C3)C2)C1 1784031664 NNEXVXAAIZNIEQ-GXZWQRSESA-N 472.970 0.475 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc(C(F)(F)F)n3)[C@H]2C1 1785282938 NKFWPFOFAXZFGQ-XIRDDKMYSA-N 485.507 0.996 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21)c1ccc(B(O)O)cc1 1786980023 ZLVHHZZBENCOSQ-QSFXBCCZSA-N 453.304 0.140 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508677 NQMKFJOZQGWXCX-PQLHYTCXSA-N 465.576 0.259 50 20 JCGD Cc1cccc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cnccc5C(=O)NN)C[C@@H]43)n[nH]c12 1790478886 POEBNRUDUYREJS-JVPBZIDWSA-N 477.525 0.777 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1791254163 OXNULHLUEFXTDE-NNXHMXCWSA-N 477.986 0.496 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ncc1F)C2)[C@@H](O)CCl 1792978151 GPJZWKAHDWGDIO-NVVZYBJKSA-N 450.692 0.786 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccc(F)cc1F 1793291356 HQDPTEBWVLPXKI-NXCRSVRDSA-N 491.520 0.959 50 20 JCGD CCS(=O)(=O)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793540751 NFRDFCLXFLUCSG-REPLKXPHSA-N 479.603 0.406 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1793875190 WWXKLMBETVHUHW-IFTGGNMHSA-N 457.955 0.645 50 20 JCGD Cc1onc(-c2ccccc2)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1794612189 IXPFXNCOZJXPPL-HATOLVCRSA-N 475.310 0.847 50 20 JCGD COc1ccc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1 1795740616 DMKGSPUWRSHLEZ-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]c3c1CS(=O)(=O)C3)C2 1796892206 NJYJJVLFORWJML-BQELMUNXSA-N 487.542 0.224 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(S(C)(=O)=O)CC1 1797141053 UDVMBIFUEKXALJ-KRXQYRFLSA-N 470.419 0.484 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C\C(=O)NC1CC1)C2 1798524925 QMYSKPHFEFZOBH-ZVDPXCMSSA-N 486.481 0.558 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2 1799816106 NNCCIESKVNFQIP-DQEVTTJGSA-N 461.538 0.955 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ncccc13)C2 1801014333 MLPFTIAZCDQTTH-FAQVEIGNSA-N 456.547 0.458 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn1 1803139442 PIJXIIQKMDBWTQ-LZQZEXGQSA-N 480.974 0.941 50 20 JCGD CN1N=C(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCC1=O 1804121595 HLRNQVQEDOCAQE-FOIQADDNSA-N 478.513 0.008 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=N)N)[C@H]1c1cccnc1 1804240303 XVALLRFNMVGIRZ-ZOBUZTSGSA-N 481.985 0.703 50 20 JCGD Cn1c(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cccc1=O 1807369171 BZHZCSCXMQPHCP-GCJKJVERSA-N 460.299 0.094 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ncc(Cl)cn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369439 JWYSBGWLIOMADO-LPHOPBHVSA-N 465.706 0.838 50 20 JCGD O=C1Cc2cccc(C(=O)N3CC[C@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)c2N1 1807373504 SGZBWSZKHSKLNT-NTKDMRAZSA-N 484.321 0.889 50 20 JCGD O=C(/C=N/N1CCCCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810284565 PUUBAOUCHYLKSS-XWOGAGCYSA-N 463.347 0.553 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810302484 KMZSSMVZNQUBOI-YLJYHZDGSA-N 478.557 0.682 50 20 JCGD O=C(CCBr)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1 1810491191 CYDKKGLYVOCHRL-UHFFFAOYSA-N 452.313 0.442 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1 1810800283 RVEDCGCEFQUMBJ-AUUYWEPGSA-N 490.480 0.202 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1813419663 QUULGFRSYKHPRC-FDDCHVKYSA-N 490.568 0.993 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCOCC3)sc2C1 1814564457 MJOBMSUWOLXWPB-WOLHVBPDSA-N 473.559 0.521 50 20 JCGD COCCOCCOCCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348855 ZFEOMTGAPAGRCN-KRWDZBQOSA-N 491.375 0.118 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@H]1CC[C@H]2CCC(=O)N2C1 1820758276 HNNXTFCOWQZWSE-QRFRQXIXSA-N 479.346 0.796 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ccccc3n(C)c1=O)CC2 1826085908 FUXDJZMOHHRQNZ-ZDUSSCGKSA-N 497.581 0.989 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)CC1 1826804258 IPWGTYCJTTXLFQ-WORIPGKHSA-N 496.505 0.465 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826806138 MJZQSHFKWHUTJX-CJNGLKHVSA-N 466.328 0.911 50 20 JCGD O=C(CN1CCSCC1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055933 OGTWRXGMFINMJA-NRFANRHFSA-N 459.421 0.649 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)nc(O)n2)CC1 1827599474 LYRSAFVCWSMUSY-SFHVURJKSA-N 454.292 0.115 50 20 JCGD CN(C)CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828854591 SAVSGNDRWUGEFK-PGRDOPGGSA-N 466.966 0.600 50 20 JCGD COC(=O)C1(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1 1828924371 PLCXITZHAQSLJK-GOSISDBHSA-N 457.531 0.872 50 20 JCGD C[C@@H](Br)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(O)O)C2)C1 1829330647 NFPJEMYJRRLNRI-VLIAUNLRSA-N 484.347 0.533 50 20 JCGD C[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCN2C(=O)OCc2ccccc2)C1 1829355692 DSCKRNBBXKLRQI-UUOWRZLLSA-N 489.573 0.192 50 20 JCGD CCc1nn(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1Br 1830723447 NUKMRRCJXKGHBQ-SCLBCKFNSA-N 493.786 0.415 50 20 JCGD Cn1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1C(F)(F)F 1830728338 RREPNSHPFZGNJL-BDJLRTHQSA-N 454.833 0.109 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833313683 NAABFZBFXAWZNZ-ROUUACIJSA-N 491.029 0.433 50 20 JCGD Cc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835736675 ACLBQDWVXPGDPF-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1 1835845803 WBILNHUZBIYOOV-SUMWQHHRSA-N 461.401 0.493 50 20 JCGD Cc1ccc([C@@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1835940146 WLXFQEVOBCXMOD-CLOONOSVSA-N 466.343 0.549 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1Cl)CCO2 1837781032 RFMQYELCGADIKA-FQEVSTJZSA-N 453.927 0.178 50 20 JCGD CCN(CC)C[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921434 JLWMOJSBLCZGFM-IBGZPJMESA-N 473.423 0.957 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@]3(F)Cl)CC2)CC1 1837922155 RNNWQANWSWXIOU-GHTZIAJQSA-N 452.719 0.903 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3cc(CO)on3)CC2)CC1 1838103196 NYKDCSGAHTZUOV-MFKUBSTISA-N 486.529 0.913 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(C(=O)OC)s3)CCO2)C1 1839035257 GNDIZKIAHGYRQM-FOIQADDNSA-N 474.963 0.787 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1839150535 OSXRZFDVXQLUEA-WOJBJXKFSA-N 473.357 0.504 50 20 JCGD COc1cc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(F)c1 1839332902 CKEOWYDSDQWJLY-QHCPKHFHSA-N 490.268 0.037 50 20 JCGD O=C([C@H](F)Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2 1839636711 PGJQQNSERFEAPY-UWVAXJGDSA-N 483.338 0.900 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1C 1840643642 WNTOAQFPJBFCPK-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD Cc1ccc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1840664974 GLBDNMKEGIPBJZ-XMMPIXPASA-N 467.526 0.686 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2 1846383942 LITBLXRKWGWJQG-UHFFFAOYSA-N 469.542 0.178 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1847078554 SHJHGOBIKOTPLI-YTQUADARSA-N 469.347 0.581 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](NS(=O)(=O)c2ccc(C)c(C)c2)[C@@H](C)O)cc1 9084216 DMXPDTMQHZDKLY-UZLBHIALSA-N 477.539 0.644 50 20 JCGD O=C(COC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F)NNC(=O)c1ccccc1 10149349 VRCDJOMEMQNQDH-UHFFFAOYSA-N 465.459 0.465 50 20 JCGD CSc1nc(C)c(CCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c(=O)[nH]1 14369288 FBFMBDOHLAEVSW-UHFFFAOYSA-N 452.562 0.796 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N1CCCCCC1 15639516 BBJLMJGQAPFBSH-OAHLLOKOSA-N 473.573 0.456 50 20 JCGD CS(=O)(=O)N1CCc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc21 27229608 FBKFSITUFZEQCS-UHFFFAOYSA-N 492.579 0.868 50 20 JCGD Cc1ccccc1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1 109108803 QDFBZGFNDKIQSF-UHFFFAOYSA-N 488.566 0.927 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)CCNS(=O)(=O)c2cccnc2)c1 728527435 IVBVEIWYMUQNPT-UHFFFAOYSA-N 457.306 0.982 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCc1cocn1)N(S(C)(=O)=O)CC2 730911709 NJNZKDDQOKCUQK-HNNXBMFYSA-N 467.504 0.471 50 20 JCGD COC[C@@H](C)n1c(SCC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)nnc1-c1ccccc1 751063931 UZGISTQKRAAKJT-UKRRQHHQSA-N 467.573 0.827 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2OC)cc1 825542783 ZXVKOTGSCPQOIT-UHFFFAOYSA-N 478.527 0.598 50 20 JCGD O=C(NNC(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1)c1csc(N2CCOCC2)n1 920049825 QKRQDDDVVCBTIB-UHFFFAOYSA-N 494.599 0.731 50 20 JCGD Cc1ccn2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)c2c1 1777943264 ZGIKTUJAUDIWAO-RCZVLFRGSA-N 476.342 0.764 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Cl)C1 1778022076 COMBPPPZKDDYKW-SSHHRWTQSA-N 451.923 0.920 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cncc(C(F)(F)F)c3)C2)C1 1779746716 AJNKUCCQULZIDG-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)ccn1 1780967906 CHTVPIHYMDCQLO-RUZDIDTESA-N 496.568 0.880 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)n2)CCCN1 1781328299 NBUSBQQIGNVGHD-FXAWDEMLSA-N 498.353 0.542 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCS2(=O)=O)C1 1781652744 JZHLUHHZEYQQKX-VYXVWEACSA-N 493.586 0.212 50 20 JCGD COc1c(C)cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1C 1781871647 BMOBYPJPOSYPJH-DEOSSOPVSA-N 452.316 0.749 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccnc1C(N)=O)C2 1781903199 OXSGBEOIORUETJ-XEKQOVJPSA-N 468.352 0.877 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1CCc2ccccc2O1 1782149250 HLFGKWYEOMEFLZ-PPJWLVRDSA-N 478.354 0.888 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncn(-c3ccccc3)n1)CCO2 1783935439 TYVHCITVTJQLSW-JOCHJYFZSA-N 455.519 0.084 50 20 JCGD COC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1784255115 XLEUFUSRPFLUNT-DJJJIMSYSA-N 462.931 0.304 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2)CC1 1785238174 PWQVRSZTWKOSRF-NFBKMPQASA-N 464.994 0.872 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc(C)c(C)nc3O)[C@H]2C1 1785575209 ATXBEGRBRAXNKC-UHFARAQSSA-N 483.529 0.526 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)c1ccccc1 1786982648 BHEQUXPPSXBAHW-JKLQHZFJSA-N 495.341 0.057 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c(O)c1 1788611031 IRWKSLWBMDGKDE-DCPHZVHLSA-N 453.499 0.606 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cnc3Cl)[C@H]2C1 1788849382 OVZCWSQBAYXCMZ-RCBQFDQVSA-N 455.918 0.840 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ccn3)[C@H]2C1 1788850002 UVUUJVRBRGGPFZ-IWEFOYFVSA-N 458.906 0.641 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C#N)c[nH]3)[C@H]2C1)NC(=O)NCc1ccccc1 1789345099 ORXRTXKPIZVRED-ONTIZHBOSA-N 493.568 0.826 50 20 JCGD Cc1ncoc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724715 MFNWAWZKMARTBJ-UFYCRDLUSA-N 484.557 0.923 50 20 JCGD O=C(Cc1cccc(F)c1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790982902 JOVLYXWNPKJCBL-QRFRQXIXSA-N 458.270 0.481 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)cc(F)c3)C[C@@H]21 1791289171 MDKVPFUINNKESL-SNRMKQJTSA-N 452.502 0.860 50 20 JCGD Cc1ccc(OCCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1792711483 YKZKWDFLDHBNEF-FAQVEIGNSA-N 467.526 0.666 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)C1 1792918915 DYROWWCHWIXVDM-REPLKXPHSA-N 485.585 0.778 50 20 JCGD O=C(CCc1cnccc1C(F)(F)F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793969129 GKASHVZLOUIOJR-UPHUGPLXSA-N 491.275 0.616 50 20 JCGD O=C(CCc1nc(-c2ccc(F)cc2)no1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1794043672 AZBPUFGDLLRWCC-MVWRLGRASA-N 466.897 0.998 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736857 OJTUPUZCADXKCR-HCBXPFHNSA-N 454.307 0.588 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccccc1=O 1795772893 JJGAJVAYSFYNEJ-RCJHGTSTSA-N 482.965 0.570 50 20 JCGD COc1ccccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796443787 KHUYHHUJTRMMIQ-RRCBXWCQSA-N 467.526 0.961 50 20 JCGD CN1CCc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)ccc21 1797018356 UJGQDWIEDKHWGZ-UPHUGPLXSA-N 464.526 0.194 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O 1797686181 IQFZBFWBUORWDE-XCDZQEORSA-N 495.621 0.616 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754087 SVZHEKJGEMKCIN-USGNIVHTSA-N 487.944 0.793 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21 1800737710 SWACFHSUSZRENA-QYLSFZBMSA-N 471.982 0.943 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C1(O)CCC1 1802465461 JPJLVQFYAXETGB-OXFYSEKESA-N 466.542 0.951 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnc(N)s2)[C@@H]1c1cccnc1 1807275436 YVXKTSKYRKTRME-GUYCJALGSA-N 466.527 0.752 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1 1807363626 MZPSJYPJIQBMMK-DYESRHJHSA-N 465.344 0.484 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807364091 HRAABMHWJQHVFP-AVRDEDQJSA-N 467.331 0.813 50 20 JCGD C[C@H](NC=O)C(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1807453069 NBCNGSSNOFELDW-HARLFGEKSA-N 495.584 0.568 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807950559 UVEVRTOFOCYFHZ-NVBFEUDRSA-N 475.307 0.311 50 20 JCGD COCCn1nccc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1808639870 TTZATMPQYUNOMQ-AVRDEDQJSA-N 471.562 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCOC2=O)n[nH]1 1815027418 XLVBZVUKNRWSSA-HNNXBMFYSA-N 456.463 0.166 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817480014 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NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3nc4ccccn4n3)CC2)CC1 1834969440 MMBSGBHRQJSKGZ-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1835117835 ORBDIQWMSFZLOO-RWPZCVJISA-N 497.556 0.812 50 20 JCGD CC(C)n1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835736750 GPZGQBIZNOUYNW-UHFFFAOYSA-N 483.577 0.357 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835833544 PGOPLMONORDNIH-UHFFFAOYSA-N 461.444 0.403 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3scnc3C(F)(F)F)C2)C1 1835935270 LPNLNIAQQONOJD-LJQANCHMSA-N 499.276 0.226 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836130931 VWHQUWVFXCHHPC-FZKQIMNGSA-N 458.309 0.249 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1836399893 PWLTZKZQOJDJDN-QUCCMNQESA-N 465.422 0.445 50 20 JCGD Cn1cc(CCC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1837919433 RHEKKCVHHNOHMF-UHFFFAOYSA-N 468.363 0.345 50 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1840154009 HZXVAZNSXNMQGX-AVRDEDQJSA-N 484.933 0.160 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1 1840184950 HYUYUCOWZYRKBW-YKSBVNFPSA-N 474.558 0.210 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CS[C@@H]3CCCCO3)C2)C1 1840185308 JXFFVFIKSPHMQW-NHCUHLMSSA-N 472.608 0.076 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1840314147 TXMDZPIARIEWOU-SIKLNZKXSA-N 453.967 0.741 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1840730189 XPEANENKERDEOC-DEOSSOPVSA-N 496.524 0.027 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CN2CCS(=O)(=O)CC2)C1 1841894227 CATLKIQFDBFNLS-UHFFFAOYSA-N 494.526 0.068 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ncn(-c3cccc(F)c3)n1)C2 1844263671 GUZWWYJAFUAUQP-UHFFFAOYSA-N 464.461 0.536 50 20 JCGD C[C@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)[S@](=O)c1ccccc1 1844264979 GBTBUCJZWYVLGG-YPSMLTEGSA-N 455.540 0.698 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)[C@@H](C)Oc2ccc(F)cc2)c1 15764884 GEQAYTGKEJTMGW-CQSZACIVSA-N 468.507 0.633 50 20 JCGD O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 15795316 VRELFVKTNNLTHP-QGZVFWFLSA-N 465.459 0.448 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728329809 IEKFTPHNFHLTSW-WMLDXEAASA-N 469.516 0.111 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1)C1CCN(c2ncccn2)CC1 728846480 NYLCEOXKRCPWPA-OAHLLOKOSA-N 464.573 0.755 50 20 JCGD Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 729276194 YTXVXOHSRYHFEB-CQSZACIVSA-N 468.557 0.172 50 20 JCGD Cc1ncsc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc3c(c2)NC(=O)CO3)CC1 731362561 GAUCPLAIPZJELD-UHFFFAOYSA-N 480.528 0.143 50 20 JCGD Cc1cc(/C=C(/C#N)C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(C)n1C[C@H]1CCCO1 786389803 GXAIUGXBOBQRIM-VHEJECIDSA-N 469.498 0.597 50 20 JCGD Cc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)cc1 844154042 RPWVWFHKPNCUDN-PXNSSMCTSA-N 467.478 0.874 50 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JNMSQXXLOFMRBR-ZJSXRUAMSA-N 452.316 0.816 50 20 JCGD N#Cc1ccc2[nH]nc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)c2c1 1781204639 HZOXYGJOBRAQPM-PXDATVDWSA-N 487.325 0.556 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccc(O)cc1 1781261065 FTAOZUJVQXNISW-WNSKOXEYSA-N 453.499 0.638 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)c(F)cc3F)C2)C1 1781584663 KACVQOPTBOJBIA-OAQYLSRUSA-N 463.416 0.860 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1 1781860886 KQNCKHXFBSCTCG-LYOVBCGYSA-N 454.293 0.350 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)CCO2 1783539578 LZSFBHFOVFRVOP-PNHOKKKMSA-N 490.395 0.972 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783939547 ICGRYKWMAARRPL-JOCHJYFZSA-N 450.511 0.580 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1 1785338797 QWSDPQSSDPCKJY-OAQYLSRUSA-N 455.556 0.104 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cc(F)ccc4[nH]3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979704 MRRJBXNIBCZXOK-OHEPNIRZSA-N 465.290 0.894 50 20 JCGD Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(C(F)(F)F)c1 1786979967 UWMPPGJBBCXRGR-QOKNQOGYSA-N 479.264 0.631 50 20 JCGD COc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1OC 1786985288 ZLHKQPJNTSRQEK-KNBMTAEXSA-N 486.305 0.430 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)C1 1789812860 VQHQLGGFZBRDAM-IATJYDTKSA-N 463.934 0.728 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1792243065 DSKPTNRUHGQOHB-LDLMYSLFSA-N 479.298 0.581 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)C(=O)OC(C)(C)C 1795342042 WNWUGEYCPDUWEG-LLJCUJCISA-N 490.561 0.577 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1ccco1 1796285105 HZWZZRCMTIRPGM-MVRRYPJTSA-N 454.487 0.782 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1nnc(C)s1)C2 1796440550 QFTJHDCXYAGZKQ-FKBANKNKSA-N 459.532 0.113 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cnccc2c1 1796978558 GDNSYRGXFLDJRC-RMFSNUHRSA-N 460.494 0.750 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(=O)OCCO)C2 1800760082 AUBPDKKPCYEPGB-VWPFQQQWSA-N 469.332 0.822 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1[C@H]3CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C3)C2 1801422001 KDNOQPUHTLGQFW-JBXGNFEISA-N 452.939 0.860 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@]12C(=O)Nc1ccccc12)c1ccc(B(O)O)cc1 1801927270 HFXXPDCRUQYOMH-SDMFYXEBSA-N 459.311 0.528 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2csnn2)[C@H]1c1cccnc1 1803749613 DQKQWFCCCSCXJC-SUMWQHHRSA-N 452.500 0.565 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1 1806637831 TZQBBBYAJRBKOT-IHJYDIMASA-N 465.514 0.500 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C#CC2(O)CCCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361146 PALCMYNIBUYETK-ZJSXRUAMSA-N 475.354 0.780 50 20 JCGD O=C(CNC(=O)c1ccco1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807587879 LCPZOTILZRNHIH-PGRDOPGGSA-N 476.298 0.104 50 20 JCGD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc(O)n1 1808334530 XUVUZVWFISIUTB-XMSQKQJNSA-N 460.299 0.804 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808417546 LQDANMVIBQZPCX-NPWMIDDZSA-N 479.541 0.912 50 20 JCGD Cc1cc2nnc(C(=O)NC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)c(C)n2n1 1809184354 AJTKFVJQDONJNA-WMZHIEFXSA-N 499.340 0.449 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3cccc(N4CCOCC4)n3)CC2)C1 1809978403 SGTLRCANGLBXNY-UHFFFAOYSA-N 492.385 0.757 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809979759 APNRFLLPQXMWLL-SFTDATJTSA-N 468.359 0.967 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnn3ccncc23)[C@H]1c1cccnc1 1810303345 QSIPRVMAWJXFFG-IERDGZPVSA-N 485.508 0.756 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)ccn1 1810839638 YEBXWRFACZEKIF-DENIHFKCSA-N 460.299 0.798 50 20 JCGD Cn1cc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1813456578 DZZUMURNMRKLKE-UWJYYQICSA-N 462.514 0.376 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1815167832 JWXZYXLQZCIWOD-DZGCQCFKSA-N 471.584 0.103 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccnc(Cl)n1)CC2)c1ccc(B(O)O)cc1 1815344419 YSVZZNMYNDRCPC-LBPRGKRZSA-N 457.708 0.806 50 20 JCGD COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nn1C 1815360257 DCFCDVQHVLYPSJ-ZDUSSCGKSA-N 455.305 0.105 50 20 JCGD CC(=O)N1CCN(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)[C@H](F)Br)CC3)CC1 1818896908 MLYDPJCEYOHEHQ-NHYWBVRUSA-N 476.372 0.910 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc[n+]([O-])c2)[nH]n1 1819401740 QIPQGLQITHLNCJ-QGZVFWFLSA-N 450.459 0.661 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ccc(F)cn3n1)CC2 1826090174 YJODXYBQFCZVQJ-GFCCVEGCSA-N 474.522 0.924 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)[C@H]1SC(=N)NC1=O 1827052905 NNNGFEVTURHXLI-ZOCIIQOWSA-N 486.403 0.402 50 20 JCGD O=C(CSc1nc[nH]n1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060554 PSTLFYWZNULYTF-SFHVURJKSA-N 457.365 0.510 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525534 SFMWMTGDYIFXET-HRAATJIYSA-N 453.923 0.767 50 20 JCGD O=C(O)C#CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551533 QOJVRXWKVWRMGL-JTSKRJEESA-N 477.901 0.126 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)N3CCN(C)CC3)C2)C1 1830543294 PESGKAXPRGYEGW-SQGPQFPESA-N 475.428 0.110 50 20 JCGD O=C(COC1CCCCC1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833217316 VMTJYTJUNDWDOD-UHFFFAOYSA-N 471.407 0.901 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1833265451 WUCDELWDWNUNOE-DOMZBBRYSA-N 472.384 0.187 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@@H]1CCc2ccoc2C1 1833364957 NUHZDNYVGNKGDL-HXUWFJFHSA-N 479.386 0.950 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccnc(F)c3)CC2)CC1 1833588855 AMRATFMGVARWBB-UHFFFAOYSA-N 469.521 0.718 50 20 JCGD O=C(c1ccnc(C(F)(F)F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833792325 SHQKSEIVOQJGCA-GUYCJALGSA-N 451.829 0.770 50 20 JCGD CCn1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834801118 PUAZLSRHPKZGIH-UHFFFAOYSA-N 453.352 0.082 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CC2)CC1)[C@H](F)Cl 1835079651 LFVYYNKLUGVYGZ-INIZCTEOSA-N 461.947 0.558 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1C 1835207459 OHPFJVWKBGTNME-UHFFFAOYSA-N 452.364 0.512 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)o1 1835736391 BXEWMPDSLSZYJQ-UHFFFAOYSA-N 476.578 0.796 50 20 JCGD CC[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)N(CC)CC 1835737217 XFLUCKAHFHYKRR-JOCHJYFZSA-N 487.649 0.991 50 20 JCGD O=C(/C=C/c1ccsc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927180 KECJREJIJHKILZ-XCVUWMKJSA-N 456.329 0.211 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cc(C)cnc34)CCO2)C1 1836950201 QDPDIUKKGJAISW-JXFKEZNVSA-N 451.911 0.362 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1c[nH]c3cccc(Cl)c13)CCO2 1837180978 ZTULGDNUKXIDIA-XMMPIXPASA-N 497.744 0.885 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1 1837459547 JLNWATMKOQBVML-JOCHJYFZSA-N 475.452 0.347 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccc(O)c3)C2)C1 1837460523 HCBCQJDYFLUONV-XMMPIXPASA-N 483.525 0.094 50 20 JCGD Cn1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c2c1CCC2 1837713359 YXUPRTGBENFUFN-OAQYLSRUSA-N 450.612 0.830 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3ccnn3)CC2)CC1 1838103201 OHRVAXIYYSIAMG-GNYKCMPYSA-N 484.561 0.972 50 20 JCGD Cc1nnsc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838137009 CHMPVJBGBLUDRC-UHFFFAOYSA-N 473.559 0.771 50 20 JCGD C[C@@H]1CC[C@H](C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)O1 1838276460 OVMUXFMLZPUPPC-FOIQADDNSA-N 459.547 0.865 50 20 JCGD CC(C)c1nc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)no1 1839199168 RTASWRRLOXSIBL-PBHICJAKSA-N 463.304 0.882 50 20 JCGD O=C(c1ccc2nn[nH]c2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839203056 YIDNOFWAVSJPIB-RHSMWYFYSA-N 456.272 0.718 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1 1840031148 GVKNRRPMDFSCOQ-YJYMSZOUSA-N 469.336 0.893 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1840031615 XCZYGDPPJCWDAG-SCLBCKFNSA-N 490.376 0.339 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3O1)CCO2 1840137625 LUCRDTPCBFOQNF-OFVILXPXSA-N 495.536 0.149 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)s1 1840183422 DKCLGDFSEHOOTJ-FQEVSTJZSA-N 454.549 0.200 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccncc34)C2)C1 1840184867 DJLIJWAQKVXPAR-XMMPIXPASA-N 469.542 0.678 50 20 JCGD CN1CCN(CCC(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)CC1 1845038733 MJKZUALSMYAKQG-UHFFFAOYSA-N 485.633 0.174 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1CCCS1(=O)=O)C2)NC(=O)NCc1ccccc1 1845039367 INBIVGSEMZXEMU-SFHVURJKSA-N 477.587 0.113 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847565413 PMHXOLPDSWIURT-AJNGGQMLSA-N 461.943 0.634 50 20 JCGD COc1ccc(S(=O)(=O)N2CCc3ccccc32)cc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 16785862 GSSIYKNUGJQGTI-OAHLLOKOSA-N 493.563 0.642 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc2c(c1)COC2)NNC(=O)c1cccc(Cl)c1 726669669 ARYZJFPWTKIRBQ-UHFFFAOYSA-N 467.887 0.653 50 20 JCGD CN(C)N(C(=O)CCNS(=O)(=O)c1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1 728180815 YOJBJZBIXLVZJH-CYBMUJFWSA-N 468.395 0.610 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)NCc2cccnc2N2CCC(C(N)=O)CC2)cc1 729611817 TXQJNRNQLMEGDO-UHFFFAOYSA-N 451.487 0.564 50 20 JCGD O=C(Cc1csc(-c2nc[nH]n2)n1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 729856045 JTSWLAYNNQSPNF-UHFFFAOYSA-N 461.529 0.716 50 20 JCGD CC1CCC(N2C[C@@H](C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)CC2=O)CC1 731322658 MHQHJFHEDXYTER-AVAKVYKDSA-N 492.598 0.896 50 20 JCGD O=C(NCc1noc(-c2cccs2)n1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 745281386 NYAKSPDHORPRMV-UHFFFAOYSA-N 492.539 0.963 50 20 JCGD O=C(Cc1cccc(F)c1)NCCNC(=O)NNC(=O)c1csc(N2CCOCC2)n1 748826192 YNNGTYXCLNJHMP-UHFFFAOYSA-N 450.496 0.422 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2c[nH]c3ncccc23)CC1 918775799 CFECXZYPXITGHG-UHFFFAOYSA-N 482.526 0.880 50 20 JCGD O=C(CCNC(=O)c1cc(F)ccc1Br)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919885745 NKAZUXVGJBMVSS-JTQLQIEISA-N 465.301 0.226 50 20 JCGD CN(CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)Cc1ccccc1 1115910733 CYFIJHJTAWWCMH-UHFFFAOYSA-N 474.583 0.920 50 20 JCGD Cn1c(=O)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)nc2ccccc21 1778623826 PGNIEPHMOQHDHZ-DRSNIGMVSA-N 462.934 0.661 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(F)c(F)cc3F)CCO2)C1 1779037307 VIPCTOYMSTVHHX-OAQYLSRUSA-N 463.416 0.860 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CS(C)(=O)=O)C2 1780054450 LNXZMTCTGVPAKY-WIYYLYMNSA-N 497.526 0.692 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1C[C@@H](O)C1)C2)NC(=O)NCc1ccccc1 1780559266 HLQBXJOCKAHZDN-FBROZUCGSA-N 487.601 0.617 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969879 PXMXIRNOCNQCLA-DEOSSOPVSA-N 488.589 0.077 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1N(C)C 1781127668 CKZOGANTSUIGLJ-XMMPIXPASA-N 482.541 0.517 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccc(O)cn2)C1 1782633700 RKOGQYSZAYJDTP-AUSIDOKSSA-N 468.514 0.156 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1785609123 PHBLJIOPLNHAEZ-NQCMUKECSA-N 491.383 0.368 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn4cccnc34)C[C@@H]21 1787508705 PKEXPMFWVMSIDR-VOVAKLSQSA-N 478.513 0.457 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1 1788766005 JNUGQTKPUPFOFE-KANFNMMFSA-N 465.627 0.288 50 20 JCGD COC(=O)NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1 1789221909 PRMWGNAFUVBMKO-OWQGQXMQSA-N 478.458 0.469 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)C1CN(C(=O)OCc2ccccc2)C1 1790784796 ZQSUYEIIKQZYJH-FFGOWVMKSA-N 479.961 0.834 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(Cc4ccccc4)c3)C[C@@H]21 1791291559 YXXVXWPAADLXHU-BVSLBCMMSA-N 482.585 0.898 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1C 1793652729 VWGDCVJVKBQSOX-BBIADKPPSA-N 452.316 0.129 50 20 JCGD CN1CCN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CN(C)NC(=O)NCc2ccccc2)CC1 1799871656 SPSUWLQFJBMVSD-KOUNCHBCSA-N 485.633 0.218 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(Cc3cccs3)C1)C2 1800973800 HFMSKSNOVLJXQB-DHBZOUTCSA-N 469.991 0.940 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(F)ccc1[N+](=O)[O-] 1802094635 HRWOXZDUBRHSHX-USGNIVHTSA-N 465.482 0.239 50 20 JCGD COc1nccnc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1804982392 XPKWYNUQKXWBSA-UZLBHIALSA-N 455.519 0.573 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363851 PUHUMDUSFYPNJS-PGRDOPGGSA-N 488.309 0.561 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CNC(=O)c2cccs2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364723 TYXMGNZZYWHKRS-PGRDOPGGSA-N 492.366 0.573 50 20 JCGD CN(CC(=O)N1CCC2(CCCN(C(=O)CS(C)(=O)=O)C2)CC1)NC(=O)NCc1ccccc1 1809423043 STLCZYPBMLUCRB-UHFFFAOYSA-N 493.630 0.608 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809979752 APNRFLLPQXMWLL-LEWJYISDSA-N 468.359 0.967 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)O)[C@H]1c1cccnc1 1810305273 JVHOVHMCXNZQCS-LIRRHRJNSA-N 472.527 0.218 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1 1810306058 SERROAMPOHOLMU-KBXCAEBGSA-N 481.542 0.310 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CCC(N)=O)[C@H]1c1cccnc1 1812627650 OXHLMNGJYVGXDF-IEAFUIEISA-N 453.503 0.487 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350010 DGHIBNSGBBDHAJ-WFASDCNBSA-N 488.375 0.962 50 20 JCGD CC1CCN(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1 1815350522 WWTVOFXDWUUPNP-QGZVFWFLSA-N 456.377 0.781 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)CC2)c1cccc(B(O)O)c1 1815360088 LVAPEQPFVISHTA-AWEZNQCLSA-N 482.283 0.976 50 20 JCGD CN(C)c1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1 1815360159 ANDUKUAVHXZUKM-INIZCTEOSA-N 465.344 0.824 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3c1OCCC3)CC2)c1cccc(B(O)O)c1 1815360646 WELTWDCTQJOOTM-CQSZACIVSA-N 467.316 0.342 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])[nH]n1)c1ccc(B(O)O)cc1 1817471572 IRXCPSCMUBWPOH-AWEZNQCLSA-N 453.224 0.341 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CSc2ncccn2)[nH]n1)c1cccc(B(O)O)c1 1817475545 SJRDPZLULUPCKV-QGZVFWFLSA-N 466.332 0.978 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1819715130 UAEULQQHJDRSDG-BZNIZROVSA-N 458.544 0.941 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccncc1O)CC2 1819798135 YQHHSVMKJZHKHJ-JTQLQIEISA-N 453.484 0.782 50 20 JCGD COc1ccnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1 1820507941 FWYSASKKSMWTPR-AWEZNQCLSA-N 452.301 0.766 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2)c1ccc(-n2c(O)nnc2O)cc1 1821418319 OSMAHKPNBSCDSV-GXFFZTMASA-N 478.918 0.961 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(C)C(=O)C(=O)O)n[nH]1 1821712672 DSJIISIUILMYJU-PWSUYJOCSA-N 458.313 0.976 50 20 JCGD C[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1 1822184881 QJGUZXMZZMKEBM-OCCSQVGLSA-N 476.397 0.916 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCC(=O)NC2)CC1 1823836748 GHJQOMRTTVDEBF-VQIMIIECSA-N 456.547 0.445 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4nn[nH]c4c3)sc2C1 1824412106 NTYFPYCVGGJDNN-LLVKDONJSA-N 477.510 0.953 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](N)Cc1cccnc1)CC2 1826085743 AMXTZJOIQBKLNN-CABCVRRESA-N 459.576 0.393 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)CC1 1827537055 WTYMDMGOXWFPNO-FQEVSTJZSA-N 477.330 0.662 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1 1829627292 WOGVGZSOFPSWGD-XLIONFOSSA-N 455.895 0.848 50 20 JCGD CC(C)N(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)C(=O)OC(C)(C)C 1829977963 HEOQSJUPFWWEKN-KKSFZXQISA-N 477.986 0.688 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2n1 1830736030 PWWWNSPENZLTOU-UTKZUKDTSA-N 450.923 0.621 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2)CC1 1830739200 ZZEMRJWAVJYLHM-QPPBQGQZSA-N 495.020 0.498 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCc3ccoc3)CC2)CC1)c1ccc(B(O)O)cc1 1834800383 FQNVIVJAJCBMME-UHFFFAOYSA-N 453.348 0.777 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c(O)c1 1834801506 QDJHBBIDSUNFRA-UHFFFAOYSA-N 465.359 0.879 50 20 JCGD Cc1ccc(NCCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(C)c1 1835930675 UFCVQEGFWRFRTQ-SANMLTNESA-N 495.385 0.555 50 20 JCGD O=C(/C=C/C1CCCCC1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931655 WBTBUSUBHXSENE-KPZSNFNVSA-N 456.348 0.573 50 20 JCGD Cc1ccc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1835933566 BZVLIWNYWFOYDB-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3n(n1)CCCC3)CCO2 1836976355 LOKBVVKLUWRKGJ-MSIOFZDNSA-N 497.556 0.423 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCCC3(F)F)C2)C1 1837456194 KRXXTMLUOXKGKC-UWJYYQICSA-N 481.500 0.581 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1 1838421561 CCUQOEVWCSZQDN-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)N1CCN(C)CC1)CCO2 1839104558 GQCYLLHHXNRRIK-FUHIMQAGSA-N 475.428 0.252 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199791 UUELMTLYRYATDK-ZJNRKIDTSA-N 498.346 0.019 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(C)C(=O)CC3)C2)C1 1839962675 NUAGVNPRIBCEPI-SCLBCKFNSA-N 459.341 0.225 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839988493 SWQVMDDAAZRNKP-GUYCJALGSA-N 468.320 0.658 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1840032189 QJANDPJQIBVIQW-ACJLOTCBSA-N 458.309 0.249 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1 1840033934 VCYDPTYNOYDUIL-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD Cc1ccc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840664460 RWQKEMGFYOEVQL-XMMPIXPASA-N 452.316 0.367 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)O2)C1 1841348987 YDLFHHGFTYTVSR-GJZGRUSLSA-N 457.955 0.958 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)C2=NN(C)C(=O)CC2)C1 1841864370 LNEJBFJYJWQARE-UHFFFAOYSA-N 457.443 0.945 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCc2cnc[nH]2)C1)NC(=O)NCc1ccccc1 1842002558 DDLLEOJFEVEGCO-UHFFFAOYSA-N 453.547 0.892 50 20 JCGD CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013831 SVLDYUAEXMRACL-SFHVURJKSA-N 491.419 0.830 50 20 JCGD Cc1noc(CC(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)n1 1845038766 QZUGTWMGTOLDPS-UHFFFAOYSA-N 455.519 0.470 50 20 JCGD O=C(CCn1cnc2sccc2c1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 14231939 OQTQRSWZNOBPKG-UHFFFAOYSA-N 491.551 0.330 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)c1ccc2c(c1)CCC2)NNC(=O)c1ccccc1 726000770 NIPOHFAMQIOMRW-UXHICEINSA-N 451.479 0.755 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(NS(=O)(=O)c2cccs2)cc1O 728202798 ATMOGEIIWIFUIE-SNVBAGLBSA-N 459.527 0.450 50 20 JCGD COC(=O)COc1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 728215777 IMKSKICBFPTUNK-UHFFFAOYSA-N 462.528 0.931 50 20 JCGD Cc1nnnn1/C(=C/c1ccccc1)C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 849196536 PFQISGANDMJXHQ-SKTWIKFTSA-N 464.438 0.510 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cccnc1OC)N(S(C)(=O)=O)CC2 910844725 LTBBCPCHRZMWGG-INIZCTEOSA-N 478.527 0.818 50 20 JCGD O=C(NCCOc1ccccc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915890179 YCBCDXIHQOALGV-UHFFFAOYSA-N 466.491 0.870 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCCNc1ccccn1 916576550 MWEYHJBRIUQQTC-UHFFFAOYSA-N 490.586 0.868 50 20 JCGD C[C@@H]1CCCN(C[C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 919914208 CXGDTJLINSCHRZ-IAGOWNOFSA-N 467.592 0.772 50 20 JCGD COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)CC1 1322200993 WHLWYNDMORSBPS-UHFFFAOYSA-N 455.533 0.189 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)no1)C2 1778092986 XPQDPNULGNMSRU-GCVSMSDNSA-N 458.475 0.642 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1779520366 NAKRDQXQBFUJLV-VQOYQAAGSA-N 488.589 0.939 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)no3)C2)C1 1779676552 OEKHDYHDKQOGTR-HXUWFJFHSA-N 460.399 0.971 50 20 JCGD O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1779948277 HBOYNTVCFNXEOR-QGZVFWFLSA-N 455.334 0.985 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(O)[nH]3)CCO2)C1 1780097824 NBXBVGQZJLBIJZ-FQEVSTJZSA-N 459.415 0.706 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)nn1 1780425753 ACBPFECRDAPDJO-VCOZGABYSA-N 469.502 0.453 50 20 JCGD CC(C)[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969623 MUVYMBIHOBESKA-REWPJTCUSA-N 461.563 0.179 50 20 JCGD CN(C)[C@@H](C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1Cl 1782830014 ADGZBOGLWIYVAZ-ZJSXRUAMSA-N 485.777 0.766 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCO[C@@]3(CCN(C(=O)[C@H](Cl)COC)C3)C1)C2 1783882756 QQNFQURBMVAUKK-WJONJSRFSA-N 482.965 0.706 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCc4sccc4C3)[C@H]2C1 1785101235 ITEDKMYNNYRRCR-FHWLQOOXSA-N 477.631 0.459 50 20 JCGD O=C(Cn1ccc2sccc2c1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785256131 LGEAPYDZGGTNJP-VDGAXYAQSA-N 495.366 0.036 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1785700637 GUCQTWNVZGVAEP-WNMGUVTHSA-N 460.339 0.932 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1F 1786982006 WYTVFOFMIXVXEP-XERREHJYSA-N 487.312 0.618 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)s1 1786986622 RKJLMYZVXYAGBM-JIGQMWBCSA-N 455.345 0.438 50 20 JCGD Cc1nn[nH]c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1787185099 UUQQQNRHEJRENK-FHWLQOOXSA-N 484.561 0.053 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(S(C)(=O)=O)CC3)[C@H]2C1 1788110957 CEKXNLVPPMCFIU-NXOAAHMSSA-N 450.001 0.655 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C[C@@H]21 1788609862 PESUJRNXLNJQEY-PWZKMPOXSA-N 491.552 0.045 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccc4o3)C[C@@H]21 1788609898 RDUNUOLAYBTFCA-AXHNFQJDSA-N 464.482 0.733 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3O)[C@H]2C1 1788824280 ZEYFAAXDQVXZMU-WILUMGJWSA-N 454.487 0.515 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1)N1CSCSC1 1791290898 CNXMFAMHZLBLIP-QAETUUGQSA-N 473.665 0.382 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccc(Cl)cc4n3)C[C@@H]21 1791290929 FFGYINKSRIFIPU-ZVZYQTTQSA-N 476.965 0.954 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)O2)C1 1792527280 BJWRJOXFVKGHRC-QEOTZNIISA-N 487.981 0.344 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1 1793208377 ADAMRPREISPENZ-GQUPQBGVSA-N 463.962 0.879 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC(CO)CC1 1793853401 QNGGBPUAJQLBOI-ROGVSCEHSA-N 459.547 0.509 50 20 JCGD Cn1c(=O)n(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)c2ccccc21 1795114485 OLVHGSBNHCVYGG-HBCWATKFSA-N 465.348 0.715 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(C(F)(F)F)cn1 1796070203 APMUBZQKMWXCNY-DPIQGUFMSA-N 458.441 0.072 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796187932 MVGTVPOBMXSGMK-IYWMVGAKSA-N 487.362 0.254 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)nn1C 1798756362 JQBONSOMKBFCGM-YXPYIKCWSA-N 485.969 0.764 50 20 JCGD Cc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)nn1C 1799094838 BRHGGWOIUUHMHQ-IRJINJETSA-N 497.600 0.207 50 20 JCGD CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2 1799267935 IUXDYUVKSZCPNS-OQMKEHIESA-N 458.906 0.791 50 20 JCGD Cc1cc(Br)ccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799498626 UKOSKOZWUSVXEG-CWPLJXCYSA-N 487.159 0.954 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799869325 HKKQRRFSQPIALI-PLACYPQZSA-N 488.589 0.122 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nnc(Br)n3c1)C2 1800975819 UIYARLRGLUYTEB-QVHKTLOISA-N 486.754 0.949 50 20 JCGD O=C(CN1CCSCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1802445975 JOSUSZWNDVFBSN-SIKLNZKXSA-N 468.388 0.130 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807365812 PKGJOADZWSHOSM-GDBMZVCRSA-N 497.210 0.436 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375532 PWFIZCNAHSWGLN-GHTZIAJQSA-N 470.298 0.438 50 20 JCGD CCOC(CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)OCC 1807375677 UMWYGRWLFXSDGE-WMZHIEFXSA-N 469.347 0.870 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccn2c(O)nnc12 1808188304 DCVQBARFUCYKRY-FXAWDEMLSA-N 486.297 0.143 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)[C@](C)(Cl)CCl)[C@@H]1c1cccnc1)C(=O)C(=O)O 1808316821 HWPBNCLFWRRDNZ-FRIZHTMISA-N 459.330 0.867 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1nc[nH]c1[N+](=O)[O-] 1808367327 DRQBUUAOOWLUIZ-CRAIPNDOSA-N 464.247 0.026 50 20 JCGD COc1cnc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1 1813071080 MKVPVBFDQNJLBT-KKSFZXQISA-N 455.519 0.573 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)COc2cccnn2)[C@H]1c1cccnc1 1813390831 GVRVUPDSTDQKBZ-VGOFRKELSA-N 455.519 0.329 50 20 JCGD Cc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c(O)n1 1815361161 ZERUQQLEKTWLHF-AWEZNQCLSA-N 452.301 0.772 50 20 JCGD COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)n(C)n1 1816135817 NHFQMKBJXFJSDJ-MRXNPFEDSA-N 452.280 0.451 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCOCC1)CC2 1817280183 PHLHPRGMHHNTOJ-JUCPORTRSA-N 473.559 0.521 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1)c1n[nH]c2c1CS(=O)(=O)C2 1817683488 ZXIWONPFMONDAO-OLZOCXBDSA-N 456.912 0.467 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC(c4ccccc4)=NN3)sc2C1)c1cccc(B(O)O)c1 1824435253 ZFKHQPWUYKFSGQ-XLIONFOSSA-N 489.366 0.815 50 20 JCGD O=C1OCCN1CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828384600 BJMGSYADJOZQIX-FQEVSTJZSA-N 457.336 0.442 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C[C@@H]2C[C@@H]21 1830719592 GOKFUKDRCFAPKR-JUPXILGHSA-N 487.981 0.440 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737912 KKOKBEHHBZADHG-WHSLLNHNSA-N 475.970 0.442 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833306491 UCODFJQQCYKAJD-SJORKVTESA-N 477.002 0.043 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1 1833565435 LFAZUCQEDLXLTP-OXJNMPFZSA-N 473.979 0.714 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncn3-c3ccncc3)CCO2)C1 1833656554 IIDVWGQECQKNJH-UWJYYQICSA-N 463.922 0.591 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CNC(=O)c3cccs3)CC2)CC1 1833835315 BYZLFGLZMUXWRJ-UHFFFAOYSA-N 492.646 0.423 50 20 JCGD CN1CCN(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)CC1 1834424123 YYLRNPDNSYCCKY-UHFFFAOYSA-N 458.445 0.590 50 20 JCGD O=C(c1scnc1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1834570913 SGIZEHNPGCXGAV-MEBBXXQBSA-N 457.858 0.832 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCCSC3)CC2)CC1)c1ccc(B(O)O)cc1 1834800672 XMMVSOBWNWBTOD-GOSISDBHSA-N 459.421 0.695 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnoc3C3CC3)CC2)CC1)c1cccc(B(O)O)c1 1834800923 AUWPWRDZDIFKEO-UHFFFAOYSA-N 466.347 0.731 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ccnnc3O)CC2)CC1 1835117604 DEDIGGQEDASUQR-JFLMPSFJSA-N 482.545 0.501 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)N3CCOCC3)CC2)CC1 1835765096 JCJNDVPXTWIMSS-XLIONFOSSA-N 475.428 0.382 50 20 JCGD CC(C)Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939321 MDWGABDQSXTCBR-SANMLTNESA-N 480.370 0.949 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccs3)CCO2)C1 1836088855 CPDNGMXUHWPKGV-NRFANRHFSA-N 459.528 0.059 50 20 JCGD O=C(c1nn(-c2ccccc2)c2c1COC2)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836391350 VBYYVTSGTJIBCO-XXBNENTESA-N 490.944 0.572 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836957487 LAUGQFDBZJQLSX-UHFFFAOYSA-N 483.573 0.961 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837025209 RFZWTCRFVLBRSK-UHFFFAOYSA-N 491.357 0.424 50 20 JCGD CC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccc1 1837457040 TVADEGDUELPQOT-DFBJGRDBSA-N 481.553 0.949 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920204 RBDORGFUYNVYIB-KRWDZBQOSA-N 459.352 0.780 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)CCO2)C1 1838525680 AZVYFNKWZIUXGJ-DYESRHJHSA-N 483.905 0.854 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1 1838762224 FGLKCUFKRXTNQY-ZUZCIYMTSA-N 484.273 0.925 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C3=COCC3)C2)C1)NC(=O)NCc1ccccc1 1839054342 VDCZAVUACZMEBE-DEOSSOPVSA-N 487.557 0.093 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)c(C#N)c3)CCO2)C1 1839188121 LYMBEDUKKIXBNZ-DYESRHJHSA-N 453.898 0.950 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)C(C)(C)C 1839198472 FKTUPKTXKUNNMK-GLJUWKHASA-N 466.348 0.684 50 20 JCGD COc1cc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc(OC)c1OC 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CCC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1841667066 OCTUDKLTXCUKAD-CYBMUJFWSA-N 450.927 0.045 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010429 PALMQVTZXMJZBV-QAPCUYQASA-N 475.351 0.112 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2 1843415696 BMZFOESFJICKLZ-MZJWZYIUSA-N 463.498 0.917 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCNC(=O)c1ccc[nH]1 1848177975 RXNONICKHAWOKG-SWERZJPOSA-N 453.503 0.470 50 20 JCGD Cn1ncc(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)c1C(F)(F)F 1848304789 YXXNPHODYVQSIR-KBPBESRZSA-N 451.409 0.567 50 20 JCGD CC(C)(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)CC2)cc1 9930745 CUJCMJTWLDUVCE-INIZCTEOSA-N 485.628 0.967 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)cc(OC)c1OC 15792775 QXMSWFLGHMNWNY-UHFFFAOYSA-N 497.501 0.947 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1 24537511 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476.511 0.623 50 20 JCGD O=C1CC[C@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCN(Cc4ccccc4)CC3)cc2)CN1 916144469 ABXLLMUOIWJCNA-FQEVSTJZSA-N 499.593 0.480 50 20 JCGD Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 917717386 DHHPQTHEKJMBRR-UHFFFAOYSA-N 484.512 0.547 50 20 JCGD CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)CN3CCCC3=O)c2)CC1 920435625 LSCJYHJFKUJQRF-UHFFFAOYSA-N 471.967 0.050 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H]3OCCc4ccccc43)CCO2)C1 1779028903 KQFMTFACYZHRPW-SQJMNOBHSA-N 479.537 0.833 50 20 JCGD Cn1c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc2ccccc21 1779030758 WRQLANHRAPFLFU-DEOSSOPVSA-N 462.510 0.934 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032490 LKPDUKYAPVDCOA-OYLFLEFRSA-N 498.515 0.086 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cncc4cnccc34)C2)C1 1780011925 ZMJPOGFTUSWKBI-HSZRJFAPSA-N 461.482 0.386 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1 1781553173 PEPPWDLJLCYYQS-OAQYLSRUSA-N 472.433 0.490 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1782180389 ZBYHVRXSSKARIH-YYFZDKIDSA-N 470.910 0.524 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1ccc(O)nn1)C2 1782213278 KRCQRLSIKQBWAR-VGOFRKELSA-N 462.551 0.002 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CC[C@@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)[C@H]2C1 1783475707 XQFDAPBFKMFMPV-HGRWERBWSA-N 487.981 0.298 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)CCO2)C1 1783527759 FZXFPFNOSIGKAK-WYSJICDVSA-N 482.375 0.779 50 20 JCGD COc1ccccc1OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1783773342 PROFNPCCYWKICS-XERREHJYSA-N 483.525 0.366 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1 1783882950 AGILUAXUVFDJBO-ZSDSOXJFSA-N 491.969 0.527 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@@H]1C[C@@H]1c1ccc(F)cc1 1783884937 OWVYEIKWATUMTN-GEFFGTOZSA-N 466.318 0.903 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCNC4=O)C[C@@H]21 1783967807 XNLOGOVBFQDNJD-FHIRATQRSA-N 482.379 0.641 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1c(F)ccnc1Cl 1785478536 CXXGEVYMNZHVMW-QRTARXTBSA-N 461.686 0.461 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCNC4=O)[C@H]2C1 1786260320 SBHCSNLJYVJXGT-JFILPPLUSA-N 468.352 0.393 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCC4)C[C@@H]21 1788610359 NJUQEKNQPMGHGM-YSSFQJQWSA-N 465.510 0.527 50 20 JCGD CC1=NN(c2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]43)cc2)C(=O)C1 1789629183 PNUMLUJLJKJYQV-JBACZVJFSA-N 498.584 0.766 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)nc1Br 1792980219 GKUVKFZPPAMNDL-IQOUGMIPSA-N 462.728 0.656 50 20 JCGD Cc1cc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)[nH]c2cc1C 1795739221 RINLTWAHRBPJAZ-UPHUGPLXSA-N 462.315 0.377 50 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CN1CCCn2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)cc2C1 1800129998 DYDKUWWKIOWCIM-VZAMPYOESA-N 458.332 0.612 50 20 JCGD COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1C 1800819352 NXBHCMROGSNNJL-BBIADKPPSA-N 452.316 0.129 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)C2 1801012539 NYONOBIOBJBZOE-HBCWATKFSA-N 451.455 0.310 50 20 JCGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)[S@](=O)c1ccccc1 1801012648 DNZRHUBVTRYPTM-AQZZLDPDSA-N 464.588 0.145 50 20 JCGD C#CCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1804183222 MOOSPBFQHMZAFC-LRSLUSHPSA-N 497.401 0.854 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CCC4(CCCN(C(=O)[C@H](O)CCl)C4)CC3)csc2n(C)c1=O 1805525002 BDFXYWBGZKDBMD-OAHLLOKOSA-N 497.017 0.672 50 20 JCGD Nc1nc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cs1 1807370391 CKVYEGXVHIBVTP-QAPCUYQASA-N 451.317 0.434 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1807376710 VZISCPFMHXNDEA-PGRDOPGGSA-N 488.309 0.576 50 20 JCGD CC[S@](=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810118141 XPKRNUPYLGSOLB-VPWRUGTASA-N 472.571 0.558 50 20 JCGD C[C@](O)(C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(F)(F)F 1810294047 HTSHHARSYYUCHM-PSGMQZRDSA-N 480.447 0.713 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1 1810306343 XGFVSLSBPXIPOM-IIBYNOLFSA-N 474.525 0.856 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(C(N)=O)cc2)[C@@H]1c1cccnc1 1810308092 IVPSIULJAVQLEQ-WIYYLYMNSA-N 487.520 0.812 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810398555 UEABBBFVHVCYPE-VGSWGCGISA-N 476.541 0.982 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1810442153 XGRGJUUPJOJODR-AQOAWAETSA-N 496.572 0.069 50 20 JCGD Cc1ncncc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810973625 LVJABIUQDGIQPD-OXQOHEQNSA-N 460.498 0.812 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1812864752 KNGJMEKZZBGZHO-GHJWDPDVSA-N 452.309 0.423 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCN2CCOCC2)[C@@H]1c1cccnc1 1813069917 BPGUCRFQRRLREA-AUSIDOKSSA-N 460.579 0.183 50 20 JCGD CC(C)CNC(=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1818134204 YFQLUBUQBLXBLW-MRXNPFEDSA-N 456.507 0.486 50 20 JCGD Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC4)c(C)n2n1 1818251111 NQLUFFRSWOWBNX-ZDUSSCGKSA-N 485.574 0.796 50 20 JCGD CC(=O)N/C(C)=C/C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1821632707 NEZYODSPXFNMAR-XLNAKTSKSA-N 454.491 0.754 50 20 JCGD COCCOCCOCCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822416522 GQWWGFXTXQHJCE-SFHVURJKSA-N 482.582 0.845 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3c4c(nn3C)CCC4)sc2C1 1824244588 AJYGUESUOXTBFN-GFCCVEGCSA-N 459.576 0.964 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1826829067 AVLPOVLDWRSUAM-QWHCGFSZSA-N 468.543 0.900 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCn2ccnn2)CC1 1828925543 LDFCHVQNTDNJOK-IBGZPJMESA-N 454.535 0.600 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1830358669 QMYOJQAGXWQFOH-FPTDNZKUSA-N 482.965 0.714 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724798 CJTRRAOHVFSYJQ-QYWGDWMGSA-N 475.970 0.512 50 20 JCGD Cn1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc2c[nH]c3nccc-3c21 1830730918 GFTBBQUHDVZDFE-VGSWGCGISA-N 475.933 0.676 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](S)C(C)C)CCO2 1831487579 QCTQIVVUGNYTOY-WPWRZWQBSA-N 465.576 0.531 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1831649919 CMMSHGNTQNYQOM-VFNWGFHPSA-N 467.954 0.494 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1831873555 NZKFRNDUXQBNLD-IBGZPJMESA-N 473.578 0.291 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ncc(F)cc1F)CCO2 1831964230 BFAGYXKQZIGKLG-VATWTLTGSA-N 490.467 0.564 50 20 JCGD CN(C)c1cccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1832526031 NHJYWCIYEFNKTK-WIYYLYMNSA-N 455.939 0.188 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@H]1CCC(F)(F)C1 1833043448 RHFBTVSZSPOHIF-KRWDZBQOSA-N 463.334 0.987 50 20 JCGD CC(C)c1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)co1 1833347487 VSFFSFDMPIVCFZ-JOCHJYFZSA-N 472.502 0.180 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1 1833450492 INDQCIFGURZIFU-GFCCVEGCSA-N 457.424 0.690 50 20 JCGD Cc1ccccc1NCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797851 DOZVLFCLGUTFII-UHFFFAOYSA-N 478.402 0.972 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835737014 HCQUFSHYVLYNQX-UHFFFAOYSA-N 482.589 0.384 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835939610 BSPHVQPHDMCTTH-JOXKVKLASA-N 498.316 0.298 50 20 JCGD Cc1nn(C)c(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1F 1837337573 SWFOMBXKORAXPD-UHFFFAOYSA-N 472.326 0.473 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837638224 NYNMFIRCCVAIDV-ONEGZZNKSA-N 473.530 0.417 50 20 JCGD C[C@H](Nc1nccs1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919472 VZRNLDPXVGMQIL-INIZCTEOSA-N 486.403 0.936 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920306 YLKNGWGMGAEGDG-INIZCTEOSA-N 476.335 0.540 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)no1 1838408908 TUJNLZWULBKBOO-UHFFFAOYSA-N 492.577 0.084 50 20 JCGD O=C(c1[nH]nc2ccncc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199713 SJNOEVSOJBYWKM-YOEHRIQHSA-N 456.272 0.718 50 20 JCGD O=C(c1nc[nH]c1[N+](=O)[O-])N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200748 MBQFKKUPEGAPPO-QMTHXVAHSA-N 450.221 0.078 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839215624 CEYVYEYYZBPRMJ-GLRBVFSKSA-N 488.491 0.949 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839219196 BBLDNVHMKJRNNN-JPYJTQIMSA-N 462.547 0.283 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1839694579 QLAGOJBIECMTJC-AVRDEDQJSA-N 466.966 0.094 50 20 JCGD CN(C)[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccccc1Cl 1839731749 POEXMAMTWGXBAI-BBTUJRGHSA-N 474.385 0.999 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840045234 YRAIIRASFOZPJM-JLHGSKIFSA-N 489.997 0.832 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3ccc(OC)cc3)C2)C1 1840149563 SQYSKLXXYIPYAM-GHTZIAJQSA-N 456.923 0.784 50 20 JCGD C#CCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1840168994 CVXTUXYVGYGKFI-VWLOTQADSA-N 485.585 0.593 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)c(F)c3)C2)C1 1840183013 ZILNRPRAIGXWLS-HOOSLVGPSA-N 494.539 0.898 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnccn3)CCO2)C1 1840455801 UFQBGEMJLSRCRJ-HNAYVOBHSA-N 455.353 0.897 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2)NC(=O)NCc1ccccc1 1840814872 JWMLUXKQNKMMMI-VWLOTQADSA-N 498.584 0.483 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1841515295 FYXYHHBGLKTJGY-UHFFFAOYSA-N 475.351 0.115 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014070 TZZWUXRQLJWSHV-IEBWSBKVSA-N 489.353 0.779 50 20 JCGD CCc1c(Br)c(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)nn1C 1843144020 WLMUQLIYTBWSPI-UHFFFAOYSA-N 475.152 0.556 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1843947757 JIVSRGLRFOLMEO-UHFFFAOYSA-N 457.336 0.440 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(N3CCCS3(=O)=O)c2)c1 14326428 DREVRMVHZVUEAV-UHFFFAOYSA-N 466.541 0.552 50 20 JCGD CCN1C(=O)c2ccccc2N2C(=O)CC[C@@]12C(=O)OCC(=O)NNC(=O)c1ccccc1 18752851 KAUWFHNQTBKBDB-HSZRJFAPSA-N 450.451 0.990 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)C[C@@](O)(c1nccn1C)C(F)(F)F 105570215 JRHDNOPHENREPS-MRXNPFEDSA-N 462.454 0.623 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](C)N1C(=O)NC2(CCCC2)C1=O 726522149 CJCAOEMNFMKNJU-LBPRGKRZSA-N 450.521 0.302 50 20 JCGD C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)N1C(=O)CCC1=O 727723373 XMUWBSVFDZFKLF-CQSZACIVSA-N 458.496 0.464 50 20 JCGD COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=S)NCC1CCC1 727865867 CSXMEWWBBNBQJR-OAHLLOKOSA-N 456.590 0.524 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(C)c(S(=O)(=O)N3CCOCC3)c2)n1 748128956 IEZGAWYBCIZYPC-UHFFFAOYSA-N 496.567 0.328 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccc3)CC2)c2ccccc2c1=O 748465208 LTSMDTJXKJJJOO-UHFFFAOYSA-N 477.525 0.616 50 20 JCGD O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1ccc(-n2ncc(Cl)c(Cl)c2=O)cc1 751282463 LUSHMJXHXWVZPT-UHFFFAOYSA-N 486.293 0.872 50 20 JCGD COC(=O)c1sc(S(=O)(=O)N2CCC(C(=O)NNc3ncccn3)CC2)c(C(=O)OC)c1C 913044369 SFIPBJOUGRZRAG-UHFFFAOYSA-N 497.555 0.964 50 20 JCGD CCOc1ccc(/C=C(/C#N)C(=O)OCC(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)cc1 913263922 QRYAEQKSHGHSIA-LJLZWOEMSA-N 461.540 0.867 50 20 JCGD CN1CCN([C@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c2cccs2)CC1 915901411 IAJKSKCAVSUHRL-QGZVFWFLSA-N 469.571 0.928 50 20 JCGD CCn1c(NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)nc2ccccc2c1=O 916826735 HNLHCZPLLGBQQV-UHFFFAOYSA-N 473.511 0.999 50 20 JCGD O=C(CCn1cnc2ccc(Br)cc2c1=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919889755 SQBWOKKLLNDRHE-LLVKDONJSA-N 472.321 0.067 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCc2cccc(C(=O)NC[C@@H]3CCCO3)c2)c2ccccc2c1=O 920348277 OPXKUACDLBXZFG-KRWDZBQOSA-N 478.509 0.987 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)CN1CCCC1=O)n2C 920827765 XKRFKRYSDXAKMW-UHFFFAOYSA-N 478.575 0.306 50 20 JCGD COc1ccc2cc(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)[nH]c2c1 1777769691 QCTWPTVOFZAZMK-XMMPIXPASA-N 463.299 0.614 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C2)C1 1778930269 KDIWADUITURPNY-GYCJOSAFSA-N 480.525 0.392 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1779317019 YQYLWXDGQRGWAL-AVRDEDQJSA-N 492.485 0.115 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2 1779407679 PSNAYPVPZIGHPU-NALNUFGESA-N 477.352 0.779 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](O)N2CCOCC2)C1 1779418891 WLKAAJMXUSGQKI-VVWQDTPRSA-N 462.385 0.324 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Br)cn3)C2)C1 1779425348 QHRHHGLFHAYABW-LJQANCHMSA-N 468.352 0.661 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1780592596 VXQUOLHCKBYSFB-DNVFCKCGSA-N 458.563 0.297 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cn2c(F)cccc2n1 1781319242 UFPDNZZCEANKAR-NTKDMRAZSA-N 480.305 0.595 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1781355216 MBZFJZRYZVQOAB-RVZJWNSFSA-N 482.347 0.783 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(F)(F)c2ccco2)C1 1781520237 FUJBPKFIWOJRLH-DYESRHJHSA-N 462.258 0.879 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1782625484 IIYDXXFQOXRDOI-WUMYNOTOSA-N 472.970 0.988 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1782707461 PLFDJIQXEYVXAQ-JOTACAGLSA-N 463.491 0.512 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783535602 AGMKWUWCYFPZNX-IERDGZPVSA-N 496.406 0.946 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C[C@@H]21 1783975155 ZZQKSGKVUFCWFN-HOSILWTGSA-N 485.335 0.767 50 20 JCGD COc1cc(N2CCC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)CC2)ncn1 1784084012 JWWABAYRQHCOCF-XSLAGTTESA-N 481.981 0.281 50 20 JCGD CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCS(=O)(=O)CC3)C[C@@H]21 1784615906 CZWJRVHRWXTDEU-NXOAAHMSSA-N 450.001 0.104 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1784786912 SCSKWFJCQNHBEK-GGUVTUNTSA-N 477.986 0.494 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1c(F)ccnc1Cl 1785478985 QFNADDGINPSWBJ-QRTARXTBSA-N 461.686 0.461 50 20 JCGD Cn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]32)cc1O 1785589958 HMYBHLQLLCTVFV-SDADXPQNSA-N 485.969 0.851 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1785609125 PHBLJIOPLNHAEZ-WTOJCKNJSA-N 491.383 0.368 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nc3F)C[C@@H]21)c1cccc(B(O)O)c1 1786984445 HLJDEMPLYUCMPF-JQFCIGGWSA-N 461.686 0.461 50 20 JCGD O=C1CSc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)ccc2N1 1787387382 WFAQECLVJJOSGT-UGQVUOCMSA-N 453.948 0.924 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cnc1C 1788611701 SCWARCNEAYOSMX-YSSFQJQWSA-N 452.515 0.604 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1[C@H]2c3ccccc3S[C@H]21 1788622911 VVHIWKHVARVTIW-BKEOGYBKSA-N 478.379 0.848 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(F)cc([N+](=O)[O-])c1 1790132479 WUPPQPISZPKABO-GKCIPKSASA-N 471.250 0.321 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(Br)n3)C[C@@H]21 1791291103 MFBQASUZPOKLAW-OBJOEFQTSA-N 488.408 0.872 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cnccc1C(F)(F)F 1794717827 FXTJDTKETJYDDZ-ZSBFGKGUSA-N 463.221 0.297 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795113325 YDCIMIIPLKZSHX-XFMPKHEZSA-N 464.357 0.247 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc(Cl)c(Cl)c1 1798075254 MIMIWFZDRYQILG-XOIINTDNSA-N 464.114 0.585 50 20 JCGD COC(=O)[C@H]1CCC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)C1 1798443669 UNQYDVIIPIMIIS-BPKGMFCQSA-N 457.531 0.916 50 20 JCGD 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COc1cnc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1807362140 DXUSOJVNBDVODO-DYESRHJHSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374896 KXMCCTCHVLNAKD-UZLBHIALSA-N 463.259 0.631 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cc(O)n(C)n2)[C@H]1c1cccnc1 1808413383 AGOLICAOVZBYDJ-RVGDNOHSSA-N 478.513 0.974 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnc(N(C)C)o2)[C@H]1c1cccnc1 1813069768 BPCIIFAYXKHLFV-JXFKEZNVSA-N 457.535 0.828 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1815233439 XGIBMGFYCUZRPC-UKRRQHHQSA-N 456.569 0.456 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CC(=O)NC2=O)n[nH]1 1815664319 RPTHXPPTYLAFOT-ZYHUDNBSSA-N 455.313 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3nc4ccccn4n3)sc2C1 1816659699 GWRXUIGGHRZGBG-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816673395 BAVPHBHZQOCWNV-RQJHMYQMSA-N 467.309 0.278 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1SC(=N)NC1=O 1818097942 BHSCIZGSNREYRG-KCTSRDHCSA-N 484.347 0.198 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)N1C[C@H]2C[C@@H]2C1 1819289545 CSHGFPCEIQFWPE-OYRIPWCXSA-N 451.336 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1 1819403964 POSJMUSHOUTXJS-HZPDHXFCSA-N 475.531 0.291 50 20 JCGD Cc1nn(C)c(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c1F 1819795166 JARKOZWLKNCSGL-JTQLQIEISA-N 472.506 0.862 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1)[C@H](F)Br 1820932953 WADSRXJXOMXOSQ-SKDRFNHKSA-N 468.247 0.532 50 20 JCGD COCc1c[nH]c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1 1821284457 KBFASLLUPMLIGM-HNNXBMFYSA-N 454.317 0.837 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@H]2NC(=O)NC2=O)CC1 1825072485 ORHGNBSRVWOBAG-VWOYHTDSSA-N 485.545 0.338 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)no1 1827059757 UXDBYUGNKSJWPH-HXUWFJFHSA-N 482.346 0.925 50 20 JCGD O=C1NC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](O)CCl)CCN3C(=O)OCc3ccccc3)C2)O1 1828549090 VHZMYFIBMQJMOO-HYFFOGBASA-N 494.932 0.147 50 20 JCGD COc1nccnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830536027 XAHIDTOLROCUJI-ACJLOTCBSA-N 457.325 0.586 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1830732453 YNGPINDWYZDJQH-SSKFGXFMSA-N 489.997 0.690 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)C1CC1 1830853667 SSKJZJHDMCAAQP-JLHGSKIFSA-N 489.997 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1scnc1C1CC1)CCO2 1833730266 WBACFWNEHWRCIQ-JOCHJYFZSA-N 486.554 0.403 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCC(=O)NC3)CC2)CC1 1835116678 XHPKYHMDRIQZQG-TXMABLNQSA-N 485.589 0.218 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835117822 NSBOTKYCMQXBLK-OVNWTWFZSA-N 488.593 0.139 50 20 JCGD COc1nccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1F 1835736996 PUBQEQJBFAFSPX-UHFFFAOYSA-N 499.547 0.727 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3ccccc3=O)CCO2)C1 1835991939 CUBCAMLFXAOFHF-BEFAXECRSA-N 456.337 0.336 50 20 JCGD CC(C)c1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)on1 1836180268 PHVACZLGAGGFSU-UHFFFAOYSA-N 468.363 0.977 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1836671256 SOGDZGZQOCABEU-CZUORRHYSA-N 461.401 0.609 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1837116881 AHIHKBCEYJACJN-FZMZJTMJSA-N 459.341 0.367 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(F)CCCCC3)C2)C1 1837458821 FELSXYXROVTMGM-NRFANRHFSA-N 463.510 0.428 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)no3)CCO2)C1 1838108234 SAHBACSALFRTNX-OAQYLSRUSA-N 490.425 0.598 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)cn3)C2)C1 1838528015 AAOZVXJLPSLGAY-QFIPXVFZSA-N 487.469 0.637 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 1838569052 QDEWDVMXYRNNLB-PGRDOPGGSA-N 468.934 0.923 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199669 ZJJBIXZKXQWGCW-SJLPKXTDSA-N 470.299 0.578 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)NC(=O)c3ccccn3)CCO2)C1 1839668092 ZZUANFIQKQJREH-GCKMJXCFSA-N 452.939 0.674 50 20 JCGD CNC(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839801481 MOIUDFUPBXPZHP-LAUBAEHRSA-N 482.375 0.585 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1839874509 XAGWDSTXJVNVLU-WDUKFBBWSA-N 490.985 0.100 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1839967407 LPWXNFSCFZNBKJ-PXAZEXFGSA-N 494.433 0.477 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1840033848 SFYIBGNZFYJGDJ-DJJJIMSYSA-N 471.352 0.778 50 20 JCGD Cc1c(F)ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1N 1840184311 ZFMMOTZNJLBRPM-JOCHJYFZSA-N 465.526 0.159 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3c(c1)CCCO3)CCO2 1840659800 MVZKOMWMLHQDER-VWLOTQADSA-N 480.326 0.075 50 20 JCGD O=C([C@H](O)c1cccc(Br)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011915 KFWGUSDNPOLMRJ-GOSISDBHSA-N 473.132 0.680 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015109 KDZSKMFJGWOFEA-KRWDZBQOSA-N 471.319 0.110 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cccc(OC3CCOCC3)n2)C1 1844606697 PFDPEHIMASFMPS-UHFFFAOYSA-N 459.547 0.829 50 20 JCGD COc1cc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)nn1C 1844836329 ZBGZRUKJAPSQMM-UHFFFAOYSA-N 469.546 0.592 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2 1846385005 KFXUDZLYCNMKFT-FQEVSTJZSA-N 457.575 0.464 50 20 JCGD CCCn1c(CCC(=O)NNC(=O)C(=O)NC2CC2)nc2cc(S(=O)(=O)N3CCCC3)ccc21 9889844 ONIOECZGZQMBCO-UHFFFAOYSA-N 490.586 0.589 50 20 JCGD COc1ccc(C(=O)NNC(=O)COc2ccc(C#N)cc2)cc1S(=O)(=O)N1CCOCC1 15889134 BVTKSHNZIGPRSN-UHFFFAOYSA-N 474.495 0.428 50 20 JCGD COCCCNC(=S)N(C)NC(=O)c1cccc(S(=O)(=O)N2C[C@@H](C)O[C@H](C)C2)c1 726077541 YXDFBBDHTPZCBG-HUUCEWRRSA-N 458.606 0.972 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(C(=O)OC)s1 726519848 OXAHKELZDFVLPM-LLVKDONJSA-N 456.454 0.471 50 20 JCGD CN1CCN([C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2ccccc2)CC1 727765352 WTFUWMOQOURKQR-FQEVSTJZSA-N 459.572 0.687 50 20 JCGD O=C(COC(=O)[C@H]1CCCN1C(=O)Cc1ccccc1)NNC(=O)[C@@H]1COc2ccccc2O1 728333602 KCQKUGHIWYLYLE-XLIONFOSSA-N 467.478 0.751 50 20 JCGD COC(=O)Nc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 728455591 LXMQXHALQFYDNR-UHFFFAOYSA-N 462.484 0.961 50 20 JCGD CCCn1c(CCC(=O)NNC(=O)c2cnn[nH]2)nc2cc(S(=O)(=O)N(CC)CC)ccc21 729456744 FCPJQNBPFJJTQO-UHFFFAOYSA-N 476.563 0.989 50 20 JCGD Cc1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)c(C)n1-c1ccc2c(c1)OCO2 730570741 LAAXTSQTSWYQGI-UHFFFAOYSA-N 470.511 0.858 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1)c1ccccc1O 751267282 OLPARJLHFFCABT-UHFFFAOYSA-N 453.420 0.856 50 20 JCGD CCOc1ccccc1C(=O)NCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 757662374 QHUXYOISPJXQDI-SFHVURJKSA-N 457.439 0.346 50 20 JCGD Cn1nc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c2ccccc2c1=O 818483840 AMCBPIGWSPQGHA-QFIPXVFZSA-N 466.429 0.301 50 20 JCGD CN1C(=O)c2ccc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)cc2C1=O 861446880 NMAXTMBAHWWXFX-UHFFFAOYSA-N 492.535 0.320 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccc[n+]([O-])c1)N(S(C)(=O)=O)CC2 913161292 IBHLLFZYVLDCLC-INIZCTEOSA-N 464.500 0.047 50 20 JCGD O=C(Cc1cccc(F)c1)NCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 916125654 QLXLAIFKSNCOLG-UHFFFAOYSA-N 462.503 0.730 50 20 JCGD CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)s1 916232113 FUVQPJDLRDNLQH-UHFFFAOYSA-N 480.616 0.699 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCc2ccnc(N3CCOCC3)c2)c2ccccc2c1=O 916388725 HHESUJYEIAHKTR-UHFFFAOYSA-N 451.487 0.792 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(Cl)cc3O)c2)CCN1 918358903 CSUBDIUQGWIGGU-UHFFFAOYSA-N 452.876 0.241 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncnc1)C2 1778091007 CGVVUZVPXXVYHP-VWCSSDMBSA-N 453.503 0.738 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2c(c1)COC2 1778640071 NTRIDGYSZOZJLC-RCZVLFRGSA-N 464.327 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C/N=C/c2ccco2)C1 1779442774 FSLLVNDZCPPPFE-RCABKOAUSA-N 468.514 0.525 50 20 JCGD CC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968709 DPHPYJUNNQPWMU-HSZRJFAPSA-N 459.547 0.532 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)N(C)C(=O)OC(C)(C)C 1781039130 WVLGXLMFMLBXPD-IQMFZBJNSA-N 490.561 0.384 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2)C1 1781340962 AEARHPHUBGIQEQ-CKFHNAJUSA-N 478.384 0.875 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214998 OJRGTGCFGWRCSA-GSHUGGBRSA-N 461.567 0.164 50 20 JCGD Cc1ccc(C(=O)NCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)cc1 1783258870 NITHVBTWMXYTDF-JBYIUTFZSA-N 451.951 0.838 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(S(C)(=O)=O)CC3)CCO2)C1 1783533673 DPGHPFGERZDOKC-SUMWQHHRSA-N 466.398 0.271 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cn3cc(Cl)ccc3n1)CCO2 1783935043 OCEFBSUGSZBUHE-OAQYLSRUSA-N 462.938 0.804 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C[C@@H]21 1783972049 HWKXAISEMQFREF-YGJAXBLXSA-N 478.384 0.840 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979682 KRXUEXMOVGTQIQ-HMNCIZAVSA-N 477.326 0.477 50 20 JCGD N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)c1cccc(Cl)c1 1786979825 KLMRDCDNKMTGBU-FIRPJDEBSA-N 471.750 0.313 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(F)c1 1786982917 HLCMKUJUFJSZLM-HARLFGEKSA-N 484.333 0.740 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)cc(F)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786984706 ZEFNILFRDUWYOO-NDXORKPFSA-N 458.270 0.481 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1 1787449461 PYBXQCGIIZOROF-YTFOTSKYSA-N 451.923 0.776 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)cc1 1787507117 YHAVBIKUIKAAAD-JTUKCZSHSA-N 497.552 0.842 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)CC1 1788145663 MONQVQNIDMYOLM-UHFFFAOYSA-N 478.358 0.278 50 20 JCGD COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1OC 1788610199 OOAQGWJUBHZTMF-OWQGQXMQSA-N 484.513 0.004 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccc(F)cc34)C[C@@H]21 1788611057 ILFWOSVLDGYODQ-KHDYIWLOSA-N 481.488 0.608 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)s3)C[C@@H]21 1788611172 NPFKFBPOKKSHAA-BPNCWPANSA-N 464.935 0.702 50 20 JCGD CN1CCN(C2(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]4C3)CC2)CC1 1788763608 VHDPAKLADNHGLC-FHWLQOOXSA-N 452.672 0.598 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)n3cncn3)C[C@@H]21 1789221783 DJAJFBGQEQPCOR-VQUGOPFGSA-N 486.485 0.966 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]2C1 1789867543 FSPVCAHOLSDIGU-DEEHTKSCSA-N 458.408 0.530 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C[C@@H]21 1791253650 DONBLYBHYFDAIU-QMHWVQJVSA-N 463.959 0.106 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Br)cn3)C[C@@H]21 1791288526 ADOREQNYOVJGMA-WBAXXEDZSA-N 496.406 0.739 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccc(F)cn34)C[C@@H]21 1791294008 XVSHZKABPKNRHH-ZVZYQTTQSA-N 460.510 0.440 50 20 JCGD 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Cc1nccn1[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610805 ASLCMPQILRPAAN-UVDFWXMISA-N 455.519 0.045 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)N1CSCSC1 1788680800 NQKNDRJMIFLBJJ-CBVHJVASSA-N 479.433 0.003 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726700 NMJYOLFXSFJURS-ZXDAYAIVSA-N 488.633 0.686 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)CO2)C1 1792984350 YLWPHMCDAIQHKL-NQNKBUKLSA-N 487.981 0.202 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)C1CC1 1793060904 AMKRLRMPTKRSFD-WXQHOCMDSA-N 459.971 0.869 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccnn1)C2 1793882642 QJGMGXPGXJUYHX-KRXQYRFLSA-N 483.953 0.577 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccccc1N 1795654102 ATORPYSZUOVKKV-CTSHNCOSSA-N 450.499 0.184 50 20 JCGD 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CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2 1802336600 OSHXUFOTJCMLRQ-QDMKHBRRSA-N 480.529 0.196 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1802862597 JLNAWFDSCXEWIS-NBHGPNQESA-N 496.373 0.994 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803141932 WCTLQTSIFOUTRP-VXIBKDFQSA-N 484.981 0.963 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1 1804417185 GGIPHYHFBFVMKM-FOIQADDNSA-N 493.484 0.205 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1F 1805146148 VTBXOIBAEPWXDL-YLJYHZDGSA-N 465.294 0.576 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ncc(Cl)cn1 1805232178 LBIOIRDBDDVUOW-APWZRJJASA-N 465.706 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1 1810131873 QXBAFFCCZFXNQM-NPIIGJQGSA-N 477.525 0.235 50 20 JCGD COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1812688267 SYHMSTFSZFUUEZ-PKOBYXMFSA-N 451.288 0.034 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1 1813032315 GTDMFQDDUVMKJP-FRYIKTPZSA-N 451.999 0.977 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1813070328 IJPBQVRLWBRLNA-XLIONFOSSA-N 456.551 0.947 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CNC(=O)c2cccs2)[C@@H]1c1cccnc1 1813071917 ZOMYXPJIWYWFLK-HTAPYJJXSA-N 486.598 0.952 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1 1813074254 WOBZXVJMVDYRCV-LAUBAEHRSA-N 469.546 0.753 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C1CCC(O)CC1 1813194299 PKRFXFCDTBLYPG-CYGMFBECSA-N 451.332 0.632 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnc3c(c1)CCNCC3)CC2)c1cccc(B(O)O)c1 1815360669 WPJPYCJJMYHJRS-GOSISDBHSA-N 491.382 0.446 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401490 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CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1830358757 RWDSRRUGOLFMDU-OAQYLSRUSA-N 452.939 0.533 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c[nH]c1C 1830720102 SZCNJTBDTDYMDO-JTSKRJEESA-N 485.965 0.489 50 20 JCGD Cc1csc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1831777805 MVTWPPOWFPNZNI-NRFANRHFSA-N 459.528 0.439 50 20 JCGD CC[C@@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549503 LKSPEYRKLZXARL-BXTJHSDWSA-N 463.959 0.346 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1832888884 SRYBRSDIEXXHJE-QFIPXVFZSA-N 466.604 0.819 50 20 JCGD CNc1nsnc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1833073014 GKGKVYVRSMVXFX-UHFFFAOYSA-N 466.612 0.138 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1ccnc1 1833376723 NHHRDIMHKIGLQI-INIZCTEOSA-N 468.562 0.328 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)cn1 1833433928 POWNEUPPSOPBGW-FQEVSTJZSA-N 452.584 0.797 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnoc1C1CC1)CCO2 1834614180 UHDVGMGIYIRZPF-OJLHXUGZSA-N 484.513 0.756 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1834675753 AFAHMFIWIGRQNG-CVEARBPZSA-N 460.417 0.324 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799116 OGEYANWVMSYINX-XZOQPEGZSA-N 497.401 0.307 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cc4ncccn4n3)CC2)CC1 1835543108 LMPCNECJPGVNEQ-UHFFFAOYSA-N 470.578 0.288 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737426 SWGIKMVDXUQSSU-NRFANRHFSA-N 487.605 0.175 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934389 RGSHEYBGYSKPHE-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)oc2ccccc12 1835937497 ZVIHHNVGBIERCP-RUZDIDTESA-N 478.310 0.805 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1836670958 MVSTVGWAULRDIY-ZDUSSCGKSA-N 484.328 0.741 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1837079040 CNXYBKQZPAMXMC-QGZVFWFLSA-N 498.415 0.406 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837146384 JVSACHHAJWRWMQ-NRFANRHFSA-N 478.575 0.147 50 20 JCGD CN(C)c1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)o1 1837388927 KSBGONYTXZRGCB-UHFFFAOYSA-N 485.545 0.665 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3Cc4ccccc4C3)C2)C1 1837463027 YEJOWZTZHASXOI-AREMUKBSSA-N 493.564 0.560 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837582225 JFLRAMOLBYXCFG-ILAWTMEDSA-N 462.547 0.821 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cnn4cccnc34)CC2)CC1 1838309124 GHIXPHLYRUWUFF-UHFFFAOYSA-N 471.562 0.715 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3csnn3)C2)C1 1838527323 NWHLCFRTFOZVBK-FQEVSTJZSA-N 491.482 0.755 50 20 JCGD 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469.498 0.083 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840912983 UOACKYQHDKAFEB-ZPGKAZOCSA-N 487.981 0.512 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1=O 1841915912 TUBLWQVCVXOXEE-HXUWFJFHSA-N 475.354 0.853 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1841924417 JUZXVXLLDZOJQF-INIZCTEOSA-N 465.743 0.316 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2ccnc3c2OCO3)C1)NC(=O)NCc1ccccc1 1844661477 YGBANHFJFPHRHK-UHFFFAOYSA-N 480.525 0.974 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 16128102 PYHLEASSJJEIQG-UHFFFAOYSA-N 482.540 0.289 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1 24537514 IHYGRDACCNPXSQ-YOEHRIQHSA-N 464.500 0.680 50 20 JCGD O=C(COC(=O)[C@H]1C[C@@H](O)CN1C(=O)c1ccc(F)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1 725960863 VZARKHRQEIKZOY-IAGOWNOFSA-N 474.401 0.314 50 20 JCGD O=C(COC(=O)c1sccc1S(=O)(=O)N1CCC(CO)CC1)NNC(=O)c1cccs1 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CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1839967510 OOOZTADRWOBYNG-LRDDRELGSA-N 462.370 0.527 50 20 JCGD CC(C)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1840001183 YBGZBXCZPJOYCM-AREMUKBSSA-N 480.370 0.803 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccccc3)C2)C1 1840149273 KHOKLEFPEZTWFD-NGVNFNDYSA-N 479.961 0.569 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C2)C1 1840187243 OWBFYIIMHZXSQM-DEOSSOPVSA-N 484.557 0.520 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1)C(C)C 1841352650 CPZRVHZXCFABGU-JYJNAYRXSA-N 472.970 0.161 50 20 JCGD CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 9864991 VROXRKISFBALST-UHFFFAOYSA-N 496.615 0.952 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc(F)cc1)c(=O)n2Cc1ccccc1 14052271 IYTDKNFYLYXPFZ-UHFFFAOYSA-N 494.483 0.655 50 20 JCGD COc1ccc(CN2C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2=O)cc1 728342295 LIWDHOQPSNWARP-UZLBHIALSA-N 483.477 0.574 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 729273926 BFMNETLFRQIHKE-CMPLNLGQSA-N 450.439 0.139 50 20 JCGD CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)[C@H]1c1ccc(OC)cc1 729276107 XDCFBOJFTDWEGS-DKSSEZFCSA-N 468.576 0.860 50 20 JCGD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 729284464 VKXSILQFNIYGLU-LJQANCHMSA-N 498.569 0.520 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1 788023324 LJPVYHDVTHTNEX-CYBMUJFWSA-N 462.509 0.443 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)NC(=O)c2ccc(S(=O)(=O)N(C)C)cc2)cc1 811677963 NWPXDZNACDBNDB-OAHLLOKOSA-N 490.538 0.368 50 20 JCGD CCC1(CC)NC(=O)N(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C1=O 913600875 OGSLJABFFDIBDL-UHFFFAOYSA-N 465.532 0.343 50 20 JCGD Cn1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)c2ccccc21 914462776 WHWTWAMZMNNAHW-UHFFFAOYSA-N 455.496 0.374 50 20 JCGD CN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C 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COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CS(=O)(=O)c3ccc(C)cc3)CCO2)C1 1783876868 SKILSDQAXRWKBJ-FXAWDEMLSA-N 458.964 0.852 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccccc1-n1nccn1)CCO2 1783934434 HLERCGFVZZHVNI-QFIPXVFZSA-N 455.519 0.084 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2n1 1783937912 YJISKWACHMKQQJ-QHCPKHFHSA-N 456.547 0.768 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783945981 VHGDNZSKCFZECR-JMERFSKESA-N 466.362 0.990 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)C1 1784069956 CCZICRJUVPYKHO-AINOVGTFSA-N 486.374 0.329 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ncn3)[C@H]2C1)NC(=O)NCc1ccccc1 1784668781 GMOXWDPOBLHYFC-BJLQDIEVSA-N 497.556 0.122 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786978664 ISSIYWMGFKCEBV-VJBMBRPKSA-N 494.353 0.379 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccccc3F)C[C@@H]21)c1ccc(B(O)O)cc1 1786981910 GDPXEAAGJKYWFF-VCOUNFBDSA-N 454.307 0.732 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C[C@@H]21 1788610334 XQDUCVRQDZDXIK-BPXKWBHBSA-N 489.536 0.982 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3C(N)=O)C[C@@H]21 1790961187 LFAFMFBZLBHHBL-MHEUCROKSA-N 453.337 0.947 50 20 JCGD CSc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1791452458 UXJIZLOPTAOOPX-NYVOZVTQSA-N 468.384 0.924 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)cc1 1793010699 BRKILVKHIMTCTJ-GFISCPRKSA-N 461.943 0.786 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CC(=O)NC1=O 1794086645 MAUYTJPXDDRFTL-BTTYYORXSA-N 473.442 0.324 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795115341 YVEXYSNEVFRWEN-HLPPOEQASA-N 478.384 0.637 50 20 JCGD CCn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c2ccccc21 1795734283 BJOXJOVWBCAMCR-UPHUGPLXSA-N 462.315 0.253 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccoc1I 1795937423 UHEYRMGQTZIVCK-QCMRWSPLSA-N 468.675 0.687 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccnnc1O)C2)NC(=O)NCc1ccccc1 1799870010 XPSHHIZVUPXZCU-BCDXTJNWSA-N 467.530 0.780 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)CCBr)C3)C2 1800324782 HPVLMHAQKUHSQL-AFIMGQEJSA-N 497.390 0.997 50 20 JCGD CN(CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)C(=O)OC(C)(C)C 1802132993 LDXDRMQZVVZUNS-RMFSNUHRSA-N 489.378 0.217 50 20 JCGD CC(C)(C)[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803074839 XFZBZGMYJRDNDA-AYOQOUSVSA-N 454.531 0.807 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1804190751 RNISPZDLTODOGV-NRXGSXMXSA-N 456.330 0.876 50 20 JCGD O=C(CCC(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1)N1CCCC1 1806646995 KMIQKTDDPZIQDJ-UHFFFAOYSA-N 455.364 0.614 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807366088 SCOBOTUGZXZPID-QAPCUYQASA-N 466.332 0.288 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807367597 MITDKEIOMTYYNO-YSIASYRMSA-N 457.361 0.195 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810295655 UWYYXBICNLPPGC-XLIONFOSSA-N 481.557 0.562 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1810304194 APBFDCYJINKZBY-QAPCUYQASA-N 466.498 0.353 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810356046 HDSRIFXYSOUCCQ-MUHANLNESA-N 480.330 0.610 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CNC(=O)c2cccs2)[C@@H]1c1cccnc1 1813071926 ZOMYXPJIWYWFLK-VGOFRKELSA-N 486.598 0.952 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)CC2)c1cccc(B(O)O)c1 1815350022 DSUHOPMBWOAGBA-SNVBAGLBSA-N 489.212 0.404 50 20 JCGD CCC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816668579 LBRARBGFJJRIBL-IUCAKERBSA-N 450.912 0.902 50 20 JCGD Cn1cc(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1 1817474201 ARZRYEGVYDHMIE-IBGZPJMESA-N 450.308 0.762 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cccnn3n2)[nH]n1)c1cccc(B(O)O)c1 1817476364 BZTADMUZQXBWRV-LJQANCHMSA-N 459.275 0.752 50 20 JCGD CCOc1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)nn1 1820371215 LBYUCLKIQSNLGJ-SFHVURJKSA-N 464.291 0.898 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1824604719 TXGNYTJGTYVWRH-WDEREUQCSA-N 476.515 0.929 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826092338 ZRQYXFXEEJPHHW-UKRRQHHQSA-N 452.581 0.733 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@@H]1COc3ccccc3O1)CCO2 1831237405 UEPVIAXGYOZXIJ-HOYKHHGWSA-N 490.557 0.046 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1C 1832094471 XHEAGMLMOBEMCJ-XMMPIXPASA-N 476.574 0.376 50 20 JCGD C[C@@H](CN)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549138 GKTKIKXZVAORDS-AVYPCKFXSA-N 462.975 0.170 50 20 JCGD CC(C)(NCCC#N)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834716213 OAAWDAOKFXPNQC-UHFFFAOYSA-N 484.605 0.152 50 20 JCGD CC(C)N[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)C 1834784650 SGGYMDLBFQTDTP-QHCPKHFHSA-N 472.439 0.574 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)nn1C(F)F 1834798261 ACYRNXGADKBLPU-UHFFFAOYSA-N 489.332 0.765 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)COc3ccccc3)CC2)CC1)c1cccc(B(O)O)c1 1834800953 DIOWZAQXNNYBCM-UHFFFAOYSA-N 465.359 0.631 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)n1 1834819419 QNIFZMDJFKBYAX-LJQANCHMSA-N 469.336 0.895 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834821805 ZJXOSFJMYWJFIP-GOSISDBHSA-N 459.341 0.385 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1834825272 WJJJOUKXFDTIFS-GOSISDBHSA-N 457.325 0.521 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1 1835117923 WTEWODTWCFMBHS-RWPZCVJISA-N 482.545 0.089 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835440975 MHXWXXBEMKQWSB-QFBILLFUSA-N 462.385 0.196 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1837375241 OWHVGALSGKROQL-PMUMKWKESA-N 463.373 0.181 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@]3(F)CCCC=C3F)C2)C1 1837461778 AZZHKEUKGFJRKJ-FGZHOGPDSA-N 479.484 0.501 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837869921 VICRBBUHKPYUFI-GOSISDBHSA-N 480.374 0.874 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cc4cn[nH]c4cn3)CC2)CC1 1838356799 YZIYMBOSJFEFHQ-UHFFFAOYSA-N 471.562 0.943 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)nn1 1838758438 IBPKSZQUTWYTEO-HXUWFJFHSA-N 453.616 0.955 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)c(F)c1)CCO2 1839009014 QCODFSZTBMQGJU-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD C[C@@H]1C[C@]1(C)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054355 VOFFHQHGIRSIHN-NGXZDTIWSA-N 487.601 0.835 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1839149334 CECJBAHUNUDXGC-WIEQDCTASA-N 490.985 0.229 50 20 JCGD O=C(c1ccc(Cl)nn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200354 JDAVJKAZJQHDQZ-SWLSCSKDSA-N 451.680 0.891 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nn1 1839201887 MORLPDRCIRNVMX-DYVFJYSZSA-N 462.320 0.794 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccc(F)c34)CCO2)C1 1839620437 LSJJNORUVPHVAP-YWZLYKJASA-N 454.886 0.797 50 20 JCGD O=C(c1nc[nH]n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839801957 ISGAUPQQOULTJE-UZLBHIALSA-N 478.347 0.881 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1839967026 WZOKYNDACGBHJD-GCKMJXCFSA-N 497.390 0.830 50 20 JCGD O=C(CCc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840053260 BWKPMDKDEWVPSS-XMMPIXPASA-N 470.306 0.208 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCc4sccc4C3)C2)C1 1840151325 YNMGGTSCVFDEKG-UTKZUKDTSA-N 472.007 0.816 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1 1840153754 AODFPQWHOOHFIL-UTKZUKDTSA-N 463.922 0.591 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1cccs1 1840374333 VSXJAYFQYJWNJB-AOMKIAJQSA-N 458.345 0.302 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840686994 PSROWKPQOSNCIN-QFIPXVFZSA-N 466.510 0.277 50 20 JCGD Cc1cc(Cl)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840697824 VVAUXEORXWOWTF-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cc(F)c1F)CCO2 1840718304 YAELEHSCFBXNOX-QFIPXVFZSA-N 478.232 0.168 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840908547 NNJIQKYZAGRADP-CKJXQJPGSA-N 477.986 0.736 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)CC2=O)c1 1841009944 SUDIQTDMMYXDKM-KRWDZBQOSA-N 471.558 0.625 50 20 JCGD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1841691691 MWZHHKTWACRCHA-QFBILLFUSA-N 481.594 0.587 50 20 JCGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2ncn3c2CNS(=O)(=O)c2ccccc2-3)C1 1844623660 QFBXBHFFBUIHPJ-AWEZNQCLSA-N 493.973 0.735 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)CCc2noc(-c3ccccc3)n2)C1 1844998016 OQLHJZIXTMMYLJ-UHFFFAOYSA-N 460.299 0.866 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846200306 LCUGNZCQQURULQ-GOSISDBHSA-N 457.336 0.583 50 20 JCGD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 17193640 FZPYEOQWXVMREM-LBPRGKRZSA-N 459.484 0.070 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cn1C 726643977 WIUUDHWLGXRJSS-UHFFFAOYSA-N 457.896 0.055 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)Cc3c[nH]c4ccccc34)cnc21 727099434 WIHXPYCBMUQQHR-UHFFFAOYSA-N 458.276 0.764 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2cn(CCC#N)nc2-c2ccccc2)c(=O)n(C)c1=O 730569393 XXVVRKBEUCDZEP-UHFFFAOYSA-N 452.500 0.499 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccc3nncn3c1)N(S(C)(=O)=O)CC2 749719883 GBPYMULVRQCALL-INIZCTEOSA-N 488.526 0.457 50 20 JCGD CC(=NNC(=O)CNC(=O)c1cccs1)c1ccc(S(=O)(=O)NCCC(=O)O)cc1 750948144 ONSIURYBXUIHIU-UHFFFAOYSA-N 452.514 0.771 50 20 JCGD O=C(COC(=O)c1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)[C@H]1COc2ccccc2O1 756833803 UAMGRDFPVKRNGG-GOSISDBHSA-N 475.479 0.371 50 20 JCGD CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2[N+](=O)[O-])CC1 915076909 ZYQCAEGUWMOAGN-UHFFFAOYSA-N 489.510 0.742 50 20 JCGD CS(=O)(=O)Nc1cccc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 916246509 JORPVASPPVUZOG-UHFFFAOYSA-N 495.583 0.987 50 20 JCGD C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)cn2)CCO1 916392907 PNFAZWCKRSTFSH-AWEZNQCLSA-N 461.548 0.744 50 20 JCGD Cc1cc(/C=C(\C#N)C(=O)OCC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1C[C@H]1CCCO1 916437947 RERCKLJDJFMPNC-KIQQWLQXSA-N 492.554 0.747 50 20 JCGD CCCNC(=O)NNC(=O)C1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1 921042922 UUMWGKWYSMGUFI-UHFFFAOYSA-N 498.562 0.573 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 921073967 JFTRGHRZNOKXFP-UHFFFAOYSA-N 453.546 0.634 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)[C@@H](O)C1 1778360512 GFPHVYWTMUNUBE-QDGJQWLKSA-N 489.997 0.424 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1 1778478216 YPPSJIMSTJVFIY-WGLQLPMYSA-N 464.486 0.307 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)[C@@H]1ON=C(c2ccccc2)O1 1779259409 QXPKHTVGAQLBRE-WWEWDKITSA-N 451.907 0.835 50 20 JCGD Cc1cc(/C=C/C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)no1 1779435081 HIQHTDOTCWIZCY-SJUPYBQOSA-N 453.304 0.504 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CCSC(=N)N)CCO2)C1 1780097057 OIGLUTPAMKMTSU-HXUWFJFHSA-N 479.515 0.980 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)Cn3cccn3)CCO2)C1 1780097073 OSGHMPIQOAYAGK-NRFANRHFSA-N 457.443 0.860 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)CCOC1 1780760862 ACOCXCRVOMOMNS-LGFFLQIISA-N 489.997 0.784 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3nccn13)C2 1782213277 KMSHWUSNIZFXKF-WZONZLPQSA-N 456.547 0.835 50 20 JCGD CSc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1784216592 PAMQDNZIJBFVJY-HSZRJFAPSA-N 454.357 0.775 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786404763 MUPTTYOLIDYDHL-XQLPTFJDSA-N 478.384 0.637 50 20 JCGD COCCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21 1786641264 ADNBCVBHTHQQAH-QSFXBCCZSA-N 479.486 0.776 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788142140 DWEZIXKNDKHGSF-FQEVSTJZSA-N 453.304 0.265 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NO[C@@H](c4ccccc4)C3)[C@H]2C1 1788143190 QBJRIYWHPYVQEU-MMKMLUHNSA-N 471.558 0.857 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C[C@@H]21 1789865693 CFNAUZUREJMLGM-WVPLEHFKSA-N 457.318 0.247 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21 1790176102 NBMPWCNUGUHHBA-YRBFXIGRSA-N 459.616 0.661 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795738841 IDZOIUAPCNZJPV-XEMDLRDOSA-N 451.332 0.576 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(Cl)cc3)CC1)C2)c1cccc(B(O)O)c1 1795740535 FPQYQKZFWKDHON-UPHUGPLXSA-N 468.746 0.955 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)C1 1796188970 HHANBSFRBLDDHQ-RSPOEFSDSA-N 471.363 0.875 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](COC)NC(=O)OC(C)(C)C 1796395115 VGKFYCDEAMPCBK-QRJUGERDSA-N 463.959 0.370 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCCC1)C2)NC(=O)NCc1ccccc1 1799094840 BSVXBZUKBKFMTF-JHDGKUDLSA-N 472.590 0.018 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1799247704 FJIGMWAQIKVQRZ-KUCCMMOJSA-N 479.933 0.957 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncn(C)n1)C2)NC(=O)NCc1ccccc1 1799864732 LVAAYUZGTMRQQE-BCDXTJNWSA-N 454.535 0.413 50 20 JCGD COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c(C#N)c1 1801012428 FVHSWZHOFBUXNU-FEJSZKPUSA-N 457.531 0.072 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1N(C)C 1801012731 XGWLJXMWYBQCPX-FAQVEIGNSA-N 461.563 0.337 50 20 JCGD COc1cccc(CC(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)n1 1806910560 XSHIVIMQABGGAC-UHFFFAOYSA-N 451.332 0.858 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCN2CCOCC2)[C@H]1c1cccnc1 1806957715 YVTWGUIZXOEVTP-WMZHIEFXSA-N 460.579 0.183 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(-n3cccn3)nc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362980 XSQNELWDKVLUPM-YKSBVNFPSA-N 496.336 0.976 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807366093 SDXCUNZQUSWOOE-CTNGQTDRSA-N 466.347 0.243 50 20 JCGD COc1nccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1F 1807371101 PUGMNHBCSBYXDK-UTKZUKDTSA-N 478.289 0.938 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@@H](CNC(=O)Cn2cnnn2)[C@H]1c1cccnc1 1807608497 LNJVSOLKRCAFME-XYJFISCASA-N 492.968 0.906 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808762386 YKHIPGUFEZSAEZ-ZAAXVRCTSA-N 465.514 0.021 50 20 JCGD COCc1oncc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808822356 SLZABECVQVSEGV-FOIQADDNSA-N 479.497 0.848 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)C1 1809973190 YKKAZQXVLXFCLB-GOSISDBHSA-N 450.348 0.739 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@@H]1c1cccnc1 1810134393 PCZUNQMYEFLBFK-DRBYORDMSA-N 456.547 0.295 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)COc2cccnn2)[C@@H]1c1cccnc1 1813390826 GVRVUPDSTDQKBZ-JTSKRJEESA-N 455.519 0.329 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCc3nc[nH]c3C1)CC2)c1ccc(B(O)O)cc1 1815347555 CZPIBQCNSRKKCS-ZFWWWQNUSA-N 465.344 0.577 50 20 JCGD O=C(CCc1cnccn1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362006 XZXUGESKTHDJEJ-OAHLLOKOSA-N 451.317 0.472 50 20 JCGD Cc1nc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)no1 1815870728 YIFMXWLVVKOGHB-OAHLLOKOSA-N 453.463 0.648 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3ccc4c(n3)OCCO4)sc2C1)c1ccc(B(O)O)cc1 1816956755 WMTBAFCIEXJZQM-CQSZACIVSA-N 480.311 0.529 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053715 YHQCYUCNSYPHIQ-FDDCHVKYSA-N 492.385 0.813 50 20 JCGD CN1CC(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CN(C)NC(=O)NCc2ccccc2)CC3)C1 1827272814 XSATVLQVIRUNAA-KRWDZBQOSA-N 485.614 0.963 50 20 JCGD COCCOCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828907536 DXGLWXBVUDUMMV-XXBNENTESA-N 497.976 0.701 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc[n+]([O-])cc2)CC1 1828924490 UZWIMWWFDDQWDT-FQEVSTJZSA-N 452.515 0.866 50 20 JCGD O=C(Cc1c(F)cccc1Cl)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830286543 OHEXJDSHDMGAQC-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)N3CCN(C)CC3)C2)C1 1830543290 PESGKAXPRGYEGW-FUHIMQAGSA-N 475.428 0.110 50 20 JCGD O=C(c1c[nH]c2nccc-2c1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830727908 KMBNDYQOAPRGIC-KUHUBIRLSA-N 457.314 0.838 50 20 JCGD O=C(c1cn2ccc(Cl)cc2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731655 NFTJTZJRDNKIOY-DNVCBOLYSA-N 457.314 0.657 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1833350453 UHCMJUZJWMQBLM-QZTJIDSGSA-N 491.029 0.433 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834821672 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CC(C)n1cnc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1837919446 SRTHCPVDPSMLJQ-UHFFFAOYSA-N 469.351 0.465 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n[nH]1 1837920363 PHSTWSPGELIEBC-UHFFFAOYSA-N 454.336 0.578 50 20 JCGD CN(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cn1 1838196517 MSQRNYFKEJPZRR-CRAIPNDOSA-N 459.316 0.908 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]nnc3C)C2)C1 1838528452 YZOBEJVXYDQIEO-OAQYLSRUSA-N 488.457 0.330 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)CCO2 1840089896 LMPMBMAXBNKPNM-QEEYODRMSA-N 463.959 0.610 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(-c4ccccn4)nc3)C2)C1 1840150295 ISPQAWZXFZSNCZ-JTSKRJEESA-N 475.933 0.862 50 20 JCGD Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1Cl 1840691419 GTNYJAMCOUQEBE-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(O)c(O)c3O)CCO2)C1 1840881621 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Cn1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(C(F)(F)F)c1 1796677620 MEHUVQDKRUXQGB-ZSBFGKGUSA-N 465.237 0.241 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cn2c(Br)cccc2n1 1797573580 UUDJLIQYRVILOL-DDFXLWFNSA-N 471.739 0.900 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797749686 JTZPZDSLULVREA-CCWDJLKJSA-N 496.524 0.162 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1798546553 RRSLPEJDXWXMOD-USGNIVHTSA-N 472.278 0.040 50 20 JCGD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)cn1 1799095064 SLPPCUBBRIFPTQ-IUTQVRIDSA-N 480.569 0.939 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c([N+](=O)[O-])c1 1799404239 IMCBLSZQXVQLOY-MFKICJERSA-N 477.518 0.109 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)C2 1801011701 WAJJVXCHSZBBDV-AVTOCCDISA-N 458.584 0.837 50 20 JCGD 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CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1 1813069673 AJTBBXMKJIXHBC-VGOFRKELSA-N 464.530 0.817 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)C2CCC(O)CC2)[C@H]1c1cccnc1 1813196142 XBJCPFTZVJUEBI-OYMMLTSBSA-N 466.542 0.951 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccn4c(O)nnc34)sc2C1 1816965917 AREUOJGZVSDWOI-JTQLQIEISA-N 493.509 0.430 50 20 JCGD Cc1cc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)nn1C 1817470726 XJTMJAAXGPHWKN-IBGZPJMESA-N 450.308 0.680 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)[nH]n1 1818111069 ZRZWJTKHLOJDTN-WZYBCIAASA-N 456.463 0.644 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnnn2C)[nH]n1 1818111439 KZBKMALFCNQKCQ-ZIFAQYRBSA-N 452.479 0.978 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1820204825 LLDATRAVGXBNQX-XJKSGUPXSA-N 465.344 0.944 50 20 JCGD CN1CCN(C2(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)CCC(=O)NN(C)C)CC4)CC2)CC1 1822721340 OOABHDMRKXBELY-OAHLLOKOSA-N 477.635 0.208 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cccc(B(O)O)c1 1823002172 AOADXGSWCOFDNW-MFKMUULPSA-N 456.102 0.739 50 20 JCGD O=C(O)c1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)ncn1 1825502641 FFMNWVPEOZJKQM-FQEVSTJZSA-N 466.303 0.402 50 20 JCGD O=C(Cc1ccc(O)cn1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1827051931 VUYCHNNLXNEHKD-OAHLLOKOSA-N 452.301 0.392 50 20 JCGD O=C(COc1cccnn1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059567 DBIMBAJCSQAXAI-HXUWFJFHSA-N 452.320 0.469 50 20 JCGD CC(=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548290 ICEMNCGSLBFYNF-UWJYYQICSA-N 451.907 0.627 50 20 JCGD CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1828825843 BNYOGXAVOWTAKU-VWLOTQADSA-N 479.342 0.842 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923605 OHIQKOSXRBXKSK-DNVCBOLYSA-N 479.603 0.599 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1830543112 KEBFNNHUKDNOBG-DJJJIMSYSA-N 470.320 0.911 50 20 JCGD O=C(c1cnc2c(Cl)cccn12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830722871 IAMLOJPJAGYNJP-KXBFYZLASA-N 457.314 0.657 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1cccc(Cl)c1 1830733555 PFBPAHYSXYJDSN-OPYAIIAOSA-N 488.368 0.573 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)C(C)(C)C 1831086294 POEHSXQMYIZRLP-APWZRJJASA-N 462.385 0.779 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3=CCN(C(=O)OC(C)(C)C)C3)CCO2)C1 1831141539 KDYSDJBWTBRNDW-JTSKRJEESA-N 487.981 0.874 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CNC(C)=O)CCO2 1831697218 REYXYNPXGLRVDO-BEFAXECRSA-N 462.385 0.779 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)COc2cccnn2)CC1 1832191369 AGSMPKFGZNCCPS-FQEVSTJZSA-N 452.320 0.469 50 20 JCGD COc1cccc(CCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1833790321 BZKJRYDWGSZSIH-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD CCOCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1834981829 SLZRNYGSAYXSHB-YWZLYKJASA-N 463.959 0.611 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccoc3C(F)(F)F)C2)C1 1835928159 GJDFCDLPPVKQFK-FQEVSTJZSA-N 482.220 0.362 50 20 JCGD O=C(Cc1ccc2ccccc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929163 CXTPGIHCNXPYHD-HHHXNRCGSA-N 488.349 0.832 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836398243 DNVCGFBKINWNJY-OAQYLSRUSA-N 470.206 0.788 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2 1836472618 OXTQFBXHCLYNOR-QYWGDWMGSA-N 477.986 0.736 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921185 JIDABDKUEVVQNH-KRWDZBQOSA-N 481.362 0.269 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)N(C)C(=O)OC(C)(C)C 1839075837 PBBYGXOGXSARTR-HXOBKFHXSA-N 499.609 0.071 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C1)C2 1839738681 CZUJWBPGPRIFBX-AVBTWRTFSA-N 486.928 0.613 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccnc3OC)C2)C1 1839962786 QVEBSJFMKQPTPF-FZKQIMNGSA-N 457.325 0.729 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1 1839964936 JKCMLSYQRWCWES-ZRGWGRIASA-N 462.385 0.921 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1839967410 LPWXNFSCFZNBKJ-YVEFUNNKSA-N 494.433 0.477 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1840151262 XIVBCHLXWJMTCC-AUUYWEPGSA-N 459.952 0.188 50 20 JCGD COc1ccc(F)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187213 MSTIRKRCPOYACY-JOCHJYFZSA-N 466.510 0.277 50 20 JCGD CSc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1840302508 BWJBAYLCYYGISI-DEOSSOPVSA-N 484.383 0.401 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1 1840484112 ZCSIGQWMKYTLEO-KUHUBIRLSA-N 456.337 0.838 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1840715246 VDLSBAZCOBSCPP-NSYGIPOTSA-N 492.536 0.696 50 20 JCGD O=C(c1cn2cc(Br)ccc2n1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011582 SMNPARZXDODSCF-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014361 BANNORVPAPNTDA-FQEVSTJZSA-N 483.374 0.880 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)COc2ccc(O)nn2)C1 1845771536 LOUFCUGNUBBLMN-ZDUSSCGKSA-N 469.926 0.897 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)OCc2cc(=O)n(C)c(=O)n2C)cc1 11285705 KFWSDNJWVWSDBL-MHWRWJLKSA-N 492.492 0.482 50 20 JCGD COc1ccc(CC(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1S(=O)(=O)N1CCOCC1 26689752 NAQAIAAGKPDJMV-UHFFFAOYSA-N 477.495 0.449 50 20 JCGD O=C(NNC(=O)c1ccccc1S(=O)(=O)N1CCCCC1)c1ccc(-n2cnnn2)cc1 109108885 MELROHJWKYCRTF-UHFFFAOYSA-N 455.500 0.912 50 20 JCGD O=C(CSc1nnc(-c2cccs2)n1C1CC1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 728518779 YJIQOVMCTVYTDG-JTQLQIEISA-N 456.575 0.951 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(Br)c(S(N)(=O)=O)c2)n1 728721602 CRFGWRIVWOHAIE-UHFFFAOYSA-N 491.345 0.408 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)n1 728733214 IYNBYFYUGCKNPG-AWEZNQCLSA-N 474.495 0.718 50 20 JCGD COc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1S(=O)(=O)N1CCCC1 728846047 UOGKNAXTTOQLPK-UHFFFAOYSA-N 488.570 0.947 50 20 JCGD CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)Cc1cccnc1 728891751 FIAKQJOUVWOAGE-HXUWFJFHSA-N 462.528 0.936 50 20 JCGD CN(CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C1CCCC1 729622610 QLNGEZBOKVJBAB-UHFFFAOYSA-N 453.565 0.526 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)NCCN=c1ncnc2n(C)[nH]c(Br)c1-2 729625054 LEGSTEXMCGKDJP-UHFFFAOYSA-N 493.322 0.329 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1cc(S(=O)(=O)N2CCCC2)ccc1Br 745992020 RJELJEXGZKOPNB-UHFFFAOYSA-N 461.338 0.920 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C=C(C)C)c(=O)n2Cc1ccccc1 901414849 AHXKBKLHVNNRMI-UHFFFAOYSA-N 454.487 0.168 50 20 JCGD O=C(CN1C(=O)N[C@@]2(CCc3ccccc32)C1=O)NNC(=O)c1csc(N2CCOCC2)n1 912852229 UEKHNRBHEOYLDV-OAQYLSRUSA-N 470.511 0.134 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNC(=O)c2ccccc2I)C[C@H](C)O1 912922026 ZLDPZBNEUWIQET-STQMWFEESA-N 488.326 0.668 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 913466322 XFZAASVPYZPWRW-UHFFFAOYSA-N 468.557 0.293 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccn(C)c(=O)c1)N(S(C)(=O)=O)CC2 913476707 SAPZZYMKMQZEDJ-MRXNPFEDSA-N 478.527 0.113 50 20 JCGD CN(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)o1 914846395 JVRMVUMYOCWMRB-UHFFFAOYSA-N 484.556 0.779 50 20 JCGD COc1ccc([C@@H](CNC(=O)NNC(=O)Cn2nc(C)cc2C)N2CCOCC2)cc1OC 915895713 UHQWXVRDDZVJRZ-GOSISDBHSA-N 460.535 0.921 50 20 JCGD COC(=O)COc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 918279547 WEFQKUIJWIMYLL-UHFFFAOYSA-N 477.495 0.334 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C(=O)C(=O)N3CCOCC3)CC2)N(C)c2ccccc21 919696293 XLVZKWCBFOYDHS-UHFFFAOYSA-N 494.552 0.187 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N(c2cccc(Br)c2)C1)N[C@H]1CCS(=O)(=O)C1 919884852 HONGDXOOILWGQT-PWSUYJOCSA-N 459.322 0.320 50 20 JCGD Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 919886489 UIEFBYDJHRNXNQ-HNNXBMFYSA-N 466.541 0.927 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c2ccccc2c1=O 920238727 JPUQYJATJKRSFH-CYBMUJFWSA-N 450.521 0.345 50 20 JCGD CCN1C(=O)C(=CNNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C(=O)N(CC)C1=S 920977529 CERKVJNMMNDMRO-UHFFFAOYSA-N 453.546 0.051 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)cc1 921105229 MNQLREMYGVCPTM-UHFFFAOYSA-N 466.541 0.679 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1778075852 HYGPQWYVJDIQNB-IGMJJTELSA-N 463.934 0.764 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cn1 1779371243 WQIDURHOLOQNFU-WZONZLPQSA-N 483.529 0.315 50 20 JCGD O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780060041 UJOYBMUHGALWSX-GOSISDBHSA-N 450.293 0.318 50 20 JCGD N#Cc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1Cl 1780191431 AHLHTZYYENKGOQ-JOCHJYFZSA-N 453.691 0.649 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1781380522 NLTQGDKAGZNLNT-FQEVSTJZSA-N 495.411 0.688 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc([N+](=O)[O-])c1OC 1783934305 CYFODPUSCSDMMM-JOCHJYFZSA-N 493.517 0.429 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnc(C(F)(F)F)c1)CCO2 1783935665 BJHLKLXHIQIBHU-LJQANCHMSA-N 457.453 0.917 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cnn(C)c3)C2)C1 1784575574 GWDIETWSTYTEPX-QFIPXVFZSA-N 471.470 0.940 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1785609251 WNJQKGHVEAKGOH-MRFFXTKBSA-N 495.404 0.821 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610478 AYJUMGMIFUEWQL-QBTDHISASA-N 467.530 0.174 50 20 JCGD CSc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1O 1789247151 LQEMXSCKJVHTMG-SNRMKQJTSA-N 470.356 0.701 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(F)cc([N+](=O)[O-])c3)[C@H]2C1 1790132085 NJJRVWZHYSKNBK-NXXSPTCGSA-N 486.460 0.640 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CS(C)(=O)=O)C[C@@H]21 1790957854 AHHPOWGGFOMYDM-LXFSFDBISA-N 453.399 0.820 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C[C@@H]21 1791254024 LVPQLAVYBWQERS-AFIMGQEJSA-N 450.923 0.902 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(Br)cnn3C)C[C@@H]21 1791291007 IDDUWGCGDCUCFL-YDHLFZDLSA-N 485.383 0.149 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1792587017 VUPBKXHDWSWPAS-OWLYRPNTSA-N 451.531 0.942 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)CNC1=O 1794011795 UWTALWQOZODCGE-BTTYYORXSA-N 473.442 0.324 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(-c2ccccn2)nc1 1794259999 ZBDGNHWWMFWTLA-UPHUGPLXSA-N 467.530 0.115 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1N(C)C 1794470960 OKDGMAREPBVMBA-IHBLFXCCSA-N 467.530 0.485 50 20 JCGD Cn1c(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc2ccccc21 1795737671 INBOTERSZSRRDF-NHKMSHSESA-N 461.327 0.304 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)ccc(Cl)c1O)C2)c1cccc(B(O)O)c1 1795739889 NGFXAYYQXACHDU-IVWMJMPLSA-N 479.125 0.896 50 20 JCGD O=C1CN(c2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)n2)CCCN1 1796362014 VPDWWJQUOVUEKI-JGTCGTHISA-N 453.902 0.146 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3cc(Cl)ccc13)C2 1797751554 FYCJBWPYYSPEEW-KSPBDQMDSA-N 483.916 0.732 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)no1 1798205582 VOLGJOWNSXRDNH-KSPBDQMDSA-N 460.399 0.731 50 20 JCGD CCC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)COC1 1799097979 YBZBFVRUUBVCMB-CEQLMSFQSA-N 473.574 0.349 50 20 JCGD Cc1nn2cc(CC(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)nc2s1 1799344748 UVGPQIBJXKCVCI-RDBQEKCUSA-N 460.329 0.922 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2)[C@H](F)Br 1799347472 NPMKHQVSCDUTPV-DJBIQUGXSA-N 493.293 0.465 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](NC(=O)OC)c1ccccc1)C2 1800971379 XFAQINYTYNKGEO-FLXSYLCISA-N 453.923 0.927 50 20 JCGD COc1ccc(F)cc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801012403 XSRQVCOJQITVIE-MFKICJERSA-N 450.511 0.339 50 20 JCGD CCN1CCN(c2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)cc2)CC1 1801876237 CZWJWNRWKKHFMW-YHELAOLJSA-N 464.994 0.631 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CC[C@H](N)C(N)=O)[C@H]1c1cccnc1 1803010098 ZNIYSJGBPIEQLW-DYWXZXKOSA-N 454.369 0.711 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1804373941 NJSCGGATJSAKBF-YRPNKDGESA-N 469.347 0.535 50 20 JCGD O=C(CCNC(=O)c1ccc[nH]1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804460826 LOEPXAZSZMRLOJ-WMZHIEFXSA-N 489.341 0.229 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)CC1 1804585496 ACELZHVHIGHVDY-BCDXTJNWSA-N 457.336 0.676 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368176 ZOJSJFNSOVEBJA-GCJKJVERSA-N 459.315 0.538 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1808712492 ILHAEMXXMBDYRB-APWZRJJASA-N 477.529 0.886 50 20 JCGD Cn1c(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cccc1=O 1810297263 BISKQHHJQLXVCP-IIBYNOLFSA-N 475.509 0.412 50 20 JCGD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn2[nH]cnc(=O)c12 1811310728 MKPYJFATQDCHED-JTSKRJEESA-N 494.556 0.419 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnc2snnc2c1 1811338305 BPIXHZHMVRLYOE-UZLBHIALSA-N 488.338 0.795 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1 1813072689 DLGOYWFOBAQJFG-DQVZHEPVSA-N 451.531 0.964 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CC1 1813073968 MRXIXSNRLYOYLO-YLJYHZDGSA-N 459.547 0.804 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1 1814770444 VMOFYMZBAUYMKR-HTQZYQBOSA-N 455.271 0.563 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361393 DGHIBNSGBBDHAJ-IUODEOHRSA-N 488.375 0.962 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1nccn1)CC2 1817281511 GIYPBKHBQAYDBB-ZVYABZQBSA-N 455.504 0.481 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3nn[nH]c3c2)[nH]n1)c1ccc(B(O)O)cc1 1817474789 GEAOWDXMFQMVNV-IBGZPJMESA-N 459.275 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CSCC(=O)O)CC2 1819800044 JTNVURGGFGALKS-VIFPVBQESA-N 464.529 0.185 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2)n1ccccc1=O 1820128146 GVTHLAWDNLDLCX-CHWSQXEVSA-N 481.538 0.790 50 20 JCGD CNc1nsnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1829756140 SXNJXUVKTKKOPB-JKSUJKDBSA-N 452.364 0.886 50 20 JCGD O=C(CCCC(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832258014 FHFABYDXVQUYND-IBGZPJMESA-N 458.242 0.169 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)ncn3)C2)C1 1832549247 JMHVUAYLHOMBJO-YCRPNKLZSA-N 499.952 0.384 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1832840184 GQIZAHFCGYIOTO-VXKWHMMOSA-N 457.380 0.905 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)CC1)[C@H](O)CCl 1833308500 UNWJMQBFBWNFLM-XLIONFOSSA-N 451.951 0.998 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3C(N)=O)CCO2)C1 1833314880 COTNXMOTPIXSJN-KZULUSFZSA-N 455.309 0.034 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCN3CCCC3)CC2)CC1)c1cccc(B(O)O)c1 1834801459 LOXUHJFKLUEPDI-UHFFFAOYSA-N 456.396 0.038 50 20 JCGD CCC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)n1cccc1 1835928575 RKKKGUGEWRHTDH-URXFXBBRSA-N 469.347 0.279 50 20 JCGD CC1=C(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)CCO1 1836270184 ZSOVNESZCXDYNM-NMWDDECMSA-N 459.503 0.271 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1OC 1836275614 YBIASVNEIZIFMJ-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD Cc1c(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cn2[nH]cnc(=O)c12 1836717691 BHXWZJMHMQCHHT-KRWDZBQOSA-N 465.938 0.543 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836718196 JSAUTCPODGEBOH-MRXNPFEDSA-N 468.963 0.968 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)n1nc(C)ccc1=O)CCO2 1837658992 JMKBAPJAQACEQO-KKSFZXQISA-N 454.955 0.761 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)n1nc(C)ccc1=O)CCO2 1837659278 YDQWTXWWNPTUNO-IERDGZPVSA-N 499.406 0.917 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1ccccc1=O)CCO2 1837691409 PCERBHXRBIQAFO-YZVOILCLSA-N 456.337 0.649 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921441 JVTHJRSFPFNSGB-PKTZIBPZSA-N 498.385 0.734 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(OC4CCOCC4)n3)CCO2)C1 1838355931 XAZXTBGIBKPUQA-WZONZLPQSA-N 497.976 0.963 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1838542544 HXNIUWZMZONCCD-XLIONFOSSA-N 470.910 0.331 50 20 JCGD CN(CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1)C(=O)C(=O)O 1838648171 KBFCWMGVOMWMAK-CQSZACIVSA-N 466.304 0.219 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1839144969 PNOXHKVGBBJIPG-LPHOPBHVSA-N 466.000 0.132 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839203297 HQTCEECEKOZSCN-VBQJREDUSA-N 452.321 0.438 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)c4ncccc34)C2)C1 1840153790 ZJNPCSRJSWNFLR-UWJYYQICSA-N 450.923 0.897 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)ccn1 1840154086 LFWKPIBLVHQDGH-IERDGZPVSA-N 469.922 0.582 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nn(C)c(C)c3Br)C2)C1 1840154588 ZYSPLLBJNSSTCQ-FZKQIMNGSA-N 493.786 0.815 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3ccc(Cl)cc3)C2)C1 1840182743 RUPDMTVMZLQGRS-QFIPXVFZSA-N 480.949 0.352 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)(Cl)Cl)C2)C1 1840186000 VYNVQDSLTPBSJP-HNNXBMFYSA-N 459.758 0.186 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840945565 VATCIUKIIWJPMV-KUHUBIRLSA-N 479.933 0.002 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1841172432 BDLWLNKDBRBKAS-UHFFFAOYSA-N 457.512 0.219 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841352383 MFWFDCFPZIZGJG-HZPDHXFCSA-N 461.868 0.954 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011646 ZXCCMOVPCPOOIM-IBGZPJMESA-N 471.363 0.973 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012689 MHUDNSOZCIYHMD-NRFANRHFSA-N 467.306 0.070 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C1)C2 1843012714 HTFNNXSWBHTLLV-SLFFLAALSA-N 483.374 0.971 50 20 JCGD C=CCOC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1844215309 STKOBKTXDJKZQA-HUUCEWRRSA-N 488.969 0.595 50 20 JCGD CCn1nc(C)c(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1C 727604688 DPXYQOSJPAPZAF-UHFFFAOYSA-N 464.548 0.685 50 20 JCGD COCCNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)Cc2cccnc2)c1 728892668 BSFXMPZMGUKCJT-UHFFFAOYSA-N 471.333 0.773 50 20 JCGD N#Cc1cccc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c1 728946690 RKCWXFXJSRKMSI-UHFFFAOYSA-N 457.516 0.049 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)NC)c2)cc1 747406956 MPJIYGQWCRJQPP-CYBMUJFWSA-N 457.530 0.770 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc3c(c1)COC3)c(=O)n2Cc1ccccc1 747416117 MWIRKWFNVQARIR-UHFFFAOYSA-N 488.504 0.919 50 20 JCGD CN(CCCC(=O)NNC(=O)CNC(=O)c1cccs1)S(=O)(=O)c1ccc(F)cc1 751209489 QUYSYXQPJDRNMO-UHFFFAOYSA-N 456.521 0.865 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCN(C(C)=O)CC3)cc2)c1 825791199 BVUWYFYETSIION-UHFFFAOYSA-N 489.554 0.421 50 20 JCGD CCN1CCC[C@H]1CNC(=S)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 884086669 DYPYSOUMJWVPJO-SFHVURJKSA-N 483.660 0.620 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 913155983 NHOVEBDQSNMIHO-BZUAXINKSA-N 457.516 0.330 50 20 JCGD CCN(CC)C(=O)N1CCC(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1 915057950 LXDFJMBRKZZBCQ-UHFFFAOYSA-N 467.592 0.937 50 20 JCGD Cc1[nH]nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1Br 917501287 MSRLWKVQQDCZRD-UHFFFAOYSA-N 472.321 0.576 50 20 JCGD CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)n[nH]c1C 917717914 NIKNMJZDWIVMOV-UHFFFAOYSA-N 499.571 0.693 50 20 JCGD COc1cccc(-n2c(C)nnc2SCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919885005 MFFDRXLUOFRBCB-GFCCVEGCSA-N 454.534 0.194 50 20 JCGD CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919885476 PIBXCQQUJIBDAE-SJLPKXTDSA-N 482.584 0.660 50 20 JCGD O=C(NNC(=O)/C(=C\c1cccs1)n1nnnc1-c1ccccc1)N[C@@H]1CCS(=O)(=O)C1 920744952 HHMCIZSINSWRRD-DSQDWWTGSA-N 473.540 0.917 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1Cc2ccccc2CN1 1778032501 STZWWGNRLGFYSE-JQYIIUTOSA-N 477.370 0.208 50 20 JCGD Cc1ccn2c(=O)c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@@H](O)CCl)C4)cnc2c1 1778689444 LXOIZTDGSKMLET-GSHUGGBRSA-N 462.934 0.730 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1778978094 CQKAGOKPTBJFRG-CJFMBICVSA-N 487.601 0.736 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnnc3O)C2)C1 1779917783 YVSQXVWCHVFMJL-OAQYLSRUSA-N 471.426 0.773 50 20 JCGD C[C@H](NC=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1781252405 NXFGTBPTIQWGIB-VPWXQRGCSA-N 452.349 0.957 50 20 JCGD CCN(CC)C[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781501728 GSRXOTQJEGWVTL-SNYIIPAISA-N 459.396 0.472 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1782668129 PPQXKIWXPVYYFA-IXKGQPNPSA-N 495.540 0.164 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1782850367 MNQAJGLAVGAOPT-RBZFPXEDSA-N 486.495 0.346 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc([N+](=O)[O-])c3)[C@H]2C1 1783438578 WLZCZLQHAWFDFE-YSSFQJQWSA-N 482.497 0.429 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1783614873 GIWCLKAXTYAQGW-FAPUVCABSA-N 475.970 0.440 50 20 JCGD O=C(Cc1ccc(Cl)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1783816207 KJHAREFSZHOGPT-MDKPJZGXSA-N 474.725 0.995 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)C1 1783932924 KQEZYMSAIZRSFE-YZZKKUAISA-N 466.579 0.559 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](N)c1cccc(Cl)c1)CCO2 1783934063 VVGGEIILIMUYLY-PZJWPPBQSA-N 451.955 0.543 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(OC(F)F)cn1 1785743159 SLXYEGHNBMYXSU-FNHZYXHNSA-N 475.257 0.270 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4cnccc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786979891 XQICMCXULKYJSC-TZYHBYERSA-N 459.311 0.822 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cn1 1786984665 WVSDAJOISGBKNM-VDGAXYAQSA-N 454.336 0.225 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(N2CCOCC2)cc1 1787545748 USVBPKIDIWLMHP-OYDLWJJNSA-N 493.369 0.110 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4ccnc34)C[C@@H]21 1788611413 ZROOBLMVPSJJTD-JVPBZIDWSA-N 463.498 0.240 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)c([N+](=O)[O-])c3)[C@H]2C1 1790022881 MXPISECDHHHSSP-AXHNFQJDSA-N 484.469 0.206 50 20 JCGD COc1ccccc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790950585 CAXNZZALJFMKSF-VCOUNFBDSA-N 452.316 0.211 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)ccnc3Cl)C[C@@H]21 1791288785 UXCSYLTUNMXSMZ-YDHLFZDLSA-N 455.918 0.840 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1792886013 UDOVHFKCZMLMTO-XFMPKHEZSA-N 464.357 0.247 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1795964676 XUQVEKUNXVACJR-XEMDLRDOSA-N 451.332 0.576 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(=O)OC(C)(C)C)C1CC1 1796360483 MJYRMORDJFTAJJ-JSJNYSNDSA-N 481.594 0.252 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3CN1)C2 1796440578 SAJFYKBEILGTDW-NXDUQTEYSA-N 478.553 0.425 50 20 JCGD COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797750973 XZWDKHYFRKALJR-FAQVEIGNSA-N 467.526 0.530 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CN(Cc2ccccc2)CCO1 1797853333 DEYTYRNWMAPYLT-LRSLUSHPSA-N 471.602 0.899 50 20 JCGD CC(=O)NCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1800537916 JAHKPBWQIVEEFC-IVSAIRAKSA-N 460.959 0.234 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1coc([Si](C)(C)C)c1)C2 1801011513 MIBNQBXTTBADKJ-CWPLJXCYSA-N 450.612 0.401 50 20 JCGD COc1cccc(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807369328 GQYWDFLDTYHZOH-NTKDMRAZSA-N 474.326 0.727 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808416064 DBVLCHVJXGWRST-ZXTBTXPSSA-N 467.530 0.746 50 20 JCGD COc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1810299532 SIVDPPRLLAACLI-MGPUTAFESA-N 476.497 0.512 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810304937 HQBZKZQIFNTUDP-RILKCQEDSA-N 465.514 0.440 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(C(=O)CNC(=N)N)[C@H]1c1cccnc1 1811362128 WYOJQXSWAHFKMQ-YWZLYKJASA-N 483.485 0.718 50 20 JCGD CC(C)(C)n1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1 1811552701 NWHBTXFNHSPCJH-NQIIRXRSSA-N 476.346 0.741 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1C 1813069228 WGDQMKBNLAGZLI-JPYJTQIMSA-N 455.563 0.745 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@H]1c1cccnc1 1813072371 BCUBGUNTLUODRC-JPYJTQIMSA-N 458.563 0.473 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1816015390 VJZMXSANNSLWTN-HNAYVOBHSA-N 450.308 0.928 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nc2ncccn2n1 1818617804 SNFAOAVJRAZDGK-INIZCTEOSA-N 460.263 0.147 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N1CCN(C)CC1 1822415599 LVMVHJJJHIGWGO-FUHWJXTLSA-N 462.599 0.411 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=N/O[C@@H]1CCCCO1)CC2 1826088069 QXBNQEGKDCRJIZ-LIFUKRKRSA-N 466.564 0.957 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)CCO2 1832360455 UKDZZTPPDRNFSP-SGXKBVARSA-N 471.982 0.488 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn(C)c3C(F)(F)F)CCO2)C1 1833329586 FUTBNWKQVGQDJP-SUMWQHHRSA-N 468.860 0.763 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C(F)(F)c3ccco3)CC2)CC1)c1ccc(B(O)O)cc1 1834799190 PXKBADZHVINXTI-UHFFFAOYSA-N 475.301 0.937 50 20 JCGD Cc1ccc2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)sc2c1 1835935359 PIWZNGCLFACOTO-DEOSSOPVSA-N 495.366 0.668 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cc(Cl)ncn3)CC2)CC1 1836027497 MBYYVQBGEIHGPE-UHFFFAOYSA-N 486.964 0.628 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460077 SMCJMTXKEGPCQB-RUZDIDTESA-N 497.552 0.694 50 20 JCGD CCc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1837725172 FMEJFGQUPCNPOO-FQEVSTJZSA-N 453.565 0.149 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1 1838394731 QWEAIDDLHKCOOM-UHFFFAOYSA-N 485.501 0.847 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838394801 YPJMJLSSAQWFEO-FYWRMAATSA-N 472.546 0.337 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1 1838479775 DQMFRBTVZXXCFO-XIKOKIGWSA-N 456.293 0.664 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CC2)CC1 1838680083 BXHYATOUYOYFNM-HXUWFJFHSA-N 499.609 0.201 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(OC(F)F)cc1)CCO2 1839331301 YVFOTMODVFJQPL-QHCPKHFHSA-N 490.268 0.352 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C(N)=O)CCO2)C1 1839349123 FHXXKEDNYOTMSS-XOBRGWDASA-N 468.348 0.887 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)Oc1ccccc1 1839748113 XDDRESKTHOGDKE-BVZFJXPGSA-N 497.552 0.613 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(O)C(F)(F)F)C2)C1 1839962538 JLJZTXPWMZEVJC-GLQYFDAESA-N 461.275 0.930 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C#N)cc(OC)c3)C2)C1 1840153980 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C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn(C)c3=O)C2)C1 1830536128 YMIGOOKEHWUIIE-LIRRHRJNSA-N 456.337 0.486 50 20 JCGD O=C(Cc1cccc2ncccc12)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831349921 IMKNFZRIDDGROB-SANMLTNESA-N 489.337 0.227 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnsn3)C2)C1 1832549230 INFNATWCOKAARM-DJJJIMSYSA-N 489.982 0.740 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cn1 1833435440 XXSTUCCUURNDLF-PBHICJAKSA-N 461.288 0.636 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccn3)CCO2)C1 1833976287 OFLVSJFVYCULFW-QFIPXVFZSA-N 485.453 0.694 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460078 SMCJMTXKEGPCQB-VWLOTQADSA-N 497.552 0.694 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460086 TZSXECFWNBKFAW-MZNJEOGPSA-N 482.541 0.029 50 20 JCGD Cc1c(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cnn1C 1837543434 UVNUPBYHFVYUDV-UHFFFAOYSA-N 454.336 0.334 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3csc(N)n3)CC2)CC1 1837890789 FXYPUCAXDMWROL-UHFFFAOYSA-N 473.559 0.650 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838499052 MVIUOPBOLWKTMS-VBKZILBWSA-N 494.346 0.191 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1C(F)(F)F)CCO2 1838895640 LSZVDWASXBCSLY-QFIPXVFZSA-N 492.259 0.769 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)c1cccc(Br)c1)CCO2 1839054708 JQMRFSIDRYJKBN-JTDSTZFVSA-N 491.766 0.539 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)no1 1839154036 ZKUKNCIZAOYLSO-RBUKOAKNSA-N 477.345 0.406 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622598 LMKXNNAFSDWYEC-DYESRHJHSA-N 498.422 0.962 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1839879396 ONSNLRUWIUDIBN-JLCFBVMHSA-N 492.485 0.115 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1839965544 BTHZHNHASMEFBT-YWZLYKJASA-N 496.362 0.575 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1840029531 ITAWAZPFBJYTFD-WMLDXEAASA-N 450.399 0.275 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)OCCO4)C2)C1 1840152721 RBLZRPHPLGEYLI-HRAATJIYSA-N 454.907 0.782 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COCCNC(=O)OC(C)(C)C)C2)C1 1840154981 LZIOIKQYWWLYEV-IIBYNOLFSA-N 493.985 0.238 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)nc4n[nH]cc34)C2)C1 1840183896 HEBMDNDFTNLXBC-NRFANRHFSA-N 493.952 0.054 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846297811 HMOXVMFZTHMQQZ-LJQANCHMSA-N 471.363 0.877 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1cc(Cl)ccc1Cl)C(=O)NNC(=O)C(=O)NC1CC1 10215601 FKUNYXICYPWYCV-GFCCVEGCSA-N 483.399 0.819 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1 21191505 RPZNZZGLVZFZPC-QAPCUYQASA-N 495.941 0.861 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CCOc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 726373279 XAXRSVUOZMAFDC-UHFFFAOYSA-N 473.511 0.684 50 20 JCGD O=C(NNC(=O)c1cc(I)ccc1I)C(=O)NC1CC1 727673274 ZADZGNHNVKJCRF-UHFFFAOYSA-N 499.046 0.935 50 20 JCGD Cc1ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1S(=O)(=O)NCc1ccccc1 729275761 RKXVISAFTQEBTH-AWEZNQCLSA-N 468.557 0.172 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cn(Cc2ccccc2)cn1)C(=O)NNC(=O)c1cnn[nH]1 730546636 GCVFECLQBKSMFY-INIZCTEOSA-N 454.491 0.947 50 20 JCGD CC1CCC(N2C[C@H](C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)CC1 731386115 VOESXEPUZRGWSV-LEPAWZOPSA-N 459.499 0.944 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1)[C@@H]1Cc2ccccc2O1 748340696 BZDRYKWRWBAUAV-SFHVURJKSA-N 475.483 0.646 50 20 JCGD COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1 749019059 UPBPDIASLZQXOS-UHFFFAOYSA-N 478.513 0.849 50 20 JCGD O=C(NNC(=O)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12)c1ccccc1O 754678588 ZSRHVQSUMIMXDG-UHFFFAOYSA-N 472.479 0.742 50 20 JCGD Cn1cccc1C(=O)NNC(=O)CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21 770264412 AASOROIVZDOICM-UHFFFAOYSA-N 461.500 0.569 50 20 JCGD Cc1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1S(=O)(=O)N1CCOCC1 770415015 KJKGCXLIKMUZOB-UHFFFAOYSA-N 461.496 0.862 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc3c(c2)CCCC(=O)N3)c1 917719909 OXUXSIUBZRXESV-UHFFFAOYSA-N 466.541 0.835 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2c(C)nc3ccccn23)cc1[C@@]1(C)NC(=O)NC1=O 917721440 YSMGVEGBACBZRU-HXUWFJFHSA-N 472.483 0.329 50 20 JCGD Cc1c(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)c3ccc(C(N)=O)o3)CC2)cc(C#N)n1C 918567844 APEMCXXMPGGDOA-OQLLNIDSSA-N 456.484 0.337 50 20 JCGD O=C(NNC(=O)C1CCN(C(=O)CCOc2ccccc2)CC1)N[C@@H]1CCS(=O)(=O)C1 1318048823 KROXWAGZPHXXSF-MRXNPFEDSA-N 452.533 0.212 50 20 JCGD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)C1CCN(c2ncccn2)CC1 1318264621 BUZYLNRGSHMRHI-UHFFFAOYSA-N 453.546 0.415 50 20 JCGD Cn1c(=O)n(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c2ccccc21 1778784138 QNFSTQFSPKECJY-JBYIUTFZSA-N 464.950 0.454 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779029126 LMQVWAXZENPTOC-ZYLNGJIFSA-N 479.537 0.941 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)C2 1782178143 IFZIZHCTBVFSHP-XKGFGPFHSA-N 469.970 0.225 50 20 JCGD COC(=O)N(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)Cc1ccccc1 1783687371 UPIGWUKYSJYHPZ-DYESRHJHSA-N 453.923 0.685 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)CCO2)C1 1783879747 XODNSBRZLUMCDQ-PZPWOCDFSA-N 491.969 0.527 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1784209862 YUDFFUPEBAUQFR-NDXORKPFSA-N 468.558 0.856 50 20 JCGD COc1ccc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)[nH]c2c1 1786983662 ZXDUFXDAQFBHOU-NYDSKATKSA-N 477.326 0.763 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)on3)C[C@@H]21 1787508418 WTAICGQPINSXFW-SKFHZHBLSA-N 456.503 0.639 50 20 JCGD COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610319 WXRWEPOVSUISPV-YSSFQJQWSA-N 453.499 0.601 50 20 JCGD COC[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724629 DHWGCVNRRCQJAP-VMXMFDLUSA-N 475.590 0.595 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(NC(=O)C2CC2)cc1 1789990253 ZJKMRDKNLDMHNK-VJBMBRPKSA-N 491.353 0.622 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CS(C)(=O)=O)C[C@@H]21 1790957851 AHHPOWGGFOMYDM-FQKPHLNHSA-N 453.399 0.820 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCS3(=O)=O)C[C@@H]21 1790963399 ACZSRSVZGLKXCW-SBJFKYEJSA-N 451.383 0.717 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)CC2=O)c1 1792488852 NQJQFYWMVVWXOA-CMCXCUNFSA-N 491.353 0.680 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1793249602 ULTWPYHQCDFENE-ZCQATVAHSA-N 476.486 0.638 50 20 JCGD 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COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)[C@@H](C)O2 1798584143 DJVJFLWPPXHWIO-BWOYXGKQSA-N 451.907 0.863 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2 1799816114 NNCCIESKVNFQIP-FZDIXFNVSA-N 461.538 0.955 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCN(C)C2 1800125909 GDFUXAICSBAZBD-ZXFNITATSA-N 468.396 0.953 50 20 JCGD C[C@H](NC=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800436047 JSSJVTUPFPNNMO-JFMONLCZSA-N 452.349 0.717 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366025 RKFFGBJIGFPCQE-BAGYTPMASA-N 466.347 0.386 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)COc2cccnc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369136 BCJZFJXHNFXNKD-XXBNENTESA-N 460.299 0.555 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1 1809531167 COOUGKXJBSMTGF-UTKZUKDTSA-N 460.535 0.303 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(CO)on2)[C@H]1c1cccnc1 1810303751 YASAXKJHFPEKAY-KUHUBIRLSA-N 465.470 0.194 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccccc2C(N)=O)[C@@H]1c1cccnc1 1810305014 IOUFUOPNWPIQBP-HRAATJIYSA-N 487.520 0.812 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1 1813072376 BCUBGUNTLUODRC-WZONZLPQSA-N 458.563 0.473 50 20 JCGD O=C(C/N=C/c1ccco1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344287 RGQKTZREALRTEJ-QHBIDGPYSA-N 452.301 0.761 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3[nH]ncc3c1)CC2)c1ccc(B(O)O)cc1 1815344398 XLJNEFIGCYWGHZ-HNNXBMFYSA-N 462.300 0.634 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1ON=C(c3ccccc3)O1)CC2)c1cccc(B(O)O)c1 1815356565 JJDDYPDBKZXHJR-AOMKIAJQSA-N 492.322 0.783 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCS(=O)(=O)CC2)n[nH]1 1815670623 DEXMXARRGHOFIH-INIZCTEOSA-N 471.656 0.984 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3[nH]nc4ncccc34)sc2C1)c1cccc(B(O)O)c1 1816870799 IHTFOPLTPHERIL-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3ncccc23)[nH]n1)c1cccc(B(O)O)c1 1817475207 MSCIUUARRIOSGX-IBGZPJMESA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)/C=C\C(=O)NC3CC3)sc2C1 1819529031 DUVKZFCDMNVVGU-FJOGCWAESA-N 469.527 0.202 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnncc2C(=O)O)n[nH]1 1819764245 ZLPUVKPOAZIMMY-HNNXBMFYSA-N 458.479 0.577 50 20 JCGD CCOC(=O)C1(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)CC1 1821803713 RBVOLCPAJCRTPE-QGZVFWFLSA-N 454.292 0.739 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)C[C@H]2NC(=O)NC2=O)CC1 1825072476 ORHGNBSRVWOBAG-LPQHRBSRSA-N 485.545 0.338 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1825730677 OHKZQZAULTULGK-HXUWFJFHSA-N 454.336 0.656 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CC[C@H](N)C(N)=O)CC1 1826933504 ZOMXUELYWIQYCK-GCOGVYCUSA-N 473.578 0.333 50 20 JCGD O=C1CC[C@@H](C(=O)N2CCN(C(=O)OCc3ccccc3)[C@@]3(CCN(C(=O)[C@H](O)CCl)C3)C2)N1 1828877664 ILUDUEGNZVODLN-YZZKKUAISA-N 492.960 0.317 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924194 MBEJTTUTHBMBKZ-GUCAUAJOSA-N 456.547 0.958 50 20 JCGD N=C1NCCN1CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829051949 GBPDMHWGAOWYOF-GCJKJVERSA-N 494.955 0.813 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1 1831286516 XZWMBUXJQQNZGN-ZWKOTPCHSA-N 456.609 0.556 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1831609494 PFGNXPAATWAMKB-GKULRIGTSA-N 476.480 0.840 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1831866822 YRRAUHRNRFKVSR-XXBNENTESA-N 460.336 0.216 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@H]1CCc2ccoc2C1 1833364921 MWAGSCSIEHQABY-IBGZPJMESA-N 479.386 0.950 50 20 JCGD Cc1nc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1834079006 IDFJDAGKZCPTFR-HXUWFJFHSA-N 453.565 0.203 50 20 JCGD Cn1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n1 1834241338 BKWKIOHBZAWUQI-KKSFZXQISA-N 485.969 0.622 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1834734713 AIWCQVFKEDSNAC-BEFAXECRSA-N 450.411 0.387 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCN3CCCCC3)CC2)CC1)c1cccc(B(O)O)c1 1834800955 DLBWFYTYAFZZLQ-UHFFFAOYSA-N 470.423 0.428 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3nc4ccccn4n3)CC2)CC1 1834970086 JGJQWTSMECGRRV-UHFFFAOYSA-N 470.578 0.288 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n(C)n1 1835954068 CESXVGIXWXOKKV-UHFFFAOYSA-N 467.379 0.161 50 20 JCGD O=C(Cn1cc(Cl)cn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1835974955 TWHJDIGRCSQPSU-HIFRSBDPSA-N 453.696 0.683 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](N)Cc1cccnc1)CCO2 1836505769 CWTKIXMVVDDTMG-QOKNQOGYSA-N 455.353 0.191 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H](C)O1)CCO2 1836605227 LBEIQNMDQZJKID-CTDGXUKLSA-N 461.519 0.144 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CC(=O)NC3=O)CC2)CC1 1837077581 HBTGAKPPUFMWEE-HNNXBMFYSA-N 473.368 0.710 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1837479719 QCNUDCGVLFLBJA-KDOFPFPSSA-N 456.341 0.518 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)nn1 1838757931 JFHGNLJERQPDCT-GUYCJALGSA-N 462.320 0.794 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1839149948 XDCMVOHLGKIVKG-MSOLQXFVSA-N 454.420 0.728 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1839387453 KGQRQRVQCSCJAQ-OXJNMPFZSA-N 475.615 0.137 50 20 JCGD C[C@H](NC=O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1839802376 UZPQWCVSZMZRFD-MDKPJZGXSA-N 482.375 0.584 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCS3(=O)=O)C2)C1 1839967049 YEMPNXTZAKUDFC-GRDNDAEWSA-N 467.382 0.194 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4nc[nH]c34)C2)C1 1840032742 JCTPIGBKGXYRKH-XIKOKIGWSA-N 452.309 0.811 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(O)c3)CCO2)C1 1840060967 VEHZYHCKBAOLAR-HTAPYJJXSA-N 498.964 0.989 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4[nH]ccc4s3)C2)C1 1840184460 NYWXDCKLTXMLPT-OAQYLSRUSA-N 463.560 0.672 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CC3(CCCN3C(=O)CCBr)C2)N1 1842639071 BIIBGLDMBPXPEM-QWHCGFSZSA-N 473.393 0.155 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc1 1843014901 NURKIGDDKJSBBM-UHFFFAOYSA-N 470.356 0.220 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2 1844265024 LRNJMRVUGJJSAP-NSHDSACASA-N 477.447 0.659 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)CC1 1847303975 KOPWIBVCOXFNCN-ROUUACIJSA-N 457.336 0.487 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c1c(C)noc1C 19610470 CXTNAIUVFKVWOF-UHFFFAOYSA-N 474.879 0.236 50 20 JCGD O=C(NNC(=O)c1cnc2n(c1=O)CCS2)c1cccc(S(=O)(=O)N2CCCCC2)c1 29490248 NDSJAMYIVJZPCJ-UHFFFAOYSA-N 463.541 0.598 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)N3CCN(C)CC3)CC2)c1C 106282319 YMYUVLXORNQCAM-UQRWVXEISA-N 492.646 0.856 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccccc1OCCN1CCOCC1 726247291 INNMBGYRTSYYJJ-UHFFFAOYSA-N 461.544 0.720 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1 727942845 APLIRTNMBMHAEJ-QGZVFWFLSA-N 464.500 0.680 50 20 JCGD O=C(COC(=O)C1CCN(C(=O)COc2ccccc2)CC1)NNC(=O)[C@H]1COc2ccccc2O1 728324011 OIIHKKHDSNQKSJ-OAQYLSRUSA-N 497.504 0.835 50 20 JCGD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)C1 728367840 AINPLPMPVJNRHK-FMKPAKJESA-N 457.574 0.549 50 20 JCGD COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc(C(=O)NCC(=O)O)cc2)c1 728508788 ZROOESAQKKXGJH-UHFFFAOYSA-N 486.300 0.895 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3c(c2)S(=O)(=O)N(C(C)C)C3=O)n1 728733052 PFQRKUMKMHADOW-UHFFFAOYSA-N 480.524 0.551 50 20 JCGD Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)C2=O)c1 730767947 UMFRRENCMIBBDB-KRWDZBQOSA-N 462.466 0.908 50 20 JCGD CON(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 746250143 LXSXFXIHEIKGSC-QGZVFWFLSA-N 479.467 0.013 50 20 JCGD Cc1nn(C)c(C)c1[C@H](C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 746760508 VRNXONDONOCKEO-HNNXBMFYSA-N 477.587 0.942 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1[C@@]1(C)NC(=O)NC1=O 748214852 LGABVHLGVKTXEG-OXJNMPFZSA-N 460.468 0.063 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1nn(-c2ccccc2)cc1O 748466211 WTKXEQBZUNKNNG-UHFFFAOYSA-N 478.513 0.656 50 20 JCGD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2 807137334 IGNNFCMQMULTTR-TZMCWYRMSA-N 456.590 0.853 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccccc1 848374493 XXNLAAFPERUVEB-UHFFFAOYSA-N 470.301 0.732 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2cccs2)cc1 849119403 UNHRBPUYJLFMHU-UHFFFAOYSA-N 468.513 0.379 50 20 JCGD O=C(NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1csc(N2CCOCC2)n1 892845708 FSSOUZWDRXFHKV-GOEBONIOSA-N 479.559 0.723 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c2ccccc2c1=O 915190912 RWFVGAKXMBHPKD-OAHLLOKOSA-N 469.523 0.795 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)cc1 915880392 LGNKTXCURMBWGK-OAHLLOKOSA-N 482.540 0.627 50 20 JCGD CN(C)[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Cc1ccccc1 915901402 SJMSXUAXQKVUPQ-HXUWFJFHSA-N 489.598 0.824 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 919745090 SMFUZGWXYIPFOZ-LLVKDONJSA-N 474.948 0.840 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCNC(=O)c2ccc(F)cc2)cc1 919916478 MWTARNRYWNGSAZ-UHFFFAOYSA-N 465.507 0.515 50 20 JCGD CCOC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1I 920402283 RJQRSDSLZBHAST-UHFFFAOYSA-N 483.284 0.703 50 20 JCGD CC(C)(C)NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)CN2CCCC2=O)c1 920435216 GFINHSCTGUVQAE-UHFFFAOYSA-N 475.365 0.909 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc(O)nc2O)C1 1778006411 IOXNQLHBLXVLNK-GULRJVMGSA-N 485.501 0.149 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1778951177 RLIDAVKWXHPRKO-GXZWQRSESA-N 490.001 0.656 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ncc1[N+](=O)[O-] 1779030156 HCJVIWPTGYORLJ-NRFANRHFSA-N 469.458 0.054 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032312 NDDYXANMGGXFSH-MWTRTKDXSA-N 452.515 0.629 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779035459 HWFNSCOGOBIKEN-HXOBKFHXSA-N 490.561 0.432 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(O)no2)C1 1779803373 OUZHYIXDSLPOGF-GCVSMSDNSA-N 458.475 0.642 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1cccc(Cl)c1 1780929458 NOQNYBDGIXKCTG-MBOZVWFJSA-N 458.342 0.947 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(OCF)cn1)C2 1782209391 LPBDEZLYYHAZFD-IIBYNOLFSA-N 466.514 0.283 50 20 JCGD COc1ccc([C@H]2C[C@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1784429218 DMLGXSBKGTYORD-IZFXNUPESA-N 478.354 0.772 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC(F)F)cn3)C[C@@H]21)c1cccc(B(O)O)c1 1786984627 SETSEIBJBSJNIF-FNHZYXHNSA-N 475.257 0.270 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c(C)n1 1788611234 PORRIJJXDDEMRQ-NYVOZVTQSA-N 480.569 0.923 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COCCO)C[C@@H]21 1789221778 DFMDQZMMECGMPT-FNHZYXHNSA-N 465.459 0.122 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1791071094 ITMKRCVUXVAPRI-TXPCXHQGSA-N 471.982 0.965 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c(OC)c1 1791293732 GBZRNWUUHATRBD-VCOUNFBDSA-N 490.601 0.989 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793595137 LQPWMHOWRAUEDT-HNJRGHQBSA-N 487.362 0.039 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCCNC(=O)C2)n1 1794506420 AMJZIIPCFCXVSZ-QOIOWGMHSA-N 463.966 0.629 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccc(Cl)cc3)[nH]n1)C2)c1ccc(B(O)O)cc1 1795735225 QMEREFVUPJOTCP-FAQVEIGNSA-N 494.744 0.927 50 20 JCGD CC(C)Oc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1C#N 1795736693 BCRQYTOZLFUUGE-JHDGKUDLSA-N 477.326 0.542 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798440127 CXFMIMBBHAHWHI-BJWYYQGGSA-N 464.526 0.966 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCNC(=O)OC(C)(C)C 1799354465 RIDMOPQKGDVHHH-UXXRCYHCSA-N 478.384 0.635 50 20 JCGD CC(=O)Nc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)ccc1C 1799713833 IDNQFXYEVYZHTL-HATOLVCRSA-N 465.315 0.150 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1800710368 FUPQWGDJBMCDQF-CKBPBPHLSA-N 477.961 0.915 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(c1)NC(=O)CS3)C2 1800979717 WPEIJLGNPKABNM-ZWUHOBOKSA-N 454.936 0.583 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSCC(=O)O 1801021244 YUDZJBPJTJBHLJ-DBWKPXFBSA-N 481.483 0.541 50 20 JCGD Cc1nnc(CCC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1 1804558303 ALLSJCYJTSNROX-AVRDEDQJSA-N 479.371 0.874 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377267 ZUUKAMSWXIHWJG-OFNKIYASSA-N 496.336 0.976 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CN2CCOC2=O)[C@@H]1c1cccnc1 1808410749 WTTQOCSGEUACSY-YQNFXTCNSA-N 481.513 0.674 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)n2cnnn2)[C@H]1c1cccnc1 1808416303 LLUHHDDKIGYGGN-FOGVZHARSA-N 478.517 0.469 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1)[C@H](F)Br 1808662614 NINODAKLAPKHRD-BPNCWPANSA-N 479.270 0.218 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CNC(=O)OC(C)(C)C)[C@H]1c1cccnc1 1813074350 PSYXZFUUXIJTML-UTKZUKDTSA-N 476.578 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H]2CCCOC2)[C@H]1c1cccnc1 1814157409 PMDDHECFSBZDSE-FUHIMQAGSA-N 452.515 0.826 50 20 JCGD COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3n[nH]c4c3CS(=O)(=O)C4)sc2C1 1815854861 WVOGKVKUIXQXRX-WPRPVWTQSA-N 473.964 0.774 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=N/O[C@H]2CCCCO2)[nH]n1)c1ccc(B(O)O)cc1 1817472213 NYEJWAPVTAJOFJ-MYHAECLISA-N 469.307 0.924 50 20 JCGD O=C(NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)c1cccnc1 1817473815 BGFUMVSFGXTQHQ-IBGZPJMESA-N 476.302 0.220 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc2ncnn2c1 1819214109 SOSSSBYXPLNLBF-SFHVURJKSA-N 459.275 0.752 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc4c3NC(=O)C4=O)sc2C1 1819349438 IBHGNYISTWXUMR-LLVKDONJSA-N 484.538 0.877 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](N)c1ccccn1)CC2 1819795214 KCPDCQFGFXTREA-PIGZYNQJSA-N 466.527 0.462 50 20 JCGD O=C(CN1CCSCC1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1829714705 CCMGUBQBLIRROS-ZBFHGGJFSA-N 454.362 0.182 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)C1CC1 1830066032 NIBNIJSPPPQXLD-IIBYNOLFSA-N 475.970 0.442 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1830450576 VJMURTSVCXJQFL-GKVSMKOHSA-N 497.552 0.567 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c12 1830734968 BNXZSMYMXQDIFL-IERDGZPVSA-N 451.907 0.846 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)C1 1831646535 MLHZZEFGOBTBCM-KUHUBIRLSA-N 474.967 0.316 50 20 JCGD O=C(Cc1cc([N+](=O)[O-])ccc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832426897 CXOHZXGUJVHBHN-QFBILLFUSA-N 459.858 0.333 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CC(O)C3)C2)C1 1832549300 HHYKVFMSFBLBFG-NHQSFPBPSA-N 475.970 0.346 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CC3CCOCC3)CC2)CC1)c1cccc(B(O)O)c1 1834800987 GDLLLLHQBZHEGV-UHFFFAOYSA-N 457.380 0.368 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccncc3)CC2)CC1)c1cccc(B(O)O)c1 1834801220 RMKZGFMPTDKUMJ-UHFFFAOYSA-N 450.348 0.189 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc(Cl)ccn1 1835889269 ILJJGELPBLFGPC-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926984 ATGJMBNDIIMDEI-JYFHCDHNSA-N 494.353 0.141 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccsc3)CCO2)C1 1836099345 YBVKPOIANVBGPI-OLCUMFGGSA-N 473.555 0.881 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1836634648 KSUBXGZMCYNFFH-XFQAVAEZSA-N 475.970 0.300 50 20 JCGD COCC(=O)N1CCC(OC2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1837699392 AWXOWOKRNGFCSA-UHFFFAOYSA-N 475.590 0.978 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1c[nH]c3ccccc13)CCO2 1839071957 SADYERUJDGMBKZ-DEOSSOPVSA-N 471.558 0.540 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839215625 CEYVYEYYZBPRMJ-UDUWVDIRSA-N 488.491 0.949 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3cccc(F)c13)CCO2 1839598853 HMXCECIHCSJTLM-QHCPKHFHSA-N 497.487 0.084 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839744243 WGGDDDFYZRNRDS-XFXHBMRDSA-N 476.480 0.853 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1839987812 IOUBTYQRRUKTMG-HXUWFJFHSA-N 459.616 0.819 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCn3c(=O)oc4ccccc43)C2)C1 1840150352 JMUDUJLFTLMBAL-KSFYIVLOSA-N 481.933 0.695 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc12 1840184442 MXNRQVGEOJHYSI-XMMPIXPASA-N 471.558 0.919 50 20 JCGD C/C(=C/C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1)C(=O)O 1840836145 AJNCLSWQQHLBLU-ONWVVCSESA-N 489.953 0.606 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C13CC(c4ccccc4)(C1)C3)CCO2 1840953515 OFQUMFNTWBLLBT-RCSZBHJWSA-N 490.365 0.558 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1)C(=O)C(=O)O 1845942816 ZLIXAMPZRXDNKG-HNNXBMFYSA-N 466.332 0.739 50 20 JCGD NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1Cl 725907964 WBACCUYVOROOMM-UHFFFAOYSA-N 486.959 0.847 50 20 JCGD CN(CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)C(=O)c1ccc(Br)o1 728330382 JIANQHCORILFGB-AWEZNQCLSA-N 496.270 0.645 50 20 JCGD CCOC(=O)C1=NN(c2ccccc2)[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1 728633917 QOXASICUHUPJEK-YLJYHZDGSA-N 496.476 0.715 50 20 JCGD N#Cc1cccc(C(=O)NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)c1 728825034 APYPUGLGGBBMMF-UHFFFAOYSA-N 469.523 0.633 50 20 JCGD C[C@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)C1 731220495 INRQXRUBLHJXQT-ICSRJNTNSA-N 486.621 0.746 50 20 JCGD O=C(NNC(=O)c1ccc(=O)n(-c2ccccc2)n1)c1cccc(S(=O)(=O)N2CCOCC2)c1 914456891 FTTFHGARNURSNN-UHFFFAOYSA-N 483.506 0.328 50 20 JCGD NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=O)c1ccc(Br)s1 914603028 HHXSZCMZEBCMKH-UHFFFAOYSA-N 475.302 0.527 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC(C)(C)C)o2)cc1OC 915416022 DLVPIWWWQHRZRX-UHFFFAOYSA-N 483.499 0.992 50 20 JCGD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1 916562365 OMADEQUSVKWUME-UHFFFAOYSA-N 462.528 0.936 50 20 JCGD COc1ccc(-n2c(C)nnc2SCC(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 919886095 UDPDOHGEWUDWBJ-LBPRGKRZSA-N 454.534 0.194 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCn1ccnc1)c(=O)n2Cc1ccccc1 920504284 AKBKSONBPAZBHD-UHFFFAOYSA-N 492.540 0.498 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)C[C@@H](C)O1 1326447912 ZBBCTBQYYLQOKP-OKILXGFUSA-N 491.408 0.764 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cccc4ncsc34)C2)C1 1778648325 JHZTYOLOPJUXRK-QFIPXVFZSA-N 451.313 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(F)cc3)CCO2)C1 1779033952 FZPVKYCOMDJJBL-QHCPKHFHSA-N 455.490 0.901 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cn4c(F)cccc4n3)CCO2)C1 1779036753 DLOQUABDBCNUNO-QFIPXVFZSA-N 467.461 0.229 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n[nH]1 1779372229 DCOMOKCLYHARNJ-XMSQKQJNSA-N 455.519 0.087 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374702 YKKYRHNJUOKGIY-WSCWJOSJSA-N 474.606 0.791 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1 1780029406 USMSRXLZTSUZCR-FDCKDHBTSA-N 468.470 0.388 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(OCCCO)cc3)C2)C1 1780127020 UNOOPBGXNGADSM-DEOSSOPVSA-N 483.525 0.204 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnsn1)CCO2)NC(=O)NCc1ccccc1 1780969569 MUHVMXMAKCXYDO-OAQYLSRUSA-N 473.559 0.328 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc2ccc(F)cn12 1781381546 NWVWSVHQSPEKLZ-HYBUGGRVSA-N 480.305 0.595 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2 1782170879 DOOOURHMVZLCAM-WRWLIDTKSA-N 473.979 0.866 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1 1782481184 PLXKNXIJJRXCHT-QFIPXVFZSA-N 452.251 0.139 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1783614857 GFVVVGSEYCKKQZ-UMCXVIDHSA-N 494.358 0.877 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)COc3ccc(C(=O)OC)cc3)CCO2)C1 1783884876 VKZALPVEWPNZIV-LAUBAEHRSA-N 454.907 0.936 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(=O)c3ccccc3o1)CCO2 1783932958 MVFYTYIPEYLMNI-QHCPKHFHSA-N 456.499 0.610 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784097680 MDPYPPWIBKRGNA-UHMOLFJZSA-N 489.378 0.121 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)CC[C@@H]3CCOC3)C2)C1)NC(=O)NCc1ccccc1 1784817162 XLYJXCRNTYFIPM-PXDATVDWSA-N 487.601 0.979 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1Cl 1785117426 NTQLBKVKSWXRSV-JOCHJYFZSA-N 458.707 0.786 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccc(Cl)n3)[C@H]2C1 1785427076 SUZOCKFYEXGODV-KKXDTOCCSA-N 472.933 0.570 50 20 JCGD CC(C)Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)n(C)n1 1786984334 FIURPHGXPSBLQK-XJABCFGWSA-N 468.363 0.206 50 20 JCGD CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS(=O)(=O)N3CCCC3)[C@H]2C1 1787504099 FIRXVQFKXGVNIX-QAETUUGQSA-N 450.001 0.799 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(CCN2CCCC2)nc1 1787554303 PPJAMMNCCPBWIQ-VMXMFDLUSA-N 464.994 0.913 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1occc1Br 1787587469 VFPQMDNKCMXNCM-QRTARXTBSA-N 477.120 0.629 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(Cl)cn3)[C@H]2C1 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O=C(CCN1CCOC1=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1818846165 WNFAMTHIUMHCJY-KRWDZBQOSA-N 455.280 0.238 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401567 IJAHRZVUEGIZHI-MLGOLLRUSA-N 456.507 0.629 50 20 JCGD Cn1cccc1C(=O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819801413 MAIXOKVMRGWKSE-LLVKDONJSA-N 467.511 0.589 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)C(C)(C)C)CCO2 1830620950 UGPQSYOLKZQYTF-WCJKSRRJSA-N 492.013 0.982 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)nc3F)CC2)CC1 1833016601 KKHBMTHFZXOHDX-UHFFFAOYSA-N 487.511 0.857 50 20 JCGD C=CCOCCCC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833470198 INHDLYRYAYUZJW-UHFFFAOYSA-N 472.590 0.853 50 20 JCGD CCc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1833516182 HNIIIMVDEIMXIC-HSZRJFAPSA-N 468.514 0.026 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CNCP(=O)(O)O)CC2)CC1 1834664087 ZZBDTQVAOBSGPH-CYBMUJFWSA-N 483.344 0.314 50 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453.367 0.052 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)[S@](=O)c1ccccc1 1839670823 CJWPKPFPVTVHCX-KILCXOCJSA-N 458.964 0.239 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CN)C2)C1 1839743717 OYUDWLNNFSUAIO-ZYEUVFMNSA-N 463.332 0.771 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1839931156 MROZSPAWLWHSPF-AVRWGWEMSA-N 481.553 0.949 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2)C(C)(C)C 1840030588 PPQGTRONFVYMMS-ZXYWRSMDSA-N 462.385 0.777 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4ccccn34)C2)C1 1840152536 LMFCSWSMPSWBCU-IERDGZPVSA-N 450.923 0.967 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843013998 LWXDPLQXVUGZJM-KRWDZBQOSA-N 457.336 0.440 50 20 JCGD CC[C@H](CC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)NC(=O)OC(C)(C)C 1843014747 XPTSPJBYVRWKIF-GOSISDBHSA-N 459.352 0.877 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)s1 1844264899 WFMSAWKWGQAJCN-UHFFFAOYSA-N 457.512 0.593 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1)n1ccnc1 1847679146 PJERMASHRBXPLG-IHPCNDPISA-N 453.547 0.992 50 20 JCGD CCn1c(NNC(=O)c2cc(S(N)(=O)=O)ccc2N2CCOCC2)nc2ccccc2c1=O 10323687 YEDSNCMLYDDWRL-UHFFFAOYSA-N 472.527 0.657 50 20 JCGD O=C(COC(=O)[C@H]1C[C@H](O)CN1C(=O)c1ccc(F)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1 725960862 VZARKHRQEIKZOY-DLBZAZTESA-N 474.401 0.314 50 20 JCGD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 727607375 FNXSZCRYHCFZTA-CYBMUJFWSA-N 483.572 0.550 50 20 JCGD CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 727607376 FNXSZCRYHCFZTA-ZDUSSCGKSA-N 483.572 0.550 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCc2ccc(C(=O)NNC(=O)CN3CCCC3=O)cc2)cc1 789858132 PGGDGHUYCKRFOY-UHFFFAOYSA-N 472.523 0.751 50 20 JCGD CCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)c2ccccc2c1=O 913573067 OSVRWAYLDOKWMC-UHFFFAOYSA-N 457.512 0.773 50 20 JCGD CCn1nc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2ccc(OC)cc2)c2ccccc2c1=O 913573093 UZULYFFJQKNLEL-CYBMUJFWSA-N 473.511 0.553 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 915076844 DMRGNUDMOHWNRO-BZUAXINKSA-N 467.569 0.758 50 20 JCGD O=C(NCCC(=O)N1CCOCC1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 916251392 KSSVMFXRQLLFKG-UHFFFAOYSA-N 478.509 0.638 50 20 JCGD COC(=O)COc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 917723999 QNPGEHZDKRNNBV-UHFFFAOYSA-N 456.502 0.155 50 20 JCGD COc1ccccc1NS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919886450 TVBMXYJRAVNIFI-CQSZACIVSA-N 496.567 0.936 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN(C)C(=O)[C@@H](C)n1cccn1 920542301 BMLQWKOTMLKKTI-GFCCVEGCSA-N 451.867 0.569 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Nc3ccc4c(c3)C(=O)NC4=O)nc2)CC1 920929374 BPFLPLPFOJQDNL-UHFFFAOYSA-N 459.488 0.050 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nncn3c1)C2 1778091070 MLZMWLQWVVPCLJ-KBDRGJQMSA-N 492.540 0.991 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779373465 UNUIAXNMERKHHX-LZBHBKQYSA-N 481.557 0.708 50 20 JCGD COc1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1780378351 IATKIRQSCIOPFA-ZJSXRUAMSA-N 452.316 0.816 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2ccncc2)C1 1780567660 CAGZPQIBWHBYRL-AUSIDOKSSA-N 452.515 0.450 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1781047536 CBXHFGUOMOSMCG-TWFHAPMSSA-N 466.376 0.545 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1 1783532968 UMBAAKQTCZZUSO-UGSOOPFHSA-N 474.377 0.853 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCCn3c(O)nc4ccccc43)CCO2)C1 1783934203 AJCORUBQQOMONT-DEOSSOPVSA-N 486.573 0.725 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1 1784239897 PVAJUOWDOVGWFQ-NVQXNPDNSA-N 492.580 0.793 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCS(C)(=O)=O)C[C@@H]21 1785079028 HSDQOKQLZYIBOV-VGWMRTNUSA-N 496.026 0.533 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccc(F)cc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786979764 PCDGNLQQHSAGBI-DCPHZVHLSA-N 466.278 0.289 50 20 JCGD CSc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983845 AHRMGALLBUHVRM-SNRMKQJTSA-N 455.345 0.390 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cn1 1788611436 BRYRBUMDNNJPJI-VDGAXYAQSA-N 482.541 0.315 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)nn3-c3cccc(=O)n3C)C[C@@H]21 1791253966 GGOHSPDXPNASNN-DWRORGKVSA-N 491.976 0.727 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc4[nH]ccc4c3)C[C@@H]21 1791292922 BMKXQLWVMADFRA-UFYCRDLUSA-N 470.574 0.848 50 20 JCGD CCS(=O)(=O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1793321277 COAJENMAXUHGJJ-AHHPBITISA-N 467.494 0.896 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc(OCF)cn1 1794409803 HICXAASTRUBTOR-GHJDPZQESA-N 473.465 0.120 50 20 JCGD Cc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1794678603 UPDADUIMKQDOLQ-JHDGKUDLSA-N 480.569 0.939 50 20 JCGD CC(C)(Cc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737789 TWOQVPVNNYQCNL-VTYHHJSWSA-N 450.344 0.839 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1796301142 OZMMBQBGBUSCAR-FPYNETTCSA-N 468.320 0.152 50 20 JCGD C#CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C 1796908412 RWQBCNIQFBCMHV-YRPNKDGESA-N 469.347 0.074 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1c(=O)n(C)c2ccccc21 1797173046 WEXMREOLKBIKRO-ZUMXRPEOSA-N 465.348 0.713 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cn[nH]c2cn1 1797579856 UKNIBSYCYBGLDL-IFONINKGSA-N 464.486 0.295 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccco3)no1)C2 1797750829 VADBOCDJSWYIIZ-DBWKPXFBSA-N 466.454 0.450 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)no1)C2 1798524538 FRVPRIIZTRUCSJ-KSPBDQMDSA-N 460.399 0.731 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1798546522 OKCQLBVGISXCJQ-USGNIVHTSA-N 472.278 0.040 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1CC1)C2)NC(=O)NCc1ccccc1 1799095431 VMWDKBMSYMDIET-JHDGKUDLSA-N 453.543 0.336 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(-c2cccnc2)cc1 1799430801 RFXAXCUMXUSHGP-ACHVPNTGSA-N 471.322 0.945 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1800404956 KWUZBWVANIZWIM-FAQVEIGNSA-N 472.734 0.474 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Cl)COC)cc1 1800979448 IHBHEDGPDLKVIR-WQDJSCAQSA-N 472.991 0.866 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]3c3cccnc3)cc21 1803142931 NXKDFJJHMJWSQK-ZTFGCOKTSA-N 460.922 0.331 50 20 JCGD Cc1nnsc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365133 WADOPOAXVLCFJG-FUHWJXTLSA-N 451.317 0.555 50 20 JCGD Cn1nc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c2c1CCC2 1809359883 IPFXTVCGHGEMTP-WZONZLPQSA-N 473.342 0.617 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809980907 ZGXJOOFZQHCONM-UHFFFAOYSA-N 452.320 0.340 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CSc2nc[nH]n2)[C@@H]1c1cccnc1 1813348316 SUPNMEZMUQIYLD-KSSFIOAISA-N 481.542 0.310 50 20 JCGD O=C(CC[C@@H]1CCOC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813626761 FVVNTASYHNDPEU-DHJUGAMNSA-N 451.332 0.898 50 20 JCGD Cc1cc(C)n(CCC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815347515 BNXGVTTYVOSYCV-QGZVFWFLSA-N 467.360 0.952 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3n[nH]c4c3CCCC4)sc2C1)c1cccc(B(O)O)c1 1816784020 WHNVRCGESMDJPF-CQSZACIVSA-N 465.344 0.964 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N[C@H]2CCc3nc(NC(=O)[C@H](F)Cl)sc3C2)N1 1817133442 GKXKTOPNNDQVOJ-CBRVECNMSA-N 489.982 0.770 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)c2ccccn2)n[nH]1 1817336734 OYWCCRFJNDMUFA-HKUYNNGSSA-N 463.502 0.809 50 20 JCGD COCCn1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n1 1817475175 LFLGMVQROSHGGV-LJQANCHMSA-N 466.307 0.552 50 20 JCGD O=C(Cn1cc(Cl)cn1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1817502474 RHJHLBBCRFGLJD-KRWDZBQOSA-N 456.699 0.946 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1819695248 UDRWNORNKDMJBU-NEPJUHHUSA-N 453.569 0.136 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2nccnc2C(N)=O)n[nH]1 1820024985 QDRSXXHMNFDOKQ-LWABSXGCSA-N 492.500 0.739 50 20 JCGD CN1CCN(C2(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)CCC(=O)NN(C)C)[nH]n3)CC2)CC1 1820801690 TYTOJAISHIDZJS-SFHVURJKSA-N 474.610 0.555 50 20 JCGD CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)nn1C 1820962300 GMHOIZXUSBUXIB-CQSZACIVSA-N 453.333 0.658 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(CCO)CCO)n[nH]1 1822026521 JHAYBCSLXRQCBU-KBXCAEBGSA-N 450.367 0.925 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1 1822699343 ARVBCJBYANCAOJ-OAGGEKHMSA-N 451.915 0.472 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CC[C@@H](N)C(N)=O)CC1 1826933506 ZOMXUELYWIQYCK-PACTWVOPSA-N 473.578 0.333 50 20 JCGD CNC(=O)CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](Cl)COC)C2)C1 1828578794 ALWKDXDLXNQLMV-WZONZLPQSA-N 494.976 0.828 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923300 BSPYYDJVANCQRW-KXBFYZLASA-N 494.618 0.246 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829715237 VIQBGKSRAXLGBX-ROUUACIJSA-N 454.420 0.728 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1830543960 JOLJUJOKZARDPA-KUHUBIRLSA-N 471.352 0.602 50 20 JCGD O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733316 IIQJQZYMBNEWSB-XLIONFOSSA-N 471.341 0.815 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830736473 SPIRXZQTOQQNCA-CDMIOBSGSA-N 483.949 0.357 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830738417 PIPMVBSCGUBXKR-QVKFZJNVSA-N 477.986 0.593 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1832089689 NZGSMLACQQHFHY-RUZDIDTESA-N 497.552 0.315 50 20 JCGD O=C(Cn1ccc2sccc2c1=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832891752 RLXKEDHESVCFDX-QRWLVFNGSA-N 469.947 0.119 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3C(N)=O)CCO2)C1 1833315658 XZPGSWMLHNZCJR-RBUKOAKNSA-N 459.330 0.487 50 20 JCGD CN(C)C(=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)CC1 1834631459 XLJFAQYXZRZNOF-KRWDZBQOSA-N 488.029 0.778 50 20 JCGD CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)no1 1834798345 JXHZGSHTGYYFBN-UHFFFAOYSA-N 454.336 0.416 50 20 JCGD COc1cncc(CCC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834800037 QVHVLPHSMHYCLD-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3CCC(O)CC3)CC2)CC1)c1cccc(B(O)O)c1 1834801455 LFXXRNDRPAMSNN-UHFFFAOYSA-N 457.380 0.103 50 20 JCGD O=C1COc2ccc(C(=O)N3CCOC[C@]4(CN(C(=O)CCBr)CCO4)C3)cc2N1 1834823323 NPFOEKWNEHNWHH-FQEVSTJZSA-N 482.331 0.873 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1835935651 XCWUPAXFSMHXAB-JOCHJYFZSA-N 473.722 0.107 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccsc1)CCO2 1836008682 GWQMHCAQUBJMRP-NRFANRHFSA-N 452.577 0.510 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)nn1C 1836033952 IOYPNWOVILMGKA-UHFFFAOYSA-N 461.611 0.541 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)c4ccn(C)c34)CC2)CC1 1836082015 JWSBHRXHHSOXRA-UHFFFAOYSA-N 499.616 0.837 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H]3CNc4ccccc4O3)CCO2)C1 1837356006 ITFRUXLICYCXHJ-JLHGSKIFSA-N 467.950 0.960 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c[nH]1 1837456963 QZVIIXHUMYWCSH-XMMPIXPASA-N 484.557 0.695 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCCn3cccc3)C2)C1 1837460929 LOWYLNXHBVRXRQ-QHCPKHFHSA-N 470.530 0.037 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1837715308 IKYHMQXBCTYDBE-LJQANCHMSA-N 452.540 0.096 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1837918183 GRUUVDSINVLYGF-LBPRGKRZSA-N 481.351 0.813 50 20 JCGD CO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528173 JMVACSPBJRDWLJ-SZNDQCEHSA-N 465.459 0.625 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839754416 YDVWPJOUSHMUJR-QHCPKHFHSA-N 496.992 0.721 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nccnc3OC)C2)C1 1839962787 QVEBSJFMKQPTPF-SCLBCKFNSA-N 457.325 0.729 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1840033350 AYGQEBWHRVDIJR-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(Cc3ccccc3)C(=O)OC)CCO2)C1 1840083944 JQCNAUZASHTYQE-AUSIDOKSSA-N 497.976 0.965 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)cc1F 1840182606 OEYNTKXMLIGRAK-DEOSSOPVSA-N 478.565 0.896 50 20 JCGD CCn1c(-n2nc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)cc2C)cccc1=O 1843011043 IZICZVRQPUBUCH-UHFFFAOYSA-N 489.341 0.173 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CCCNC(N)=O)NC(=O)OC(C)(C)C)C2 1846365769 UWXXTKKVPVQKEW-GJZGRUSLSA-N 490.001 0.785 50 20 JCGD Cc1ccc(S(C)(=O)=O)cc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 15524856 WTAMQYSTCPAQFD-UHFFFAOYSA-N 481.552 0.494 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1 15709707 IKBJILMFGLTYKL-UHFFFAOYSA-N 473.471 0.566 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CNC(=O)c2cccs2)cc1 725902919 XMLHQFATCDYVHE-UHFFFAOYSA-N 452.514 0.197 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H](C)N1C(=O)NC2(CCCC2)C1=O 726522148 CJCAOEMNFMKNJU-GFCCVEGCSA-N 450.521 0.302 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1 726523734 VJWNUOAVOPCAHB-CQSZACIVSA-N 465.532 0.016 50 20 JCGD Cc1ccccc1S(=O)(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 727353756 WVHPSVBLSCCFBA-UHFFFAOYSA-N 467.569 0.958 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1cccc(C#N)c1 728873019 SKBGPAQNFCYUKA-YFPIXMDGSA-N 490.563 0.713 50 20 JCGD O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 731003801 NHAKFMAVCLHEML-GFCCVEGCSA-N 482.378 0.521 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)c1 743738078 SKVUOIMYHGTYAI-UHFFFAOYSA-N 483.568 0.961 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)C(=O)NC(C)C)n2CC 744446946 PRTOJMOKQCRJLJ-UHFFFAOYSA-N 480.591 0.691 50 20 JCGD O=C(NCCC(=O)N1CCCCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 748462268 DULIELCTLXESSY-UHFFFAOYSA-N 481.575 0.444 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)[C@H]1COc2ccccc2O1 749838392 OJIXAHUTJRKGPU-LLVKDONJSA-N 476.330 0.776 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O 751207087 ZGCVYLVDISEVNB-ZDUSSCGKSA-N 492.535 0.263 50 20 JCGD O=C(NNC(=O)c1ccc([N+](=O)[O-])cc1I)N[C@H]1CCS(=O)(=O)C1 751362751 QRAQMUPCLXGCNP-ZETCQYMHSA-N 468.229 0.331 50 20 JCGD O=C(COC(=O)CN1C(=O)COc2ccc(Cl)cc21)NNC(=O)c1cccc([N+](=O)[O-])c1 818125342 BVBUJYKDNBTTII-UHFFFAOYSA-N 462.802 0.978 50 20 JCGD Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cn1 915057897 KDYICDCQQPMAET-UHFFFAOYSA-N 498.568 0.022 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)Cn3ccc(=O)n(C)c3=O)cc2)cc1 915062390 MVOGSOINEQAVFU-UHFFFAOYSA-N 499.549 0.137 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)nc1 915906161 NRRKYTVMTYXIHT-UHFFFAOYSA-N 481.579 0.993 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2cccnc2)c2ccccc2c1=O 916092699 APKCLPCEYZCHSE-UHFFFAOYSA-N 458.500 0.454 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(NS(C)(=O)=O)c2)c1 916246489 ISIHSTXKKLKVQI-UHFFFAOYSA-N 469.545 0.453 50 20 JCGD CCC(=O)N[C@H](CCSC)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 917393770 VZHXMGWLDYPGIH-MRXNPFEDSA-N 456.590 0.880 50 20 JCGD C[C@@H]1CCc2sc(C(=O)NNC(=O)N3CCN(S(=O)(=O)N4CCN(C)CC4)CC3)cc2C1 918779488 WZRKCKNILPHNNH-OAHLLOKOSA-N 484.648 0.337 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)cc1 919338642 BDLABWHHFMXHBP-UHFFFAOYSA-N 452.471 0.690 50 20 JCGD C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 919883950 FJGVJWMUZVIMKR-HLLBOEOZSA-N 466.560 0.986 50 20 JCGD CN(CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)c1ccc(Br)s1 919886796 VCWBFSRXTHBYMF-QMMMGPOBSA-N 453.340 0.100 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1 920435959 QYSXVBRZKJIJEH-LLVKDONJSA-N 493.405 0.681 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CN(C)c1ccccc1)c(=O)n2Cc1ccccc1 920760216 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CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4ccccc4[C@@H]3O)[C@H]2C1 1784151853 KPUVWWIXPBLYHD-ZKEZPVKKSA-N 472.586 0.635 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)C3(c4ccccc4F)CC3)C2)C1 1785458558 GEMBBRQUAMBNKZ-HSZRJFAPSA-N 452.291 0.681 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](COC)NC(=O)OC(C)(C)C)[C@H]2C1 1787470283 ZFQMEOJVNORQQC-SIRPWMCASA-N 477.986 0.760 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607841 NTAZWZSTUWXHAM-LRGYGIHKSA-N 481.557 0.284 50 20 JCGD CSc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1O 1789247312 XJISLTCLTFGNTM-SNRMKQJTSA-N 470.356 0.701 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1792207068 XGBJFCBODYXPEG-NYVOZVTQSA-N 476.342 0.469 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ncc(Cl)cc1Cl 1792411192 JNYBSKQCUXRORJ-FVCICTRLSA-N 464.114 0.585 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC(F)(F)CC1 1793160657 RRPAHHPQRHQNGX-XOIINTDNSA-N 451.474 0.714 50 20 JCGD CN[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)C(=O)O 1795647426 OCOYNWFSBDKENT-OYNZLANYSA-N 482.375 0.645 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cccnc3n1)C2 1796441974 LHOKESCEGFULQC-PTFAKJKNSA-N 475.509 0.967 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncncc2c1 1797467591 IYTOVMZGPUTEKP-NKNSKHGVSA-N 475.509 0.967 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1[N+](=O)[O-])C2 1797754023 PIKBQGHMIPIUHZ-DPIQGUFMSA-N 472.433 0.249 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(Br)c1 1798019779 FKJJRVIJYBTQSM-FVCICTRLSA-N 489.330 0.360 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])c2c1OCO2)c1cccc(B(O)O)c1 1799344194 VVOFMQIMDQVOAI-MUJYYYPQSA-N 467.243 0.569 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1800714858 DNUFOTMZRROJHU-UNPPPGBBSA-N 471.982 0.823 50 20 JCGD CC(=O)C[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1800941465 LCECVKGNZJBHHC-IBHRTIHJSA-N 473.574 0.537 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O)C2 1800978580 VPRBMVCRPXSZNK-UCIFAOBLSA-N 489.997 0.448 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)NC(=O)[C@H](C)O3)C2 1800979071 RKCJKFDLIZSYJG-VGXVWSLXSA-N 451.907 0.863 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1C(C)C 1801572741 NVGBSXWJGIDCPP-LVPMTATBSA-N 458.563 0.583 50 20 JCGD C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1803016752 YCAWOKUIMGIGBZ-SZVBFZGTSA-N 471.396 0.405 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc(O)nc(O)c3C2)[C@@H]1c1cccnc1)[C@H](O)CCl 1803141132 LOTKEXBUZUXQOX-KBEZCGTCSA-N 475.933 0.693 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cc1 1805162213 NIROYASCZQBNDD-QFIPXVFZSA-N 466.343 0.953 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374046 WPQSHNPWVSBUIO-MNHFLQJXSA-N 490.369 0.482 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807376366 YMSCSMVLWYHBFZ-NYDSKATKSA-N 474.326 0.944 50 20 JCGD Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)s1 1807534801 VTYABJZXYXXUDH-YWZLYKJASA-N 480.554 0.802 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808418143 ZVNJPWSGHZSRQN-KFVBAAANSA-N 496.572 0.929 50 20 JCGD O=C(CN1C(=O)C=CC1=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1 1813177749 SPQNISPRLWHJBC-JCURWCKSSA-N 453.268 0.703 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)Nc1cc([C@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1 1815672922 IUYQHMHVTKPDGO-GFCCVEGCSA-N 452.364 0.936 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817474918 JCOWXMYUJIBEPV-CXAGYDPISA-N 458.280 0.957 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4cccnc34)sc2C1 1818991646 MAXBVEUWHGOUTK-GFCCVEGCSA-N 456.532 0.785 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(=O)c1ccco1)CC2 1819793794 SZJLQTKTPQPHGF-JTQLQIEISA-N 454.468 0.843 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1ccnn1 1819800444 OUVLBJVEEAOUSN-GHMZBOCLSA-N 455.504 0.220 50 20 JCGD O=C(COC(=O)C(F)(F)F)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057940 OAWCURIGNONRAH-KRWDZBQOSA-N 470.253 0.705 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCC3)CCO2)C1 1829874885 LHAUAKMWAQULDB-HSZRJFAPSA-N 490.513 0.686 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c[nH]c1C 1830720101 SZCNJTBDTDYMDO-HTAPYJJXSA-N 485.965 0.489 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3csnn3)CCO2)C1 1831743149 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O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1837920054 HXASPGHJAIINSM-QGZVFWFLSA-N 471.132 0.669 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)CC2)CC1 1837921090 YZHSFICAIQFRRF-GOSISDBHSA-N 480.374 0.507 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)/C=N/N3CCCCC3)CC2)CC1 1838391936 BTVKAUNTUQQYJO-HKOYGPOVSA-N 464.611 0.830 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)CCO2)C1 1839483463 HAVAJJVJKKIHLK-XOBRGWDASA-N 481.893 0.795 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCC3=O)C2)C1 1839743462 SDALBYLXTBHJSC-FBGPZHRUSA-N 488.491 0.951 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1839962416 DGLAKALUKUYODF-XIKOKIGWSA-N 471.308 0.418 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1 1840030957 BIVGKDJEWOVTAQ-PXAZEXFGSA-N 461.288 0.636 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840033075 SGRSHKBINJNOOS-KBXCAEBGSA-N 459.341 0.383 50 20 JCGD CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840087723 OQQJDQDRKHEJAJ-DRSNIGMVSA-N 492.013 0.982 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1840152758 SFBNNUNBVWUKAM-VBKZILBWSA-N 455.895 0.177 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)C2)C1 1840184670 ANGUSEABDJFIOP-ISJRUSPKSA-N 450.580 0.642 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840806260 OYOZNZCIXBZQHZ-GAJHUEQPSA-N 499.609 0.119 50 20 JCGD C/C=C/C(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C1 1843428831 SWJVANQQKDBPNH-XZXOBPBMSA-N 471.363 0.582 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)C1(C)CC1)C2 1843428882 WKGKSBZPTQCAEY-IBGZPJMESA-N 485.390 0.806 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)[C@H](C)N1CCN(C)CC1)C2 1844692967 HOUNELRWASOLLM-INIZCTEOSA-N 473.530 0.973 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2C[C@@H]3C[C@@H]3N2C(=O)OC(C)(C)C)C1 1847080592 UBKPFVSJUVFVEQ-YESZJQIVSA-N 463.579 0.961 50 20 JCGD COc1cc(C(=O)NNC(=O)CCc2c(C)nc(N3CCOCC3)[nH]c2=O)cc(OC)c1OC 14289162 UHWRBSLWTJMGPB-UHFFFAOYSA-N 475.502 0.335 50 20 JCGD Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)OCC(=O)NNC(=O)c1ccc(Cl)cc1 18392784 YDLVGVMNCUOMFM-UHFFFAOYSA-N 484.918 0.317 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNc3nc(-c4cccnc4)no3)c2)CC1 728078796 VZULKSXRYKSEEU-UHFFFAOYSA-N 471.499 0.741 50 20 JCGD N#Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3c[nH]c4ncccc34)CC2)c1 728952921 HOBWSEKFCFBRJY-UHFFFAOYSA-N 453.484 0.795 50 20 JCGD Cc1cc(=O)c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)nn1-c1cccc(C(F)(F)F)c1 729276002 UWFMMXAGQZMBHB-SNVBAGLBSA-N 461.422 0.258 50 20 JCGD O=C(CNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)C1CCN(c2ncccn2)CC1 729372493 BSCVIDWXYLCOKP-UHFFFAOYSA-N 486.476 0.838 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC1(N2CCCC2)CCOCC1 729624676 ZYWRBOZSGDTDDW-UHFFFAOYSA-N 452.581 0.877 50 20 JCGD CNS(=O)(=O)c1ccc(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 804142126 SQPQUHNODKSRIO-GOSISDBHSA-N 477.495 0.058 50 20 JCGD COCCCNC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 915879617 GPYDASDSOJRIGD-OAHLLOKOSA-N 458.537 0.320 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(S(C)(=O)=O)cc2)cc1 916568122 BZTPCQFSRPWXPH-UHFFFAOYSA-N 468.557 0.550 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)c2ccccc2c1=O 917914621 KABWMOLHWKXFHI-LBPRGKRZSA-N 463.541 0.996 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCN3CCc4sccc4C3)nc2)CC1 919784130 DJIHURPZZHPMKD-UHFFFAOYSA-N 479.632 0.764 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)c1ccc[nH]1 1115817323 UEFSFJHTSFFHPI-AWEZNQCLSA-N 471.333 0.772 50 20 JCGD CCc1oncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371028 HQYMNCHEBXTJTC-XMSQKQJNSA-N 456.503 0.677 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)c1ccccc1)C2 1779371253 XHUQIFPQXMIPNM-YOSAUDMPSA-N 467.526 0.546 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1 1780342274 SVZXDDRHZNRIJM-XMMPIXPASA-N 460.299 0.309 50 20 JCGD O=C(Nc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1)C1CC1 1781466668 NWCXOFKTXZLZOF-RUZDIDTESA-N 477.326 0.472 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCc3sccc3C1)C2 1782209038 IFEFXXLDEIBGSO-HYBUGGRVSA-N 491.658 0.993 50 20 JCGD O=C(CCBr)N1CCO[C@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1782729850 VACZXAUQFNWDJE-HXUWFJFHSA-N 451.365 0.998 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCO2 1783022735 NRNNKEPKHYANPS-NTLWEQJWSA-N 466.376 0.545 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936525 OVNJXNHXZPSULI-DEOSSOPVSA-N 484.557 0.703 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)ccc21 1784093570 YTVNGMDVXDEPSN-ZZCKCESHSA-N 450.923 0.070 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)C2)C1 1784373497 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472.611 0.847 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779563915 GUOOAFQSKXYHJX-WSCWJOSJSA-N 466.347 0.390 50 20 JCGD CSCC[C@@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968494 LUQSLFQJSZEWIR-XXBNENTESA-N 493.630 0.277 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCC=CO1)CCO2)NC(=O)NCc1ccccc1 1780969028 SOCVXOOSRZJBNI-RDPSFJRHSA-N 471.558 0.855 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cc21 1781329879 MMVKFMPVZQMXMV-DYVFJYSZSA-N 458.288 0.151 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1 1781769648 BXVHJIVKOWLLQV-NRFANRHFSA-N 457.223 0.171 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N1CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C1)CC2 1782986043 BBEISIYQPYRUGG-RXFWQSSRSA-N 478.354 0.624 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1 1783535696 BRJBFQDXGVLKKV-CWTRNNRKSA-N 480.319 0.905 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1)CCO2 1783935077 NQISZRXEMSBMLU-DHIUTWEWSA-N 499.584 0.538 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1NC(C)=O 1783935747 WGJRRFTWCYSKDF-QHCPKHFHSA-N 475.546 0.470 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)CSCC(=O)O)C2)C1 1783952862 MOHSARDBHZNZPD-DJJJIMSYSA-N 479.983 0.766 50 20 JCGD CN(C)C(=O)NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785074050 GUBHDTORVWJSND-VGWMRTNUSA-N 490.001 0.369 50 20 JCGD COc1ncccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1785309972 PPGPBIISKVGIET-VDGAXYAQSA-N 482.541 0.315 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](N)c3cccc(Cl)c3)[C@H]2C1 1786885194 LVLHZDMNQWQRBY-DILOTOHQSA-N 486.960 0.632 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc2cnccc2n1 1787887778 APAARPJUZMEPEO-JLMWRMLUSA-N 460.299 0.217 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)[C@H]2C1 1788080555 FJCMXODUTYGNAP-WSMBLCCSSA-N 488.932 0.418 50 20 JCGD O=C(NC1(c2ccc(NC(=O)c3cc(=O)n4[nH]cnc4n3)cc2)CCC1)c1ccc(B(O)O)cc1 1788136579 CZTFBBYVDSRRAV-UHFFFAOYSA-N 472.270 0.159 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21)[C@@H](F)Br 1789923480 PJHDQRJHAMJKHQ-GZCFXPHUSA-N 489.367 0.562 50 20 JCGD N#CCc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1790143332 SYPDBCPSSVBCQR-YYWHXJBOSA-N 462.510 0.658 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(F)ccc3F)[C@H]2C1 1792136435 HPANSNCYQARYOC-FNHZYXHNSA-N 452.502 0.860 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1OC(F)(F)F 1792668719 JJJZFMQUBPBFIV-CCWDJLKJSA-N 478.232 0.782 50 20 JCGD CC(C)(C)n1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1Cl 1794431500 FMSBJESDEUSTBO-JLVBRIDZSA-N 474.754 0.488 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1cc(C)c(O)nc1=O)C2 1796892958 BIBDBQWRNHAZGK-MVRRYPJTSA-N 469.502 0.030 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1797588456 POUARJLCZDSMBP-XBHGAPDLSA-N 478.452 0.526 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(F)c1Cl)C2 1797752882 LIALXLJPDRBLQS-KSPBDQMDSA-N 461.881 0.995 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2cccnn12 1798500443 KSWULFDCIBTSJS-IPJQOSJUSA-N 464.320 0.466 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Cl)cc2nn[nH]c12 1798619443 XBLHRQGTPNDPFX-YQYWCBKUSA-N 484.904 0.127 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)c(F)c1 1799479566 WIJGCLVGCCXYMR-IVWMJMPLSA-N 461.881 0.995 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799871590 PPQMZQBJSABRQQ-DVWBAYGPSA-N 472.590 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC[C@@H]2CCC(=O)N2C1 1799926421 NIUSCHLHYOKCIX-OVYGPGRDSA-N 454.531 0.338 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2ncccc12 1799975613 RJHCZWRJPLJBOD-RXHPZTQNSA-N 475.509 0.967 50 20 JCGD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)CCC(=O)NN(C)C)c([N+](=O)[O-])cc1O 1802336021 BFOIKMPHVREQIY-BTTYYORXSA-N 463.491 0.934 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@@H]1c1cccnc1 1804195627 FYTDUCNJAMTUGY-GOEBONIOSA-N 463.387 0.622 50 20 JCGD CCn1nc(C)cc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807984786 XCBJRCPDLHLMCQ-KNQAVFIVSA-N 461.331 0.920 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2C)[C@H]1c1cccnc1 1808416722 QOJMSRDMBMHJPE-VPYRCWRLSA-N 479.541 0.842 50 20 JCGD Cn1ccc(=O)cc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1811362879 AEAQIUBXIHSFMV-GCJKJVERSA-N 460.299 0.094 50 20 JCGD CCN(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1812312228 QIBKHRNCBYGMSM-OXFYSEKESA-N 453.547 0.740 50 20 JCGD C[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1812857940 BAGXDCCHFPTRHI-XJABCFGWSA-N 468.558 0.814 50 20 JCGD N[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)c1ccccn1 1815354439 BJFMNIHZBZZDJU-KSSFIOAISA-N 451.317 0.144 50 20 JCGD COc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815354780 CZWGXDSTFOIPEY-CQSZACIVSA-N 452.301 0.766 50 20 JCGD Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)ncc1[N+](=O)[O-] 1817621982 OZEFYJRORFQUHU-AWEZNQCLSA-N 481.299 0.974 50 20 JCGD Cc1nc2ncccn2c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1818391676 DNIMMTDTUTUDOO-HNNXBMFYSA-N 476.327 0.714 50 20 JCGD Cc1cc(C)n(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819792931 DPBJJMBJCVONHJ-ZDUSSCGKSA-N 468.543 0.881 50 20 JCGD O=C(Cc1ccc2ncnn2c1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1820698419 JNZQLEZQITYXLX-IBGZPJMESA-N 473.302 0.681 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ncn(C)n1)CC2)NC(=O)NCc1ccccc1 1822517912 CUYIPVNQBOERDO-HNNXBMFYSA-N 497.585 0.844 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCOC2=O)CC1 1824333649 QJPKPWXBQOSLLA-SFHVURJKSA-N 458.519 0.371 50 20 JCGD O=C(CCCn1ccnc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826683698 CULITSHQZWAUMP-INIZCTEOSA-N 453.333 0.726 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H]2CNC(=O)C2)CC1 1827679592 KMDSEZURRQCMPS-DFXDRYTJSA-N 456.547 0.876 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828926922 UGIDIFRCWALUBR-QRWLVFNGSA-N 458.563 0.785 50 20 JCGD O=C(c1ncon1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829164851 GKVWIYZYFCAOKA-HRAATJIYSA-N 477.905 0.735 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c([N+](=O)[O-])c1 1830733652 QQCBOMLQCUBLQQ-YLJYHZDGSA-N 471.894 0.202 50 20 JCGD COc1ccccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830991666 BILYBKBEBRIJBG-VWLOTQADSA-N 482.342 0.078 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1)n1ccnn1 1831170694 JAWUAWNLMICQFC-BEFAXECRSA-N 454.535 0.771 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCCCN3C)CC2)CC1 1833323462 ICFFQRARQYYBNS-FQEVSTJZSA-N 450.628 0.415 50 20 JCGD O=C(/C=C/c1ccco1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833850011 QBVIYOYLUSISDC-BQYQJAHWSA-N 451.332 0.858 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1coc(C)n1)CCO2 1834207961 VLUVSFGQROJSFV-JHXRPTDYSA-N 458.475 0.187 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3ccnn3C)CC2)CC1 1834212051 DXGHYESOSPGZLT-JVWAILMASA-N 468.562 0.739 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCC4)CC2)CC1)c1ccc(B(O)O)cc1 1834798672 WWILQQCUOCXTIY-UHFFFAOYSA-N 465.363 0.008 50 20 JCGD CCOc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800563 MXQJQCJJIQGLTD-UHFFFAOYSA-N 480.374 0.659 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4nc[nH]c4C3)CC2)CC1)c1cccc(B(O)O)c1 1834801369 CHQJMHUXJIHCCN-SFHVURJKSA-N 479.390 0.080 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)n1cccc1C=O 1834806094 IGJQTFZCDDXVRJ-SFHVURJKSA-N 480.374 0.427 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cc(O)n1 1835089781 RLTMKVKBCWAZBP-UHFFFAOYSA-N 481.557 0.593 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCOCC3)CCO2)C1 1835397591 UDFNOGABZDBCDW-XFWAWQDHSA-N 490.507 0.660 50 20 JCGD O=C(Cc1c[nH]c2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931625 UBRUGCYHCBYOCN-VWLOTQADSA-N 477.326 0.160 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1836473561 JEHZICDCDORIPF-VHKYSDTDSA-N 498.404 0.565 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)ncn3)CC2)CC1 1836939699 VGRYVNLZCCHMJM-JFLMPSFJSA-N 483.529 0.928 50 20 JCGD O=C1COc2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)CCBr)C4)C3)cc2N1 1836990768 GIVXCOSGEKTPHJ-FQEVSTJZSA-N 482.331 0.873 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1 1837460103 VEJMUPCTWDBDSQ-HSZRJFAPSA-N 497.487 0.084 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCCCn3cccc3)CCO2)C1 1837624280 ZAMAGHONMCCVEK-XMMPIXPASA-N 484.557 0.427 50 20 JCGD O=C(c1ccc(Br)cn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1837826036 AVCNTABLWXSULX-WMLDXEAASA-N 462.728 0.514 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CC2)CC1 1837920069 IPFKKYVCIRBXBV-UHFFFAOYSA-N 497.313 0.906 50 20 JCGD COC(=O)C12CC(C(=O)N3CCC(OC4CCN(C(=O)c5cccc(B(O)O)c5)CC4)CC3)(C1)C2 1837921550 LPUIRRVNDCHAEN-UHFFFAOYSA-N 484.358 0.322 50 20 JCGD CN1CCN(C2(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@](C)(Cl)CCl)CCO4)CC2)CC1 1839154318 KIXVVMGAHJVSFW-PMACEKPBSA-N 477.433 0.459 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)CCOC1 1839191181 XVQRGMDXMXDLRL-VQTJNVASSA-N 496.388 0.930 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(-c3cnco3)c1)CCO2 1839365530 QIRMROWXNADKIC-VWLOTQADSA-N 491.309 0.405 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1 1839477156 ZQKCPGOKYPZOMV-OXJNMPFZSA-N 492.953 0.553 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)Cc1ccccc1)CCO2 1839960047 AWKYVKTVPJRGSI-RIFZZMRRSA-N 455.349 0.830 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)C1 1840151946 SAYNRKQUCKDDBB-KKSFZXQISA-N 454.907 0.668 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ccc(F)cn34)C2)C1 1840154820 HKJWRCCHNSTVFW-MGPUTAFESA-N 454.886 0.797 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc4ccccc4n3C)C2)C1 1840182646 OVTRCMMFQCDGRK-VWLOTQADSA-N 485.585 0.550 50 20 JCGD COc1ccc2oc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2c1 1840184417 LGOUDFKUPZEODW-DEOSSOPVSA-N 488.541 0.884 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184675 AUEMKWLFXFEWID-HSZRJFAPSA-N 496.992 0.721 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840869391 WKMHSBHSCLIUON-DYESRHJHSA-N 450.923 0.552 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1Cc3ccccc3C1)CCO2 1840943618 MWEKKLSVUUWMKL-RUZDIDTESA-N 479.537 0.170 50 20 JCGD O=C1NC(=O)[C@H](CC(=O)N2CCCC23CN(C(=O)[C@H](Br)Cc2ccccc2)C3)N1 1841962025 QLKSIIWEHSRZCX-CABCVRRESA-N 463.332 0.794 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1c(O)cc(O)cc1O)C2)NC(=O)NCc1ccccc1 1845039242 VNLKHIZTRKMMBY-UHFFFAOYSA-N 483.525 0.967 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1845939196 ITYLSYZLRPYPLF-UHFFFAOYSA-N 485.566 0.538 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCn2cncn2)C1)NC(=O)NCc1ccccc1 1846546619 QPBJTLBMLXVJLZ-UHFFFAOYSA-N 454.535 0.218 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl 16785817 HLLKUPBAVOJKKG-LBPRGKRZSA-N 463.965 0.710 50 20 JCGD Cn1c(CCC(=O)NNC(=O)C(=O)NC2CC2)nc2cc(S(=O)(=O)N3CCCCC3)ccc21 17806377 SDLUGDHHHHLSCS-UHFFFAOYSA-N 476.559 0.107 50 20 JCGD CN(C)N(C(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1)[C@H]1CCS(=O)(=O)C1 728178574 YTMCOGGXPQAJJP-HNNXBMFYSA-N 465.544 0.858 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(NC(=O)c2ccc(Br)o2)c1 729273981 DVACYUQASWXURT-SECBINFHSA-N 473.305 0.993 50 20 JCGD CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)[C@@H]1c1ccc(OC)cc1 729276109 XDCFBOJFTDWEGS-LJHODMEESA-N 468.576 0.860 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C[C@H](C)O1 751206658 KUGOBFRVUPOQMV-KBPBESRZSA-N 464.500 0.269 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12 751210904 KQPOEOBJCXVLBA-UHFFFAOYSA-N 465.538 0.551 50 20 JCGD O=C(COC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NNC(=O)c1cccc(Cl)c1 789579456 HZTBOYZNQPIOIY-UHFFFAOYSA-N 481.914 0.979 50 20 JCGD Cc1cc(C)n(CCCNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 915889473 AURTWKIUZYATKN-UHFFFAOYSA-N 492.602 0.874 50 20 JCGD COCCOc1ccccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 919658622 VQHYCRRHYVTALR-UHFFFAOYSA-N 492.554 0.877 50 20 JCGD O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1cc(F)ccc1F)N[C@H]1CCS(=O)(=O)C1 920746250 VDGIGTXNVAZBEO-LBPRGKRZSA-N 488.494 0.897 50 20 JCGD CNC(=O)CNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Br)cc1 920848868 JKETTYJVLWAYMP-JYRVWZFOSA-N 459.304 0.957 50 20 JCGD C[C@H](Sc1ncccc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)N1CCCC1 1325540914 ZSAKKCZJLFEVEA-STQMWFEESA-N 455.562 0.316 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)CCNS(=O)(=O)c2cccc(Br)c2)C[C@@H](C)O1 1326447913 ZBBCTBQYYLQOKP-ZIAGYGMSSA-N 491.408 0.764 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1n[nH]c2c1CCCC2 1777875709 GCHDXIXJJGMBBI-HYBUGGRVSA-N 466.347 0.410 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccnc1C)C2 1778092452 BZQBRYASTGPHKR-PZOAEKQQSA-N 469.546 0.839 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1779029380 WSGNVNQBTBHTJS-HSZRJFAPSA-N 468.514 0.165 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1n[nH]c3ccc(F)cc13)CCO2 1779031923 HLVPISKBKLLRDM-QFIPXVFZSA-N 467.461 0.458 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)ccn1 1779557885 ONHCGNNEVVOPSQ-IBUSPFOHSA-N 454.487 0.668 50 20 JCGD NC(=O)c1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780773335 AHNQQVPOTGDDPL-OMXAPOSASA-N 458.288 0.394 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C#N)(C(=O)N2CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1 1781168171 WLBGQIVEMFOFHK-OPAMFIHVSA-N 484.981 0.957 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C3CCN(S(C)(=O)=O)CC3)CCO2)C1 1781229253 FUEDTMRVFGXORL-ROUUACIJSA-N 470.419 0.724 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782210093 FBZQEEOBDJCYTC-BFUOFWGJSA-N 453.569 0.080 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(Cl)cnc1O)C2 1782210115 FWSKKCJLBDICGA-IIBYNOLFSA-N 467.954 0.941 50 20 JCGD COc1ccc2c(CC(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)c[nH]c2c1 1783932769 DSTGZKBLUBCJEO-DEOSSOPVSA-N 471.558 0.922 50 20 JCGD C[C@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)NC(=O)OC(C)(C)C 1783935571 VSEPWMWHLYPVBD-OPAMFIHVSA-N 469.583 0.493 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2 1783937119 PNNUHDGJHWXQPM-XCLFUZPHSA-N 486.495 0.346 50 20 JCGD Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)no1 1785273006 NXTIYVSLVCDNBP-UFYCRDLUSA-N 499.572 0.246 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)ccnc3Cl)[C@H]2C1 1785482867 HBFGFBTTWSFTSE-PJODQICGSA-N 476.896 0.780 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)CCN3CCCC3)C2)C1)NC(=O)NCc1ccccc1 1785675478 XCYFGBKLOTZANG-VWLOTQADSA-N 486.617 0.648 50 20 JCGD CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc(C)n1 1786979924 PPNZVUNOYWRMMU-HSQYWUDLSA-N 451.332 0.539 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@@H]1SC(=N)NC1=O 1787500467 JZTZGRRJYYKCFL-SDONNHMOSA-N 465.345 0.459 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C#N)c[nH]3)C[C@@H]21 1787508309 FBDZHHNUADTFEG-RBFTXDQOSA-N 451.487 0.614 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nn[nH]c3C(F)(F)F)C[C@@H]21 1787508786 UFPVVDDAXYGWLV-FWAJNHRISA-N 496.450 0.551 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]4C3)cc2NC1=O 1791290864 PZDUEZPNJZMFOF-VERUCKTNSA-N 487.557 0.372 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc([N+](=O)[O-])c1OC 1792980094 LKQYUBNPUNLPCQ-LMWOUKEDSA-N 457.867 0.415 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1C[C@@H]1c1ccc(F)c(F)c1 1793045563 JJEQHXOGMVNJSK-SIUYQDCVSA-N 470.281 0.652 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1793153260 KDSRZLZPQAQDSG-NEXGVSGLSA-N 459.971 0.869 50 20 JCGD CCN(CC)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)c1ccccc1 1795741249 OMZFUFUVLZNVKY-CBJLPSGESA-N 479.386 0.653 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2)[C@H]1SC(=N)NC1=O 1796427020 LXPDUYLODJJOAZ-XBEPSMQDSA-N 451.376 0.615 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(Cl)c1)C2 1796441275 RONKTRKAFLQUQP-VNGJRTCYSA-N 474.905 0.778 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccnn1-c1ccccc1 1796738649 ONZFDDKHQQELAN-OPMZPASUSA-N 460.299 0.069 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCNC2=O 1797323412 CPFPQOTULDRSOR-ZWUHOBOKSA-N 468.352 0.393 50 20 JCGD Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(F)c1F 1797754497 ZYYNVVNGMGBPGZ-DBWKPXFBSA-N 459.453 0.789 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798616033 YTFCLHPOCHGYFM-RSPOEFSDSA-N 470.574 0.662 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2 1799269939 GEWSYSJVWCWSNE-QKQGURCUSA-N 459.971 0.965 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)C=CC1=O)C2)[C@H](Br)Cc1ccccc1 1800436998 QJWJFRWQBSRQHJ-KYFSNAEOSA-N 490.354 0.507 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=CCN(C(=O)OC(C)(C)C)C1)C2 1801010569 HRNUODWYKMMSAL-XEMDLRDOSA-N 479.578 0.126 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2COC[C@H]21 1801600621 XYTUGTBBWVCXBG-BHLQKMAXSA-N 457.955 0.601 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc3c(=O)[nH]c4ccccc4n3n2)[C@@H]1c1cccnc1)[C@H](O)CCl 1803142728 HHHUZKYCOUVQHL-BMGDILEWSA-N 495.927 0.885 50 20 JCGD CC1CCN(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1803387857 KEHFBSGHQHUISZ-ZJSXRUAMSA-N 464.375 0.813 50 20 JCGD O=C(Cn1nnc2ccccc21)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804016920 PRFONIZWGHYVSN-DVECYGJZSA-N 484.325 0.526 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n(C)n1 1804923550 LAIQKUDARQWCCZ-FOIQADDNSA-N 478.513 0.456 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364833 UKSOWCRTVIKPPF-WIYYLYMNSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C2CCC(CO)CC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369856 XJLYSHXCJQAKCS-OVFRKTKQSA-N 465.359 0.880 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807370580 HAMWAMKDUQEXOB-PZJWPPBQSA-N 463.347 0.363 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375539 PWFIZCNAHSWGLN-WIYYLYMNSA-N 470.298 0.438 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1 1808416294 LDXUYKDJHHFNOZ-XZLWZSMOSA-N 490.524 0.478 50 20 JCGD O=C(O)c1cnncc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809977596 ILQSJBCNQXTXAE-UHFFFAOYSA-N 452.276 0.013 50 20 JCGD Cc1nccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810301932 DXFCBVJAVMVYOQ-OXJNMPFZSA-N 460.498 0.812 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810322447 KIDTZJIDKPCRKK-NBCNXNJRSA-N 474.330 0.372 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)C(=O)C(=O)O 1812392364 PESBXHIENCCWAB-IACUBPJLSA-N 459.272 0.321 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1814132306 UDUGBJQFDATARF-CNNODRBYSA-N 460.579 0.765 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)CNC(N)=O)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1814229150 ATDFKZGXQCICBW-UGKGYDQZSA-N 496.572 0.102 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815364748 ZEFNOJBFMAQSLA-KDOFPFPSSA-N 492.366 0.867 50 20 JCGD C[C@](O)(C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(F)(F)F 1817474173 OACUUQWKVKVGRK-KSSFIOAISA-N 454.214 0.709 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC(=O)NC2)[nH]n1 1819400838 VFMKJFILAUJVJL-BLLLJJGKSA-N 454.491 0.240 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOC1=O)CC2 1819797208 PWLZXEJLDOGCCB-LLVKDONJSA-N 473.515 0.210 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)/C=C/C(=O)NCc3ccco3)sc2C1 1820061657 YORRHODKOCBBBG-NPQIQWPPSA-N 488.570 0.894 50 20 JCGD C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2 1825642220 PTBLLJUAVCAVAZ-NKWVEPMBSA-N 467.309 0.278 50 20 JCGD CNc1nsnc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826081396 QLIRYLLJCUMCQD-SECBINFHSA-N 452.566 0.635 50 20 JCGD Cc1cc(NC(=O)CC(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)no1 1826085977 IKHWEGTWYVGTQM-GFCCVEGCSA-N 477.547 0.753 50 20 JCGD Cc1cc2nnc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)CC3)c(C)n2n1 1827052965 QPKMKNZTESKHOV-OAQYLSRUSA-N 490.373 0.968 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1831655309 VVPJAMTVUOCRFB-QVKFZJNVSA-N 463.922 0.567 50 20 JCGD COCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549126 GFESBUYCJRUJKH-YWZLYKJASA-N 463.959 0.611 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832755368 HJRUYNPCZBHKRL-HRAATJIYSA-N 467.906 0.041 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3ccc4sccc4c3=O)CCO2)C1 1832895720 AMISATJUUZRWKE-HRAATJIYSA-N 483.974 0.773 50 20 JCGD Cc1cc[nH]c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1833546950 OAQOICNBGKCTCZ-RUZDIDTESA-N 498.584 0.739 50 20 JCGD C[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)Oc1ccccc1 1835931993 KGDVQWZZBOIZLI-KBMIEXCESA-N 482.342 0.294 50 20 JCGD CCCOc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939632 WDXLDMCQODMGPP-RUZDIDTESA-N 482.342 0.539 50 20 JCGD C[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)Oc1ccccc1 1835939860 LGOZLAGOWIICBV-UQBPGWFLSA-N 482.342 0.294 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1 1836337475 DALNHQNKXVSSNF-UWJYYQICSA-N 456.971 0.942 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@H]3[C@H]4SC=C[C@H]43)CC2)CC1 1836511511 CUVUMODGANCXIR-SXLOBPIMSA-N 470.599 0.745 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1837527531 PFVGGVVVTJEAHS-CLBJDOSESA-N 462.341 0.757 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cccn4cncc34)CC2)CC1 1837919224 RMQBDFOGOWPVFC-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1sccc1Cl)CCO2 1838227995 XWCRYHUDDKGTFY-LJQANCHMSA-N 458.968 0.845 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838386339 LKNHIBTTYJDWJS-HXUWFJFHSA-N 473.574 0.870 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1 1838433818 BJEQJSKWTAFAIG-SUMWQHHRSA-N 462.385 0.920 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1839153766 RUFNXSDCSHBTJE-CVEARBPZSA-N 450.279 0.624 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)nc2nccn12 1839550697 ZCCFVMZGQHNAFX-KSSFIOAISA-N 470.299 0.798 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ccoc13)CCO2 1839586874 XEAWFWKDSKWMRW-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)[S@](=O)c1ccccc1)CCO2 1839673871 DQTGTGDJKQDNGG-RMWUIZLJSA-N 472.991 0.893 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)[C@H]3SC(=N)NC3=O)C2)C1 1839964652 YBKNFWNHBRHCIE-WLHTULFXSA-N 491.408 0.419 50 20 JCGD Cc1ccn2c(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cnc2c1 1840184806 CHVNRBGOQFSLOO-HSZRJFAPSA-N 472.546 0.086 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc(C)c1O 1840187197 LXQYRCMZWNQOFD-HSZRJFAPSA-N 462.547 0.452 50 20 JCGD CC(C)(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1)NC(=O)OC(C)(C)C 1847580876 AGYQPEAMSIEVDJ-ROUUACIJSA-N 459.352 0.875 50 20 JCGD O=C(CSc1nnc(N2CCOCC2)n1C[C@@H]1CCCO1)NNC(=O)c1ccc(F)cc1 11373945 DNJMCOQRCSVVBA-INIZCTEOSA-N 464.523 0.986 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c1ccccc1F 28854813 XSSKQDBODAVHOA-UHFFFAOYSA-N 473.866 0.770 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c1C 115999937 CWASVMMRSANRPT-IZQLPPHKSA-N 451.593 0.913 50 20 JCGD CC(C)[C@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)CNC(=O)c1ccco1 725740488 WGUWCJUMHKTQKB-IBGZPJMESA-N 494.526 0.321 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(C(=O)Cc2c[nH]c3ccccc23)CC1 725870530 JTGNETHFTHPBCY-UHFFFAOYSA-N 452.471 0.618 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCNC(=O)c2n[nH]c3ccccc23)cc1 728064940 IOETYTZPHIHFLX-UHFFFAOYSA-N 472.527 0.459 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)C(F)F)cc2)c1 728974240 JDVRHHMCCZHQIP-UHFFFAOYSA-N 490.510 0.806 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCCn1cccn1)c(=O)n2Cc1ccccc1 745421010 GYZOYMYBEGAPKB-UHFFFAOYSA-N 478.513 0.252 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 762930172 PBALNJMBKRGJIE-IBGZPJMESA-N 489.506 0.615 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@H](C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)[C@@H](C)O)cc1C 777289188 CGOGOSACUKTXIF-KUHUBIRLSA-N 497.957 0.989 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1C 904224881 DERSNCWMCUUTJF-UHFFFAOYSA-N 478.483 0.837 50 20 JCGD Cn1cc(S(=O)(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)cc1C(N)=O 912979382 NUERYZRRXITLTB-UHFFFAOYSA-N 483.553 0.610 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1 914458943 SVBNQIOLKWHGKD-UHFFFAOYSA-N 476.511 0.046 50 20 JCGD CCCSCC(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 918017342 SXBWBHBALZDQDR-UHFFFAOYSA-N 458.544 0.719 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)C1 919887124 ZKOAYPUCSKNUGY-LZWOXQAQSA-N 472.589 0.484 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1OC 920738484 PRYLBJPZRXCHBE-HUUCEWRRSA-N 472.564 0.019 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H](C)OCC1CC1)c(=O)n2Cc1ccccc1 920820536 LIRYGAOOROAVKR-HNNXBMFYSA-N 468.514 0.390 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cnn(-c3ccccc3)c2)cc1 921017986 UYSROTIXLDLJEH-UHFFFAOYSA-N 463.541 0.811 50 20 JCGD COc1ccc(OCc2ccccn2)c(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)c1 921259095 WHABDXXWQHJYSJ-UHFFFAOYSA-N 470.511 0.704 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 921305048 BGDITPJWONOMFT-HNNXBMFYSA-N 484.575 0.701 50 20 JCGD Cc1nc2[nH]n(C)c(=O)c2c(C)c1CCC(=O)NNC(=O)C1CCN(c2ncccn2)CC1 1321585672 RVWFCUQXJBMQQO-UHFFFAOYSA-N 452.519 0.665 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)cn1 1777800397 OUTDKLUKPSYAGO-SQGPQFPESA-N 473.979 0.353 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccnc(Cl)n1 1779680552 RMJAOAPQNWFGDC-DYESRHJHSA-N 458.711 0.251 50 20 JCGD COc1nc(C)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779848454 ALJGYLCKSRRUEF-NTKDMRAZSA-N 482.541 0.838 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1780428712 HYSVBCDSRJEWHO-RCZVLFRGSA-N 465.359 0.874 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2C[C@@]23C(=O)Nc2ccccc23)C1 1782005875 AEFVJXHBJODKIQ-LGZXMISNSA-N 497.596 0.783 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C)nc1C(F)(F)F)C2 1782212115 IPPXKCGWBRQWSG-FOIQADDNSA-N 488.511 0.939 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1782725856 KRBULAAVZYKKSG-QRGARVHWSA-N 493.568 0.347 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)n4[nH]cnc4n3)CCO2)C1 1783341481 FIUNXRGKDLFWTR-DIFFPNOSSA-N 453.297 0.035 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)C1 1783859601 NMIHJELLOIHPOJ-SPHHXRGISA-N 487.557 0.930 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)n1C)CCO2 1783935705 YBRJWOKPBKUNGR-LJQANCHMSA-N 459.469 0.860 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3ccc(C#N)cc13)CCO2 1783935925 ZWPJBSXAYSTJEF-JOCHJYFZSA-N 453.503 0.251 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)[S@](=O)c1ccccc1 1783936391 GQEVNFIOTWCKBL-XWJUPSSKSA-N 464.588 0.386 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3CCN(C)CC3)C[C@@H]21 1783968485 VISDBKXJJRSQFI-XSLAGTTESA-N 459.429 0.635 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C(C)(C)O 1785609901 MJTITWSWJSQPCO-LRDNONRASA-N 463.959 0.080 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786979488 PDNCFFUOHRYVRM-APTRMMRNSA-N 496.369 0.610 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3NC(=O)C4)C[C@@H]21 1787507867 VRQUOISJXYNNPF-JJJWMERFSA-N 492.536 0.909 50 20 JCGD C[C@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)n[nH]c21 1787950807 RQERMYDTVJNXLY-BMIPRAEKSA-N 452.320 0.046 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3Cc4ccccc4O3)[C@H]2C1 1788185352 BKMPEPBAUQXKOH-MEGFKASBSA-N 465.510 0.282 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)N3CCOCC3)[C@H]2C1 1788656537 QYLNIQZAHQBALO-BXGRNZEMSA-N 490.507 0.502 50 20 JCGD CN(C)C(=O)NCC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1 1789519752 IRPGFFSTPMXISX-UHFFFAOYSA-N 453.503 0.704 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1789707816 GGDCSWYFSRMMGA-QEJZJMRPSA-N 485.404 0.656 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn(C)n3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724720 MMUIKGRKFSWAFG-ZJOUEHCJSA-N 483.573 0.360 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)CCOC1 1789914001 QAOXMWPLRJVVLJ-DQKQSUEQSA-N 475.970 0.250 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1 1789922338 DDAOQRNFJQQCTL-HTVCTNPSSA-N 482.347 0.542 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)cc1F 1792647345 HTIKGRTVAYIMBS-KSPBDQMDSA-N 461.881 0.995 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(Br)cn1 1794158034 CFTKVBPISRTGCL-VTEUUUEMSA-N 482.379 0.349 50 20 JCGD COc1cncc(CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1 1794328468 SJJWNVZBJIUMSW-BJWYYQGGSA-N 452.515 0.973 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)c2c1 1795739022 MKBNYKSODMHIOF-MFKICJERSA-N 463.299 0.373 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(C(C)C)CC1)C2 1796439596 OUJHLLNMPPWQPJ-KBQLEIQFSA-N 472.590 0.830 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c(C3CC3)c1F)C2 1796440828 AMPCZSKVNVHDAT-SCBBBYKHSA-N 471.493 0.763 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1797587712 IXGJAXSROSSDPA-OREBXVKISA-N 498.374 0.647 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1798874730 TUHJGSUSIJKOAL-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD COC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799094907 JFVVJIYNAIPVEQ-OPVJXMOQSA-N 461.563 0.347 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095004 PHHKFXZCXYRITD-PYDYAWQMSA-N 474.606 0.296 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1799366509 QPTNJNQSCJOADY-BUONHZGMSA-N 482.347 0.542 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1800283870 HEJBLEAURZRIPE-DJBIQUGXSA-N 461.244 0.037 50 20 JCGD COCCOCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2 1800848032 SNTPVGIPOMXIBQ-VXIBKDFQSA-N 495.411 0.303 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)c(O)cc1O)C2 1801012822 ZWQVGDBXUBOSNU-SLAYPKMVSA-N 454.911 0.327 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801319633 KWISVTONBHGDJC-BKEDOTJMSA-N 470.555 0.464 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)CC1 1801938859 MGXOFSSHAQACAX-YYIAUSFCSA-N 457.955 0.743 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1802085276 NXARRNDCVFUXIK-ZUWCUPBKSA-N 465.906 0.567 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CN2CCNC2=N)[C@@H]1c1cccnc1 1803009521 WTGSDBGFAJKYMO-UKPHBRMFSA-N 451.369 0.958 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2CCN(C)CC2)[C@H]1c1cccnc1 1806918196 ZRGKJUXTTQMJMR-IRFCIJBXSA-N 451.999 0.979 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807374028 WMPMPQUORAAEKW-CVDCTZTESA-N 461.331 0.664 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375011 MAQIKBCMFZNGMW-SESVDKBCSA-N 451.332 0.654 50 20 JCGD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1C 1810298954 MSAUJCKUCYHNKA-UZLBHIALSA-N 462.514 0.755 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)CC1 1810913874 BQZZAFFFQPTMCM-HSZRJFAPSA-N 461.371 0.926 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2cnccn2)[C@@H]1c1cccnc1 1813072715 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Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476939 IAEFTWBDMCBDHL-LJQANCHMSA-N 450.308 0.978 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cn4ncccc4n3)sc2C1 1818462843 UDPIYECACUMIJX-LLVKDONJSA-N 477.510 0.724 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCn2ccnn2)n[nH]1 1822808988 ZPEFRMQADQWCQX-MRXNPFEDSA-N 452.479 0.396 50 20 JCGD O=C1Cc2cccc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3ccc(B(O)O)cc3)CC4)c2N1 1824200400 HYSKDVNJUSBHNF-OAHLLOKOSA-N 476.323 0.857 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1828128809 XABLXUPQMBKMPF-DOTOQJQBSA-N 458.349 0.354 50 20 JCGD O=C([C@@H](F)Cl)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H]3C[C@H](O)CN3)C2)C1 1829056573 NFUFQXDBTKHZSM-AYMMHLMVSA-N 482.940 0.696 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CCO2 1830574138 ZUMOEZCNBBAZGD-NJSLBKSFSA-N 494.383 0.112 50 20 JCGD CC(C)(C)n1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1Cl 1830724990 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COCc1oncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737818 DRQXTVKGAMDSKR-UHFFFAOYSA-N 485.545 0.319 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccc(Cl)cc3)C2)C1 1835930188 AROFUXABSJGTBY-SGIRGMQISA-N 498.772 0.894 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ccc(F)c1F 1835934566 YVHNZIKDKJEUFD-HSZRJFAPSA-N 474.269 0.337 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)c(F)cc3F)C2)C1 1835939231 IGBRDMPWPYXGJQ-JOCHJYFZSA-N 494.687 0.682 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1cccs1 1835939871 LNCFBLQNUCASRU-ZHRRBRCNSA-N 458.345 0.302 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cccn3)CCO2)C1 1836165840 DOQZSOCQJHRNDQ-HRAATJIYSA-N 485.969 0.472 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)COC4)CCO2)C1 1836568004 BKAQGBJKDZNECZ-DEOSSOPVSA-N 481.509 0.099 50 20 JCGD Cc1cccc(C)c1SCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837705798 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CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccccc1)CCO2 1840121244 LPEQWUNSSGPWHJ-ROKPMTFOSA-N 458.559 0.620 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C(=O)OC(C)C)C2)C1 1840150073 GCRRAWSBLCXFDM-HTAPYJJXSA-N 483.949 0.971 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C2)C1 1840182373 HRLNBSJTDAIGAB-SOAGJPPSSA-N 476.496 0.548 50 20 JCGD CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840914226 OQQJDQDRKHEJAJ-PNLZDCPESA-N 492.013 0.982 50 20 JCGD O=C([C@@H](O)c1cccc(Br)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011916 KFWGUSDNPOLMRJ-SFHVURJKSA-N 473.132 0.680 50 20 JCGD O=C(c1csc(Br)n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013848 VGDZHFFRQRWPHD-UHFFFAOYSA-N 450.123 0.716 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844361501 QWVLBHBNIMQJQH-GOSISDBHSA-N 472.590 0.841 50 20 JCGD COC(=O)N(CC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)Cc1ccccc1 1846260138 OAHWPRKQKCHUTL-UHFFFAOYSA-N 480.525 0.771 50 20 JCGD CC(=O)N1CCc2cc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c3ccc(C)cc3)ccc21 15244227 JRWFTRSNQSKPHO-UHFFFAOYSA-N 480.568 0.534 50 20 JCGD CN(C)N(C(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCO3)CC1)[C@@H]1CCS(=O)(=O)C1 24768111 BZHYLNFOOUPDDO-MRXNPFEDSA-N 487.600 0.351 50 20 JCGD O=C(NNC(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C1CCN(c2ncccn2)CC1 728959645 OOQFEYXJCWSJJG-UHFFFAOYSA-N 455.479 0.559 50 20 JCGD CC(=NNC(=O)[C@H](C)CN1C[C@@H](C)O[C@H](C)C1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 729816570 OPGWPXCJHXRDNL-BZUAXINKSA-N 488.632 0.998 50 20 JCGD O=C(COc1ccccc1Cc1ccccc1)NNC(=O)NCCS(=O)(=O)N1CCOCC1 748110902 DAKRUDLVMMJQKV-UHFFFAOYSA-N 476.555 0.649 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2cccc([N+](=O)[O-])c2)CC1)[C@H]1Cc2ccccc2O1 748340694 BZDRYKWRWBAUAV-GOSISDBHSA-N 475.483 0.646 50 20 JCGD C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 803369319 OBNSWUMWOXDHNN-YVEFUNNKSA-N 497.913 0.537 50 20 JCGD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)NNC(=O)c1cc2c(s1)CC[C@@H](C)C2 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Cn2cncn2)C1 1779497232 HJVYZFYYYPEOCD-IERNEYDSSA-N 484.561 0.562 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1 1780224335 TZCHNMGZVCZMJQ-OAQYLSRUSA-N 484.904 0.367 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C=CCN1)C2)NC(=O)NCc1ccccc1 1780559436 MGHFJMLUOPYYMM-BPYKYCOYSA-N 484.601 0.375 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)n1 1781332147 UMDTUJMASQPYET-KDOFPFPSSA-N 459.316 0.807 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)NC(=O)c1cnccn1)C2 1782175408 LOTZOLHCOQJRMT-GYQJYAJYSA-N 467.954 0.363 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(Cl)ncn1)C2 1782212289 PIANFXFDFRTYJI-FOIQADDNSA-N 452.943 0.631 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCn2ccnn2)C1 1782563938 AMGJBKWRYDZWLF-IINOVHIQSA-N 470.534 0.316 50 20 JCGD 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O=C(NCCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccc[nH]1 1827055835 HAUQZJOHBMVFDS-QFIPXVFZSA-N 480.374 0.748 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc3ncnn3c2)CC1 1828733494 IYVBAEDVIVKWKI-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cc2cncnc2)CC1 1828923433 KEJQEUBJCKBUIB-FQEVSTJZSA-N 451.531 0.951 50 20 JCGD O=C(c1c(Cl)ccc2c1OCO2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830727681 AUFCUNAIXWVALA-YJYMSZOUSA-N 461.298 0.738 50 20 JCGD O=C(Cc1ccc(Br)nc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733528 OQVQBOXAVQPPAL-KSSFIOAISA-N 476.755 0.443 50 20 JCGD CN(C)[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccccc1Cl 1830736047 QEUGNMJSTVYUHU-WFXMLNOXSA-N 474.385 0.999 50 20 JCGD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1831113549 SYWABGUKHAUUKC-RXVVDRJESA-N 480.905 0.606 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H]3COc4ccccc4O3)CCO2)C1 1831235847 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471.518 0.035 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)c3ccccc3)CCO2)C1 1840800697 OSRFRDHBZSOHJG-AVRDEDQJSA-N 467.950 0.517 50 20 JCGD COc1ccc(CC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c([N+](=O)[O-])c1 1843014573 AFMVYTBKRVMZMQ-UHFFFAOYSA-N 453.260 0.343 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1844692857 RZKLIYRCOXZPSF-QGZVFWFLSA-N 462.459 0.488 50 20 JCGD C=CCC(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1846376675 YGYZYVQBCNANBZ-IBGZPJMESA-N 471.363 0.582 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnc(-c2ccccn2)nc1 1848294451 AMWLFMKYAKENOR-OALUTQOASA-N 458.482 0.666 50 20 JCGD Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1[N+](=O)[O-] 15562732 DTBBWPBOOWLWTH-UHFFFAOYSA-N 484.512 0.547 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1S(=O)(=O)NC1CC1 21967832 PJRLXNUZTYXIKD-UHFFFAOYSA-N 481.556 0.504 50 20 JCGD CC(C)(C)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CNC(=O)c2ccco2)cc1 725739627 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JCGD COC(=O)c1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1784156686 PSNNWHOEJVPQMB-XMMPIXPASA-N 481.509 0.158 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3CS(C)(=O)=O)[C@H]2C1 1785685517 RIRUSJFKHQEKQO-MBGYTDRXSA-N 473.979 0.473 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)CCN3C(=O)C=CC3=O)cc2)CCC1 1786552445 KXVPCSMYPDHMFR-UHFFFAOYSA-N 476.493 0.748 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3occc3Br)C[C@@H]21)c1ccc(B(O)O)cc1 1786979767 FQHJPAOUAWPLSK-QRTARXTBSA-N 477.120 0.629 50 20 JCGD O=C(CCN1CCOCC1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788140621 BMLPNONTPOSELG-UHFFFAOYSA-N 451.332 0.836 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3csc4c3c(=O)n(C)c(=O)n4C)[C@H]2C1 1789702698 BUAIYZLKBIEQOA-HNKHHVNMSA-N 497.017 0.838 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(C#N)c1 1789843338 IQNAUNUGVFXZGR-YYWHXJBOSA-N 471.558 0.462 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C[C@@H]21 1791292226 ITQLNRSZTRQIPN-FNHZYXHNSA-N 479.509 0.629 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ncccc13)C2)c1ccc(B(O)O)cc1 1795736663 ABLHRNXDWSGIQO-OPMZPASUSA-N 462.315 0.079 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1 1795851113 BUEVFKOKSZUUMM-ACDBMABISA-N 470.356 0.264 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)nc1)C2 1796439625 SKRZYLFJBBQGPV-FKWFMORESA-N 470.505 0.877 50 20 JCGD COCc1c[nH]c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1 1796441712 UDRCHHBPMAJPHC-WVNFENISSA-N 456.503 0.498 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCOCC2)cc1 1796491409 XSQRAOTZRRLIRL-OPMZPASUSA-N 494.552 0.039 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1CCN(C)CC1)C2 1796892247 RQTFBSHEOYJROB-PNFLAOTCSA-N 457.579 0.396 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]12C[C@@H](CO1)N(C(=O)OC(C)(C)C)C2 1799156475 SVKHRHGWZHBJOC-WHDKQWSOSA-N 487.981 0.608 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799342025 DANICGRGAKDBAP-XVIXHAIJSA-N 482.347 0.542 50 20 JCGD COc1cc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(F)c1 1799590647 ZVEZYZJOPSBSLH-VTEUUUEMSA-N 460.242 0.170 50 20 JCGD CC(C)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1 1800335436 UTLBWRHPDOVANL-SVZOTFJBSA-N 487.022 0.021 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2 1800754103 FLVVSKQLRPPHAN-UXXRCYHCSA-N 478.384 0.635 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3ccc(C#N)cc13)C2 1801013198 WJLOHTAEUGDXSM-YVWYUNDQSA-N 453.503 0.011 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccccc1C(=O)OCCO)C2 1802337488 YIIOWSYAHYADGC-BJWYYQGGSA-N 460.531 0.461 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1 1804580492 JRFXSPKFZGSZPB-XXBNENTESA-N 455.563 0.974 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)C(C)(C)C 1805804529 BBSYACQTVFKWIR-HXUWFJFHSA-N 457.380 0.762 50 20 JCGD CC(C)(NCCC#N)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1807148087 VAOONIICXWJNFD-PXNSSMCTSA-N 478.557 0.682 50 20 JCGD Cc1nnsc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365135 WADOPOAXVLCFJG-SJLPKXTDSA-N 451.317 0.555 50 20 JCGD COCCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1808653107 OPDLUEJJKGQRDO-SIKLNZKXSA-N 477.330 0.238 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc2ncccn2n1 1809765228 SZHAPHBGRZSODA-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD O=C(O)c1cc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)ncn1 1809969394 UJVBVYPQHFKAIE-UHFFFAOYSA-N 452.276 0.013 50 20 JCGD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1C 1810298948 MSAUJCKUCYHNKA-OXJNMPFZSA-N 462.514 0.755 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccnc1 1810301834 CREWFPVZXHAAAU-IFXJQAMLSA-N 478.469 0.950 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810356056 HDSRIFXYSOUCCQ-YPXOPSQDSA-N 480.330 0.610 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813089844 AJXNHANHTAETFJ-HOJAQTOUSA-N 457.361 0.195 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)/C=C/c2cnc[nH]2)[C@H]1c1cccnc1 1813301061 PKVVLPCXGGJVQE-PPCRGMIQSA-N 460.498 0.836 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)c1ccccc1)CC2)c1ccc(B(O)O)cc1 1815339637 LHVRZTWROAPUCQ-APWZRJJASA-N 451.313 0.782 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360744 YDBHVWDQTDLYKV-JJBLJPBOSA-N 494.338 0.819 50 20 JCGD COCCn1nccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474191 AFEXQCWMVIJFOY-SFHVURJKSA-N 466.307 0.552 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1 1817815648 OTVZIDPYFHZMNW-CYBMUJFWSA-N 459.543 0.693 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc2ncnn2c1 1819395499 QGCBXIKRBVRMIO-HNNXBMFYSA-N 462.300 0.405 50 20 JCGD O=C(/C=N/N1CCCCC1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1819774756 UHVBNTZMCKWDSU-DXRSZSRVSA-N 455.349 0.520 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1821684469 HXEGKGUXCAXDQZ-GUYCJALGSA-N 458.280 0.957 50 20 JCGD COc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)nn1C 1821766093 PXVYTNSOVNSWFO-CYBMUJFWSA-N 455.305 0.105 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1824529142 YZWFKABGHXFJJC-FUHWJXTLSA-N 458.625 0.660 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCSCC2)CC1 1828922312 RMNCBXJKYITZST-HXUWFJFHSA-N 474.631 0.967 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829051231 SFWMZILWAXCRKC-UTKZUKDTSA-N 453.352 0.528 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2)[C@@H]1SC(=N)NC1=O 1830358105 QGUMFNPYJQCQEJ-JMERFSKESA-N 460.984 0.510 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCCO3)C2)C1 1832549313 MDNKRIDPAPIKOM-GCKMJXCFSA-N 475.970 0.754 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1 1832590940 QRTUWHYRMIQWRW-DYESRHJHSA-N 472.007 0.816 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H]3Cc4ccccc4CN3C)CC2)CC1 1833709994 JPXSWDJFZXWQFO-DEOSSOPVSA-N 498.672 0.988 50 20 JCGD Cc1ccc(OCC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834537143 AMUVYRRCJXYNOK-UHFFFAOYSA-N 479.386 0.939 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1834559369 JXYCBDFWMPXJOF-NRFANRHFSA-N 467.954 0.486 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834821648 SDBRUFQJNOWRNO-WMLDXEAASA-N 461.382 0.254 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(C)cc3)CCO2)C1 1835162087 BSRLQVZKLWTOJE-WINMZROPSA-N 497.552 0.964 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1C 1835209010 OUDQWJZWGAMDOP-UHFFFAOYSA-N 467.574 0.831 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1C 1835931377 PPNFLJVEOAIDRC-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD O=C(CCN1Cc2ccccc2C1=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836589931 HJUHDLSTCOVAJN-XMSQKQJNSA-N 465.934 0.089 50 20 JCGD O=C1Cc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)ccc2N1 1836790246 CRNSECSOWMRXTR-QFBILLFUSA-N 470.295 0.942 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1 1836815058 JBRDWJWLKWBOKN-XIKOKIGWSA-N 452.309 0.811 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3c(c1)CNC3=O)CCO2 1837150506 QSKOXBSIKUWKCM-QFIPXVFZSA-N 461.591 0.852 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)N1C[C@H]3C[C@@H]3C1)CCO2 1837289788 WWKZIUOXBXCEFV-HAJKQMQPSA-N 458.397 0.957 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)(Cl)Cl)C2)C1 1837460333 BPVIKHRFAVTMGI-MRXNPFEDSA-N 480.736 0.125 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1837582327 SNBCUYYPLMKVTP-MRXNPFEDSA-N 467.954 0.493 50 20 JCGD CN1CCN(C2(C(=O)N3CCO[C@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)CC2)CC1 1839106300 YAXTZRSDNQNCJW-NRFANRHFSA-N 457.015 0.488 50 20 JCGD O=C(c1cnn2ncccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198876 DSOZKYAMJDMLAQ-RHSMWYFYSA-N 456.272 0.490 50 20 JCGD O=C(c1ccc2nonc2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200709 LLAVAAXPBYLQEH-YOEHRIQHSA-N 457.256 0.983 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1839947406 NNHZHWZCDPBMFA-BVZFJXPGSA-N 481.553 0.867 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1839964207 KARBAPQPLOSNFK-RVKKMQEKSA-N 475.409 0.643 50 20 JCGD COC(=O)C12CC(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](C)Br)C4)C3)(C1)C2 1840007143 QAGLEKYBHNQGCS-GPIZFROPSA-N 459.337 0.570 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1 1840153678 XLJKMFYSFOKEKL-IFXJQAMLSA-N 463.865 0.567 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CC1 1843009769 HMDFQJXZGDACIN-UHFFFAOYSA-N 457.336 0.488 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013395 DTJRWAFIDUJNAS-UHFFFAOYSA-N 460.299 0.697 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013622 QQKNBVIWSYAGKI-UHFFFAOYSA-N 451.288 0.457 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2nc3ccc(C(F)(F)F)cn3n2)C1 1843155393 APDJVPUCSAGVFA-UHFFFAOYSA-N 488.430 0.877 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)ccn1 1843416070 VHYRLIUTDWOISB-VULFUBBASA-N 451.487 0.991 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1843886273 OSFWTYXMMMTWMF-HKUYNNGSSA-N 489.353 0.779 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1=C3c4ccccc4C(=O)N3CC1)C2 1844264574 JJXJNGQFFKEZKR-UHFFFAOYSA-N 472.505 0.773 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CCCC23CN(C(=O)[C@@H](F)Br)C3)C(=O)C1 1847124402 NRUYODBOORZAJE-OAHLLOKOSA-N 491.358 0.960 50 20 JCGD COCCCNC(=S)N(C)NC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1 726077572 ZYEIEHBYCJALCE-UHFFFAOYSA-N 458.484 0.738 50 20 JCGD COc1ccc(C(=O)N[C@@H](C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c2ccccc2)cc1 727105208 VIYCKPAICPYTCC-SJLPKXTDSA-N 460.512 0.684 50 20 JCGD O=C(NNC(=O)c1nnn(-c2ccc(F)cc2)c1C(F)(F)F)N[C@@H]1CCS(=O)(=O)C1 748232319 QWESTUWQWGRSTD-SECBINFHSA-N 450.374 0.556 50 20 JCGD C[C@@H](NC(=O)c1cccs1)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 813303444 TZSIKURFZLIGKD-OAHLLOKOSA-N 494.595 0.668 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccccc2S(C)(=O)=O)c1 873921170 XANOPORWYZQVAX-UHFFFAOYSA-N 489.597 0.744 50 20 JCGD CC(C)CN1CCO[C@H](CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1 915922973 QXFKQRWLSBYIAL-QGZVFWFLSA-N 469.612 0.001 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CCCc1nc(C)no1)N(S(C)(=O)=O)CC2 916158953 AADJYLPZOPLOSB-INIZCTEOSA-N 495.558 0.814 50 20 JCGD Cc1cc(/C=C(/C#N)C(=O)OCC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1C[C@H]1CCCO1 916437946 RERCKLJDJFMPNC-FQCNOMQSSA-N 492.554 0.747 50 20 JCGD Cc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)cc1 919885256 LDLPPHXIBKCLOA-MRXNPFEDSA-N 480.568 0.951 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@H](C)OCC1CC1)N(S(C)(=O)=O)CC2 920805172 JBFYTVRDGWLIPA-SUMWQHHRSA-N 469.560 0.915 50 20 JCGD C[C@H](OC[C@H]1CCCO1)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 920999497 PVQYDEZQOYPXTM-FUHWJXTLSA-N 469.560 0.372 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CCN3Cc4ccccc4C3=O)C2)C1 1778186939 SXCACOCMLSCBJB-DEOSSOPVSA-N 471.558 0.235 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cncn1-c1ccncc1)CCO2 1779028518 MPOMFIDGXURADY-HSZRJFAPSA-N 476.497 0.023 50 20 JCGD C[Si](C)(C)c1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)co1 1779032534 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CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)CCO2 1783347743 OISGIARSHMYSPY-QLQJRFMMSA-N 461.382 0.792 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)CCO2 1783935160 QDVZWAZEUILVND-HSZRJFAPSA-N 454.531 0.893 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786982239 SRABKWZLUNNJDQ-LEAZDLGRSA-N 489.378 0.263 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1csc(-c2cccnc2)n1 1787540464 SMIWEQKOCRWCHU-CUWPLCDZSA-N 492.366 0.792 50 20 JCGD COc1ncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1F 1788611517 ICPUFZFKOQCYJS-IWEFOYFVSA-N 472.477 0.135 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]3C2)no1 1788764200 CZGQRAOGABXSOD-ZOBUZTSGSA-N 452.584 0.544 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]cc3I)[C@H]2C1 1788898831 NVIFGRSVXKKELU-ZPFDUUQYSA-N 496.733 0.861 50 20 JCGD 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CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cn2ccccc2=O)[C@H]1c1cccnc1 1807443047 RJVZDLWPLBKLJY-WZONZLPQSA-N 454.531 0.322 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808417734 OLXDEWFJRCQHLR-GSNRYTIQSA-N 499.528 0.286 50 20 JCGD Cc1nnsc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1808648060 RVNQKVDZQSJNJT-YOEHRIQHSA-N 466.527 0.873 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC2(CCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)CC1 1810260166 YPDMFYUGKDONPN-AWEZNQCLSA-N 458.968 0.937 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)[C@@H](O)N1CCOCC1 1810351845 QFUMAROTEHCAJY-YRBFXIGRSA-N 459.316 0.429 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)C1 1815335642 ITLKWSQCYNANRZ-IIAWOOMASA-N 471.344 0.638 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339561 HBIAAPXZLOPVJT-CZUORRHYSA-N 465.344 0.944 50 20 JCGD Cc1noc(N)c1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819795831 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O=C(NC1CCN(C2CCN(C(=O)CCc3ccc(F)nc3)CC2)CC1)c1cccc(B(O)O)c1 1834799840 HFHQOFABHUPBLG-UHFFFAOYSA-N 482.365 0.719 50 20 JCGD CCOc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1 1835737793 ANDCFIPDESOPFZ-UHFFFAOYSA-N 496.572 0.373 50 20 JCGD Cc1cccc(Cl)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835932107 OCGQZUJDNGALEM-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c[nH]c3cnccc13)CCO2 1837180289 VOXWGOJQPCUKNO-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cnc4[nH]ncc4c3)CC2)CC1 1837919346 ZUGMIYVKXSRLPV-UHFFFAOYSA-N 477.330 0.564 50 20 JCGD O=C(c1ncccc1Br)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838073677 JLKGFBZODMIHFT-DYVFJYSZSA-N 462.728 0.514 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838106706 IOMQZDRPKHBSCM-INIZCTEOSA-N 453.584 0.225 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)N3CCN(C)CC3)CC2)CC1 1838627106 JMTIWMUEPFMWMU-XLIONFOSSA-N 459.031 0.875 50 20 JCGD O=C(c1cc2ncccn2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201504 ZIIYPKQHBIBPJO-WMLDXEAASA-N 456.272 0.490 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839204322 NMBCVRZGTWGFIL-ORAYPTAESA-N 484.377 0.522 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@H]1F)CCO2 1839770674 MGHSGAIXKDLMOV-HZUJVAHNSA-N 465.434 0.948 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1839964967 JXICOHYWMLGIOO-KUHUBIRLSA-N 471.352 0.909 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(=O)OC)nc3)C2)C1 1840152218 BDGPTZJQJSNZOT-YWZLYKJASA-N 455.895 0.192 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1 1840184302 ZBKAJZZASDVAOO-SFHVURJKSA-N 464.485 0.548 50 20 JCGD C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)[S@](=O)c1ccccc1 1844264980 GBTBUCJZWYVLGG-ZZQXMTQJSA-N 455.540 0.698 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1F 1846893616 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O=C(CCBr)N1CC[C@@]2(C1)CN(C(=O)C(O)O)CCN2C(=O)OCc1ccccc1 1828522478 CNXWOKXKOWHZJU-HXUWFJFHSA-N 484.347 0.534 50 20 JCGD O=C(c1nc[nH]n1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829033998 PWCCIWFWXQQPQW-IERDGZPVSA-N 476.921 0.470 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829049849 HRWWXQHYXVIIFN-LAUBAEHRSA-N 453.352 0.528 50 20 JCGD CNC(=O)CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCN2C(=O)OCc1ccccc1 1829341127 XNZOQOYFCBMLOK-MBSDFSHPSA-N 494.976 0.828 50 20 JCGD Cc1c(Cl)cccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830134639 JZCSXBSFLFFIMY-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C2)C1 1830726961 YGTOBCOMVVSWQB-LVCYWYKZSA-N 451.907 0.236 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)C1 1830735281 FSFUOTVYZJBUDL-XXBNENTESA-N 495.960 0.311 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1)n1ccnn1 1831170696 JAWUAWNLMICQFC-HNAYVOBHSA-N 454.535 0.771 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1[nH]ccc1C)CCO2 1833543796 YMOFEACVJHUQNZ-NJRDNMGOSA-N 456.503 0.527 50 20 JCGD CC(C)(C)OC(=O)CC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833608252 LCXLBHRONWLJFW-UHFFFAOYSA-N 488.589 0.602 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n(C)n1 1834188695 YZKXJQLTJXAARR-UHFFFAOYSA-N 468.562 0.226 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccn4nccc4c3)CC2)CC1)c1cccc(B(O)O)c1 1834801104 MHPBLQNJAAQILW-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)o1 1834801313 XQTDOWZYAODVAR-UHFFFAOYSA-N 482.346 0.417 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1 1834824232 YRSRXWHSBQEBPA-KRWDZBQOSA-N 470.349 0.941 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835116284 FMIZYOGNLPPUIF-AGKHUZRLSA-N 497.600 0.550 50 20 JCGD CNCCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1835663231 UGLLFIRNDRVEDL-JOCHJYFZSA-N 478.502 0.590 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1835933734 BPRIRSZNOKJFIY-AVRWGWEMSA-N 482.342 0.249 50 20 JCGD O=C(c1cc2ncccn2n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836872739 KTYXDJMWKDHDCT-YOEHRIQHSA-N 456.272 0.490 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3noc4ccccc34)C2)C1 1837457721 NJQKFZIYWLLZIC-XMMPIXPASA-N 494.508 0.139 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)sc1C 1837459693 MIMJZMKEHSOPCJ-NRFANRHFSA-N 474.543 0.142 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1 1837653613 IQRMHXYCKLUVRH-QGZVFWFLSA-N 462.385 0.921 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1 1837679131 FJXCZYBYKHNDAE-ZRGWGRIASA-N 462.385 0.921 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccn1 1837919506 ZMWLBWDOHMXQDW-UHFFFAOYSA-N 494.357 0.646 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)C=CC3=O)CC2)CC1 1838432005 JXKSRFTXUGKDEA-UHFFFAOYSA-N 451.596 0.762 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c([N+](=O)[O-])cc1O 1838601857 WSHIDOCQHMSDPE-QAPCUYQASA-N 461.830 0.913 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(F)c1 1839259248 JTQOYSDODHEPSN-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)c(F)c3)CCO2)C1 1839271294 AAQDIWWNVQITPF-QFIPXVFZSA-N 491.907 0.861 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(CC#N)cc1)CCO2 1839361868 KTJKQUBBDHESLG-MJHSOURCSA-N 492.536 0.957 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(N(C)C)o3)C2)C1 1839963644 QWWPMFYCXAIUBP-FZKQIMNGSA-N 459.341 0.984 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cc(C)on3)C2)C1 1839965416 XTIVETNXSVVPEG-LIRRHRJNSA-N 487.351 0.343 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2 1839967266 HEIVIXPFAFKNCW-GJYPPUQNSA-N 462.385 0.921 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C2)C1 1840032044 MFCWLFRSLDVCQR-ZUOKHONESA-N 481.347 0.820 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1 1840033478 GQEOFRJPBAEONA-XIKOKIGWSA-N 452.309 0.811 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1 1840153259 IVBDPZCZGAVSPD-TVIVXCNVSA-N 463.918 0.732 50 20 JCGD Cc1ccccc1OCC(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184292 YPXHAMSTWCUHHV-QHCPKHFHSA-N 462.547 0.203 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840186551 ATSVJMZIJPJNSX-JOCHJYFZSA-N 482.965 0.792 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)cc3)CCO2)C1 1840728108 LAPWMBIAWQFTNR-WIYYLYMNSA-N 453.923 0.969 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@]2(C)CN(C(=O)OC(C)(C)C)CC[C@H]2O)C1 1841031051 CZOYSGIBAISKPZ-UZUQRXQVSA-N 495.621 0.571 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC12CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1841287622 YIVMQHIGHYSNJZ-CYBMUJFWSA-N 450.399 0.892 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1841584910 SFJYGURCVINBQR-ZDUSSCGKSA-N 451.973 0.757 50 20 JCGD CCS(=O)(=O)CC(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1 1841923945 HJPAWJSJEVTHKQ-ZDUSSCGKSA-N 451.973 0.757 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012384 KIQDRKWQESJOAG-LJQANCHMSA-N 471.363 0.877 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015555 ORQKIVPWUIDXPH-OAQYLSRUSA-N 467.306 0.070 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1844156478 GJRAYWIONXTUKC-QWHCGFSZSA-N 462.931 0.386 50 20 JCGD COc1cc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)ccc1[N+](=O)[O-] 1845148028 GUKPEZMGXSWBLS-UHFFFAOYSA-N 468.470 0.662 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1845541709 PJXONLXIYLTIHJ-UHFFFAOYSA-N 454.443 0.738 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 9788097 KSLDCGSBKCBJRG-HNNXBMFYSA-N 470.406 0.827 50 20 JCGD O=C(Cn1ncc2ccccc2c1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 23057806 RHMZRTYMQKPULL-UHFFFAOYSA-N 455.496 0.642 50 20 JCGD COc1cc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)COC3)cc(OC)c1OC 726372984 PCARDNLNGFYGEF-UHFFFAOYSA-N 465.484 0.482 50 20 JCGD CC(=NNC(=O)[C@H](C)NS(C)(=O)=O)c1ccc(S(=O)(=O)NCc2ccccc2)cc1 728437963 YYIUCVTUMUOMTP-HNNXBMFYSA-N 452.558 0.943 50 20 JCGD COCCCNC(=O)[C@@H](C)N1CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1 728941864 CSDZHPDZCIESGE-GFCCVEGCSA-N 459.345 0.290 50 20 JCGD CN(C)c1ccc(NC(=S)NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)cc1 729689712 FZWSELVWEKRYFO-UHFFFAOYSA-N 479.364 0.976 50 20 JCGD COc1ccc(C(=O)Nc2cccc(C=NNC(=O)CSc3nn(C)c(=O)n(C)c3=O)c2)cc1 730569110 NSQSVJOCDYHXOV-UHFFFAOYSA-N 482.522 0.982 50 20 JCGD C[C@]1(c2ccccc2)NC(=O)N(CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)C1=O 856530503 HURSNAGICCJVFY-RUZDIDTESA-N 478.553 0.813 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2cc(C)ccc2C)cc1 913449269 RLBJULKJFRLTKW-UHFFFAOYSA-N 463.512 0.985 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(N3C[C@@H](C(=O)O)CC3=O)cc2)cc1C 914746669 TUMWFYOZIXLPSS-AWEZNQCLSA-N 474.495 0.689 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1)NNC(=O)c1cccc(Cl)c1 914978399 CNYOYCVBXPAOHE-UHFFFAOYSA-N 471.875 0.572 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)c2ccccc2c1=O 916391576 DPUNLOJBXZBXRB-UHFFFAOYSA-N 491.508 0.133 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NC[C@@H]1CCN(C2CC2)C1 916577945 NBLNEWLLWJKSCU-SFHVURJKSA-N 479.603 0.455 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)Cc3ccc(Cl)cc3)n[nH]c2n1 917391866 KNCOCLZKPXAXBY-UHFFFAOYSA-N 463.955 0.940 50 20 JCGD COc1ccc(C(=O)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)c(OC)c1 917837240 ZKQURWKKLPLRQI-UHFFFAOYSA-N 471.470 0.831 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 920433525 WNKFFOIINHDVPU-ZDUSSCGKSA-N 495.535 0.454 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cccnc2N2CCN(C)CC2)nc1 921247109 ATHCAKWPHHMEED-UHFFFAOYSA-N 462.580 0.741 50 20 JCGD Cn1c(=O)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)nc2ccccc21 1778623827 PGNIEPHMOQHDHZ-GSHUGGBRSA-N 462.934 0.661 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1)NC(=O)NCc1ccccc1 1778672646 IELTZEXQAMPFOE-RUZDIDTESA-N 495.584 0.619 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1 1779037154 QZEIBPZRWPIJSN-NRFANRHFSA-N 470.442 0.056 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1780905409 UWKXHLQYGDQRCW-IZHWHUGBSA-N 498.515 0.086 50 20 JCGD Cc1nocc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969970 PNEYPZAFTWBMFG-HSZRJFAPSA-N 470.530 0.773 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnn(C)c1)CCO2)NC(=O)NCc1ccccc1 1780970294 UGHQAODEMHASJA-HSZRJFAPSA-N 469.546 0.210 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)[C@@H](O)C1 1781115748 UBPGFPJGDXCWTQ-WTOJCKNJSA-N 466.362 0.848 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781334640 QHAMWVVOKLFKDC-APWZRJJASA-N 455.328 0.904 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1 1781998105 UAYZEYMDVCJYQP-FKEXNYPISA-N 482.379 0.892 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1C[C@@H]1c1ccc(F)cc1 1783885874 RQXIRFLFVXIDDE-GEFFGTOZSA-N 466.318 0.903 50 20 JCGD N#Cc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786981697 GXMXPRIDFRNBLS-LRQRDZAKSA-N 451.263 0.284 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCc3ccncc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984675 XRBHFKJQIKEOGN-BVSLBCMMSA-N 451.332 0.378 50 20 JCGD COc1cc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(C)c1 1786984954 CODCENQFJSGBQN-NYVOZVTQSA-N 466.343 0.899 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786986681 XYUFVNDFUQPUKL-BVSLBCMMSA-N 474.326 0.664 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccn(C)n3)[C@H]2C1)NC(=O)NCc1ccccc1 1787048806 WKFWMYCAOOOMTF-BVSLBCMMSA-N 497.600 0.289 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788150573 YFLIRIRAUNMAHD-UHFFFAOYSA-N 490.281 0.884 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncc(F)cc3F)C[C@@H]21 1788611601 LZQZYLXEXNSBFZ-KCTSRDHCSA-N 460.441 0.265 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(CO)on3)C[C@@H]21 1789221754 AUWAECOGNNQFKL-ROOHIHILSA-N 488.453 0.908 50 20 JCGD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(O)n1 1789310213 VNOSGHMHTVHYJX-KKXDTOCCSA-N 454.487 0.001 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1791150140 XYWCOWLFKCFLAM-YZCXLBAGSA-N 482.317 0.821 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCN(C)C3)C2 1792872309 YWOLYUBOVPNWES-AFIMGQEJSA-N 468.396 0.953 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CC(=O)NC1=O 1794082499 FTQWDQOIOBLUNL-CRWXNKLISA-N 471.942 0.309 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(O)nn1)NC(=O)NCc1ccccc1 1794906446 DLKZMWCJDFKRCS-BCDXTJNWSA-N 467.530 0.780 50 20 JCGD O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(=O)OCCO)C2 1795114949 QGGXUSUYYLKSRQ-ZSBFGKGUSA-N 469.332 0.824 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cc(F)ccn1)C2 1796439617 RLLQJTUGQHBJKJ-BSBFHTJNSA-N 470.505 0.877 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCn1c(=O)oc3ccccc31)C2 1798440751 NOWUTLLUIXLEKK-MUJYYYPQSA-N 478.509 0.935 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2)[C@H](F)Br 1799346549 CKTWUWMAIBVCNL-DJBIQUGXSA-N 461.244 0.037 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@@H](Cl)COC)C2 1800979469 JKZOUSDWDLJPSI-RPUYLAQPSA-N 482.965 0.466 50 20 JCGD C[C@@H]1[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)CCN1C(=O)OC(C)(C)C 1801014473 VDMUSDLOKHCXIF-ZIKOTGLESA-N 495.621 0.595 50 20 JCGD Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(C)n1 1801230103 DKVDICOQPFYYMJ-JHDGKUDLSA-N 451.332 0.214 50 20 JCGD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)[S@](=O)c1ccccc1 1801276532 UCIQYGRUWFQRLK-SNTIRWHOSA-N 454.357 0.815 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCS(C)(=O)=O 1801531873 XPXIVYPFHXLPBP-HBCWATKFSA-N 483.499 0.158 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)ccc1[N+](=O)[O-] 1801838767 DDHHFSRMUWNQIC-YVWYUNDQSA-N 463.491 0.180 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H](F)CN1C(=O)OC(C)(C)C 1802204246 ALZKJUWAKWPUAS-WFNPHZEWSA-N 499.584 0.297 50 20 JCGD COc1cccc(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1804399476 OOEYVPYKRXNSSP-DVECYGJZSA-N 474.326 0.727 50 20 JCGD COc1nccnc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804971078 LNHMTAVGSOFDGE-XLIONFOSSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362813 NOWKHFOSDZWAEQ-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3ncccc23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365154 WLVJKDPRTWTESR-GCJKJVERSA-N 470.298 0.438 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)CS(=O)(=O)N2CCCC2)[C@H]1c1cccnc1 1808410976 DQOPRXOSRUSKBQ-ZIFCJYIRSA-N 472.995 0.767 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1810097553 LGKDNWPEEYSAAC-MGKPWUAXSA-N 499.528 0.286 50 20 JCGD O=C(COC(=O)C(F)(F)F)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810181305 CWYVIVMIWXYANU-QAPCUYQASA-N 479.220 0.187 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1 1810302018 DNXMKXHRIDCPBD-KKSFZXQISA-N 485.508 0.756 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1812939037 JPEZIJPNXDHPLB-ZJOUEHCJSA-N 487.981 0.383 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1 1813074247 WOBZXVJMVDYRCV-DYESRHJHSA-N 469.546 0.753 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1 1815329422 AJJQVRCECOQYBL-SNVBAGLBSA-N 461.580 0.951 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)[nH]n1)c1ccc(B(O)O)cc1 1817470304 OILQLRUBJUSCIQ-ZDUSSCGKSA-N 486.187 0.751 50 20 JCGD CC(=O)O[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(C)C 1817472068 FXMMJMRKIUXCIT-QUCCMNQESA-N 456.308 0.983 50 20 JCGD C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2 1822863988 WRSAMIFFSCJPDV-QZTNRIJFSA-N 471.330 0.731 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1823436414 CWRBUUAPWUODHI-HKUYNNGSSA-N 455.324 0.700 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](O)Cc3ccccc3)sc2C1)c1ccc(B(O)O)cc1 1825429726 ZBJMVVKOPUDCPX-IEBWSBKVSA-N 465.340 0.652 50 20 JCGD O=C(CNC(=O)C(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827055208 SANYFSHMYWAXED-QGZVFWFLSA-N 469.269 0.278 50 20 JCGD O=C(Cn1cccn1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829017658 NQLUIOJYADNHMY-AUSIDOKSSA-N 489.960 0.935 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1830450221 OWBXNIWLWMPROS-BVZFJXPGSA-N 482.342 0.249 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c([N+](=O)[O-])c1 1830736241 SAPUYZBVQAOEDF-UZLBHIALSA-N 485.877 0.051 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnc[nH]3)CCO2)C1 1832806627 DZMLNXZZJYNDKA-HTAPYJJXSA-N 499.996 0.931 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798883 GOEDCXVDLZHAQX-UHFFFAOYSA-N 496.329 0.479 50 20 JCGD CC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1834871469 DSGMMLXQMMWPDE-XMMPIXPASA-N 489.573 0.158 50 20 JCGD Cc1cnc2c(C(=O)NC3CCN(C4CCN(C(=O)c5ccc(B(O)O)cc5)CC4)CC3)cnn2c1 1835562938 WDWKDPSQFQPIKT-UHFFFAOYSA-N 490.373 0.217 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1 1835932111 OCLXYUSURYUOFG-NVQXNPDNSA-N 478.354 0.242 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1836875231 FLSKIUWIEPXDMP-MRXNPFEDSA-N 474.624 0.039 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)n1nc(C)ccc1=O)CCO2 1837659280 YDQWTXWWNPTUNO-KKSFZXQISA-N 499.406 0.917 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)C(C)C)C2)C1 1838527271 KTQYHVNBODZNIM-KNQAVFIVSA-N 479.486 0.607 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2 1838998024 AMEHCBGWGYBVNL-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1 1839024737 GHPSSGYKUFVTPE-DEOSSOPVSA-N 483.525 0.386 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ncccc3[nH]1)CCO2 1839492884 PBYMKWHQSPPQAI-SWOYFSSUSA-N 493.524 0.767 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nccc4nc[nH]c34)C2)C1 1840032741 JCTPIGBKGXYRKH-SGTLLEGYSA-N 452.309 0.811 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)C2)C1 1840150232 IBFQKUFWMZLCST-VBKZILBWSA-N 472.926 0.486 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccn(C(C)(C)C)n3)C2)C1 1840183703 VBADLGVEWGZAFL-QFIPXVFZSA-N 464.567 0.081 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4C3)C2)C1 1840184834 GAMNWJMTTUWDRF-BWKNWUBXSA-N 472.586 0.621 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1[N+](=O)[O-] 1840185757 WYCJXXJVOKSLBC-HSZRJFAPSA-N 491.545 0.275 50 20 JCGD CCSc1cccnc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185930 WNTOVLHOTKTDJS-JOCHJYFZSA-N 479.603 0.637 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840391292 YMVBXMUYUTWGBH-SBUREZEXSA-N 485.371 0.012 50 20 JCGD COC(=O)C12CCC(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)(CC1)CC2 1843011616 WPLCSPNJLMNMEQ-UHFFFAOYSA-N 454.332 0.697 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1843868241 HNWRFFZBDIBPSL-HSZRJFAPSA-N 471.363 0.831 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844264300 DNJVBGGAHAMUMJ-OAHLLOKOSA-N 472.546 0.759 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847565416 PMHXOLPDSWIURT-ZQDZILKHSA-N 461.943 0.634 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1nc(N)n[nH]1 1848099589 WZNUNGXJDCJTJJ-AVGNSLFASA-N 455.947 0.653 50 20 JCGD O=C(COC(=O)CCS(=O)(=O)c1ccc2c(c1)CCC2)NNC(=O)[C@@H]1COc2ccccc2O1 728327644 NGENICBDSHGXJC-FQEVSTJZSA-N 488.518 0.870 50 20 JCGD O=C(NC[C@H]1CN2CCC[C@@H]2CO1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 729620562 YTYZGPCWEDBKMD-SJORKVTESA-N 451.549 0.278 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@@H](C)N1CCOCC1 729624187 TXIZFMIGXOGTHP-DLBZAZTESA-N 467.592 0.914 50 20 JCGD O=C(COC(=O)CCC(=O)N1CCC(c2ccccc2)=N1)NNC(=O)[C@@H]1COc2ccccc2O1 780134313 AQZITHUZSWAENB-FQEVSTJZSA-N 480.477 0.934 50 20 JCGD C[C@@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)c2ccc(Br)cc2C1=O 894397365 VFGCXZWCMHCCPK-JTQLQIEISA-N 484.270 0.871 50 20 JCGD CCOC(=O)N1CCC[C@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 912895737 NVYRDANZGYPIKI-SFHVURJKSA-N 496.586 0.656 50 20 JCGD N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 913151328 AKQZBEMKFURHIR-UHFFFAOYSA-N 491.551 0.082 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)NS(=O)(=O)c2cccs2)cc1OC 915023717 VWDBBXHUYMYSDR-NSHDSACASA-N 471.513 0.437 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1 915076985 ATXCYGBRVXODJH-QGZVFWFLSA-N 485.609 0.951 50 20 JCGD CCCCN1C(=O)C[C@H](C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)[C@H]1c1ccc(OC)cc1 919886555 XPFRPBMELUZUQL-HHXXYDBFSA-N 466.560 0.902 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3N1)CCO2 1779036729 DGFSBDYBHAAALQ-WMZHIEFXSA-N 450.499 0.165 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3cccc(F)c13)CCO2 1779037326 WADDQUIJQJJKAN-JOCHJYFZSA-N 467.461 0.458 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1 1779120701 RGJONRQRBNGLQA-KPZWWZAWSA-N 457.325 0.574 50 20 JCGD CCNC(=S)NCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780777204 SVYAFAIQLKLUSB-PVXIVEMSSA-N 453.378 0.675 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1782654304 URWAPXQJNPUBQF-MWTRTKDXSA-N 452.515 0.402 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)[S@@](=O)c1ccccc1 1782681830 RAFBPWVQUMXFAE-YOHOVHIESA-N 470.356 0.006 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCNC3=O)CCO2 1782864471 MQKIUDGMWPPKQW-BFFNPARHSA-N 496.474 0.955 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783937465 RSINXWBTNPNRAM-QFIPXVFZSA-N 460.510 0.598 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@]3(O)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1784011181 ONIWDNPCWIACLS-JHVJFLLYSA-N 475.970 0.442 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1784786916 SCSKWFJCQNHBEK-NQCBRMCBSA-N 477.986 0.494 50 20 JCGD C[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)Oc1ccccc1 1786983136 KMFBROAIJANIAO-FUAMJQMHSA-N 466.343 0.817 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)[C@H]3SC(=N)NC3=O)[C@H]2C1 1787499779 ZALWZJZZWABPMW-LQSBQDLSSA-N 475.409 0.942 50 20 JCGD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)N1CCN(C)CC1 1788150318 CKMDUYGLPWLLRA-SFHVURJKSA-N 464.375 0.750 50 20 JCGD COCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726822 VCNJPISLHTUFLY-UFYCRDLUSA-N 461.563 0.349 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790754780 LCCYUUOUXLPFMC-LRQRDZAKSA-N 485.277 0.250 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCCCC3=O)[C@H]2C1 1791180551 KZIMQJBCLKSRPU-BODMQJBDSA-N 472.546 0.113 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC(=O)NC1 1792582751 HNQBWRZTCJGGDC-PUPWTTRCSA-N 458.465 0.988 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@H]2C[C@@H]2N1C(=O)OC(C)(C)C 1792994191 FASBHKSUQUSLSP-ABYCXSSWSA-N 493.605 0.347 50 20 JCGD C/C(=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C(=O)O 1793882742 VKAAGXOYCANFPD-REVMDSIMSA-N 459.927 0.739 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCCO3)C2)c1ccc(B(O)O)cc1 1795734403 NZWHSKIKPNYMJV-IRJINJETSA-N 464.327 0.137 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1795965029 PCMGULCOLCLKSJ-CCWDJLKJSA-N 466.542 0.895 50 20 JCGD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(-n2nccn2)c1 1798630083 PERSZISNNUDDFY-VPTLXERWSA-N 490.524 0.091 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)n(C(F)F)n1 1798678709 DKIKAQADOHXYBP-DRXBFXEBSA-N 463.445 0.102 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccncc1)NC(=O)NCc1ccccc1 1799109551 YUEOHDVSWNAPTE-RUMRUAAYSA-N 480.569 0.560 50 20 JCGD CN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1800011348 VQJXRKYVCNDWMD-QEOTZNIISA-N 489.013 0.986 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)CCOC1 1800142081 LEOQDEDNLDGPKU-YDLHNXBPSA-N 487.362 0.302 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)[C@H]2C1 1800739963 NRBADVSIJSCNTE-RAKFEZMXSA-N 475.945 0.992 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1Cl)C2 1801010755 UOQJVSDMTGVGCV-USGNIVHTSA-N 454.930 0.984 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC(=O)N1C(=O)OC(C)(C)C 1801161239 ZIKGNYFQZPCPSE-JRBZFYFNSA-N 473.954 0.756 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1801943883 HDOGCECKOWXKKL-ZINXYGQCSA-N 479.342 0.933 50 20 JCGD O=C(Cn1nnc2ccccc21)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804015624 CREIWJYCYAAFKY-YADARESESA-N 484.325 0.526 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnc(OCF)cn1 1805031665 UZWDMJWPWDJDHW-UTKZUKDTSA-N 479.277 0.491 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)Cn3cnc4c3c(=O)n(C)c(=O)n4C)C2)CC1 1806900268 CCSCSNYRMFAIGY-OAHLLOKOSA-N 478.981 0.682 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372863 JTIVJQYCVULYDO-MBSDFSHPSA-N 475.314 0.209 50 20 JCGD O=C(Cc1ccc2ncnn2c1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807400989 OHOASUKNUWRGJD-YKSBVNFPSA-N 484.325 0.366 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)CC1 1807483213 OXUPBFJUYWWBHE-UHFFFAOYSA-N 479.603 0.703 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n[nH]1 1807777823 YSFCLYMCQPJJDO-MGPUTAFESA-N 462.514 0.999 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1 1809356456 UGSKBDZQZGONGB-IERDGZPVSA-N 485.508 0.756 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCC4(CCCN(C(=O)c5ccc(B(O)O)cc5)C4)CC3)nc2N1 1809967009 OOPFKONPMDWBNF-UHFFFAOYSA-N 476.342 0.805 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810294354 JQYVLIRRBUEBPO-DZFGPLHGSA-N 465.558 0.884 50 20 JCGD O=C(CCc1cnccn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813443399 KMKNMJOGRAFKMV-WMZHIEFXSA-N 459.315 0.504 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCc2cnccn2)[C@H]1c1cccnc1 1813445564 FRWUQJAKSAABLS-HTAPYJJXSA-N 474.525 0.823 50 20 JCGD O=C(CNC(=O)c1cccnc1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815784035 GHNRYBPNHBCNCA-LJQANCHMSA-N 476.302 0.220 50 20 JCGD O=C(CCBr)Nc1cc([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1 1816782250 MDGJYAVSXWUIBS-NSHDSACASA-N 452.246 0.912 50 20 JCGD CNc1nsnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474972 IVYWFWZAVSOMRP-CQSZACIVSA-N 455.309 0.602 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1819433202 SCONYORVONYOPO-SJORKVTESA-N 480.522 0.270 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)n1 1820090115 WLQAUSIMZRJBNX-INIZCTEOSA-N 495.370 0.349 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@@H](F)Cl)CC2)n(C)c1=O 1825105627 WBDPCNWLHRRDER-RHSMWYFYSA-N 482.944 0.588 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)/C=C/c3cnccn3)sc2C1 1827013665 CDAWCMKPADTXLD-FXMSTWTQSA-N 464.511 0.871 50 20 JCGD O=C([C@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)CC1 1827269352 PKZNNNVSBXVSIG-JKSUJKDBSA-N 458.968 0.671 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828938963 HNXZVLUHXNSUBV-UTKZUKDTSA-N 465.363 0.890 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCC(=O)NC1)CCO2 1829960271 LOVGGAYRRRRRNW-JRDZDNNQSA-N 488.491 0.854 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1830669014 YFDSWWPDVHNOLD-PMACEKPBSA-N 489.378 0.443 50 20 JCGD O=C(c1cccnc1OCC1CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724843 IQOYFCMPQRQOOM-UWJYYQICSA-N 453.923 0.540 50 20 JCGD COc1cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(OC)c1OC 1830736603 UFEHAILQEGHRMB-YRQSBNEQSA-N 498.960 0.782 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1833714373 VNMXZOFLMPOOAQ-HNNXBMFYSA-N 493.468 0.072 50 20 JCGD COc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1833778563 FAUJKLPWLWZVCF-UHFFFAOYSA-N 480.374 0.198 50 20 JCGD Cc1oc(C(C)(C)C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1834198907 VQRHUMFHAPUVGQ-VWLOTQADSA-N 484.358 0.949 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1834328629 BLLOJLFRWBQOSU-INIZCTEOSA-N 466.970 0.066 50 20 JCGD O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1834421900 SAHOKFOTGQCLPB-UHFFFAOYSA-N 480.367 0.388 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCN(C)CC3)CC2)CC1 1834623268 BIDOZQIMTOBZFG-KRWDZBQOSA-N 472.472 0.979 50 20 JCGD CN[C@@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1)C(=O)O 1834738579 HHEUWZBFBIBTOP-BBRMVZONSA-N 461.401 0.652 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cscn3)CC2)CC1)c1ccc(B(O)O)cc1 1834797905 JTLIWALESLKGBJ-UHFFFAOYSA-N 456.377 0.251 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)CC2)CC1 1835118030 JPJCPJKNSLSIEB-LTPBRXSJSA-N 470.574 0.584 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cc3cnn(C)c3)CC2)CC1 1835118040 KMLYFTFAPMDNLJ-OGLMXYFKSA-N 482.589 0.668 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1835709478 QBQZSTSWJLBYEW-DOMZBBRYSA-N 464.380 0.956 50 20 JCGD O=C(COc1cccc(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934049 LKTLJBSMWGHQFY-HSZRJFAPSA-N 488.733 0.169 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1 1836457776 XNUUYFGLQZANMP-SGTLLEGYSA-N 452.309 0.811 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1=NO[C@@H](c3ccccc3)C1)CCO2 1836585899 GSYDEPOLSBDFNR-YKSBVNFPSA-N 487.557 0.333 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1 1837372610 FNIOXSOVCROCHT-HNAYVOBHSA-N 472.329 0.707 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)C1 1837712380 OIVVCZSAXZWWGN-HSZRJFAPSA-N 492.649 0.840 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CCN3CCCC3)CC2)CC1 1838395400 LPWAKADCVBCMJW-UHFFFAOYSA-N 472.590 0.783 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)C1 1839109523 JXCKHYNTYUGXQH-LAPQFRIASA-N 496.388 0.474 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ccncc13)CCO2 1839507460 ABYTUBYANJSPQD-VWLOTQADSA-N 475.310 0.298 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)c12 1839558074 KAKUTUFGBYNTQK-XMMPIXPASA-N 487.557 0.620 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Cl)COC)C2)C1 1840806054 LMFUVTODVITHED-VWKPWSFCSA-N 477.986 1.000 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)ccc3F)CCO2)C1 1840810518 NROWDGNKVQVPQV-HSZRJFAPSA-N 489.479 0.276 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840912974 UOACKYQHDKAFEB-AHWCRGGASA-N 487.981 0.512 50 20 JCGD O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011752 OZNFRTJATSDKEB-UHFFFAOYSA-N 457.299 0.381 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843012847 MOHLKYSASJECBI-BVZFJXPGSA-N 499.373 0.067 50 20 JCGD O=C(NC1(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)CC1)OCc1ccccc1 1843014093 WNJROLMDPXCKSM-UHFFFAOYSA-N 477.326 0.642 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1843904714 JYKCQENYBIKXFM-KRWDZBQOSA-N 457.336 0.440 50 20 JCGD Cc1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c(-n2nccn2)c1 1844760553 PNMTWFUFLARSCB-UHFFFAOYSA-N 460.498 0.705 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cnn3ccncc13)C2)NC(=O)NCc1ccccc1 1845039001 SSXQWZMFHGFIPY-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)C[C@@](C)(O)CC(=O)O)C2)NC(=O)NCc1ccccc1 1845039403 MIOIXLDKXKTTCG-JOCHJYFZSA-N 475.546 0.152 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1847040705 WVIPIYCWCONFIN-SAABIXHNSA-N 457.336 0.487 50 20 JCGD C=CCOC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847563958 OKNHADBRIVQKIQ-VGWMRTNUSA-N 488.969 0.593 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)c1n[nH]c(=O)c2ccccc12 14854982 MHDQLDHIJVYVIQ-CYBMUJFWSA-N 473.486 0.924 50 20 JCGD Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1C 725895397 YUIVVDYJMQCSGE-OAQYLSRUSA-N 496.593 0.781 50 20 JCGD CN1CCN(C[C@@H](NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2ccccc2)CC1 727843631 QMRWFLCWFSJHPZ-GOSISDBHSA-N 473.603 0.912 50 20 JCGD O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)C1CCN(c2ncccn2)CC1 728890078 VJLGHIVEEDWSCQ-UHFFFAOYSA-N 471.543 0.359 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(-n3cnnn3)cc2Cl)cc1OC 729728062 YZXYUKSNTXCTDU-UHFFFAOYSA-N 460.834 0.951 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(F)ccc2N2CCOCC2)c1 730767570 ANRPTGRVVWHVRQ-UHFFFAOYSA-N 450.492 0.987 50 20 JCGD CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)C(=O)NC(C)C 744447008 RUFSIVCBSQYERS-CYBMUJFWSA-N 459.366 0.973 50 20 JCGD COc1ccc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)cc1OC 748468269 XVWPVNBHUVITCQ-UHFFFAOYSA-N 456.503 0.782 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)o1 751043352 LLHAFGGTZLKHAE-UHFFFAOYSA-N 455.514 0.684 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(S(N)(=O)=O)ccc2Cl)cc1OC 819847421 JISUUALLGKFJND-UHFFFAOYSA-N 471.875 0.623 50 20 JCGD CS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 873919609 CJVHAUWLFKPRTH-UHFFFAOYSA-N 487.581 0.498 50 20 JCGD CC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1ccc(-n3cnnn3)cc1)C2=O 894386575 BDDAGAVBXWAPJQ-UHFFFAOYSA-N 468.518 0.950 50 20 JCGD O=C(CN1C(=O)[C@@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 912643270 NOYNYZIMRJLAAH-IQGAEYHTSA-N 486.550 0.429 50 20 JCGD Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 916108735 VLUKLTKTJLAFLK-SFHVURJKSA-N 475.506 0.616 50 20 JCGD CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 919779720 WNUUUVGTFTZDFY-HNNXBMFYSA-N 497.599 0.615 50 20 JCGD O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919889887 WBSIIWFHXVJMNO-LLVKDONJSA-N 487.332 0.343 50 20 JCGD CN1CC(=O)N(CCCC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)C1=O 921235729 WVYUVYAOMOGIPI-UHFFFAOYSA-N 476.493 0.880 50 20 JCGD Cc1c([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cnn1C 1115854201 BSFJVCBARMSXHI-CYBMUJFWSA-N 450.521 0.455 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCC4)C2)C1 1778665939 AFYKXYODMUTPEI-VCOZGABYSA-N 453.503 0.407 50 20 JCGD Cn1ncc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)c1Cl 1779929316 WNZFAVIZSTYABV-IIBYNOLFSA-N 475.937 0.513 50 20 JCGD CN(C)c1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1780642457 IDXGYZMISWUVTJ-QHCPKHFHSA-N 452.515 0.508 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc([N+](=O)[O-])cc1F 1780878968 HLRSJNHKOCEWSQ-NFBKMPQASA-N 485.277 0.855 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)CCO2)NC(=O)NCc1ccccc1 1780969039 SYNRSBMQFLEJGM-QHCPKHFHSA-N 499.528 0.713 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)N(C)C(=O)OC(C)(C)C 1781040752 FAFZEYFUIYFGDT-OPAMFIHVSA-N 469.583 0.445 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781331680 PQGWSFGWSLGDDX-MLGOLLRUSA-N 459.297 0.890 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC(F)F)cc3)C2)C1 1781698981 GETOISQRDUWRCX-JOCHJYFZSA-N 460.242 0.725 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)CCO2 1783539574 LZSFBHFOVFRVOP-GKCIPKSASA-N 490.395 0.972 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)CCO2 1783869904 SISSERQFNMOCLB-DOWNOZBLSA-N 489.997 0.688 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@]13C[C@@H]1CN(C(=O)OC(C)(C)C)C3)CCO2 1783937055 NZQQPGPZFGXWRQ-GAZXMLTASA-N 493.605 0.446 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C[C@@H]21 1783966697 KARVPCGUPGIGGN-HJWJTTGWSA-N 494.452 0.669 50 20 JCGD Cc1cnc(Cl)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1786256819 URCVCVDQHBRAFX-KKXDTOCCSA-N 472.933 0.949 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCO4)C[C@@H]21)c1cccc(B(O)O)c1 1786983316 NFGNEBPOZFWNOR-MDKPJZGXSA-N 452.272 0.002 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786985181 OZINTVKOLKWSRO-DBXVSBKESA-N 452.316 0.427 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)[C@H]3SC(=N)NC3=O)[C@H]2C1 1787498178 NAKUQJDSRVRUHU-VVVXUTRGSA-N 461.382 0.552 50 20 JCGD CCc1[nH]nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1F 1788611487 FBVIJBPICRFATR-PJODQICGSA-N 459.482 0.017 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1788642275 ARLQXBJFWFGHGQ-UHFFFAOYSA-N 485.371 0.540 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1n[nH]c2c1CCc1ncccc1-2 1789181366 HDEVQGKWVJGPST-FRJURHEUSA-N 459.934 0.763 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H](O)C3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726732 QNYFEKGBURNBQY-WHZJULEDSA-N 473.574 0.083 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1 1789923369 JBXKCAWQSQDFQX-GCQYFTOKSA-N 468.320 0.500 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1791080773 GCVYAWWYOOIYQB-VIQHNZTISA-N 459.971 0.965 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791490364 RCFYGYREAGJGIU-QQOZLPODSA-N 451.332 0.234 50 20 JCGD C[S@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl 1793105869 FMIZQYPJESPQBC-IXQBYZJESA-N 480.027 0.886 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(Br)c1)C2)c1ccc(B(O)O)cc1 1795734638 UXFNNAPSYMNFKS-JLVBRIDZSA-N 474.120 0.041 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cc1F)C2)c1ccc(B(O)O)cc1 1795734951 ACJQMPWDNUKUDL-HBCWATKFSA-N 478.232 0.624 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1796839243 PJUMWPGENYUVNZ-FCGDIQPGSA-N 475.351 0.158 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1797179270 KMKPQNAXXCIHBO-CKBPBPHLSA-N 459.971 0.823 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2 1797956011 VIFRONSOAMKWND-ZSBFGKGUSA-N 484.589 0.626 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncccc1C(F)(F)F 1798226335 CACMWOMKNXPLNL-DRXBFXEBSA-N 478.431 0.616 50 20 JCGD COc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1NC(C)=O 1799321442 HLCFFMCSLANGAI-ACDBMABISA-N 465.315 0.899 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H](O)CNC(=O)OC(C)(C)C 1799364500 DMCHLBVWRPQCOL-SVZOTFJBSA-N 463.959 0.106 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(OC(F)(F)F)cc1 1799494690 DATLCDNSCRQLLT-HGKCTWBKSA-N 478.232 0.782 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)c(N(C)C)c(F)c1 1799836034 MTHLDGYXUDYINS-YVWYUNDQSA-N 467.517 0.607 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799869250 FQEHYODMMTWASI-FFGOWVMKSA-N 470.574 0.662 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@](C)(O)CN1C(=O)OC(C)(C)C)C2 1800981462 NIJXVNBRQIJTGA-WHDKQWSOSA-N 489.997 0.590 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1)C2 1801012105 DFOOOWPLRVMFLO-AYMMHLMVSA-N 495.621 0.596 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1802128471 CFZALKGLBQPYLH-HNJRGHQBSA-N 489.378 0.263 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803136648 DIQSHMICVMQHCY-TZSPXAHUSA-N 488.972 0.867 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)COc2cccnc2)[C@@H]1c1cccnc1 1804336854 DPLXNBFHKHLQTE-JTSKRJEESA-N 475.509 0.874 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1805301423 NLSFLYXBCZHXMR-YLJYHZDGSA-N 463.303 0.137 50 20 JCGD COCCOCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1806755846 MPAXFKCIWGMPKU-UZLBHIALSA-N 456.503 0.063 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368174 ZOJSJFNSOVEBJA-AVRDEDQJSA-N 459.315 0.538 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374557 HSWGOURDCIBXNP-XTQVGHSUSA-N 473.342 0.977 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807374856 JRFXFOMOCXADHS-UGKGYDQZSA-N 484.325 0.746 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)no1 1808390811 KPHDBNZSCQJBEW-SBUREZEXSA-N 485.545 0.786 50 20 JCGD Cc1cc2nnc(C(=O)NC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)c(C)n2n1 1809188368 WNIPPJHWJFPWNA-WMZHIEFXSA-N 499.340 0.449 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1 1810302042 FCONBUWZDILZMS-SUMWQHHRSA-N 450.459 0.142 50 20 JCGD CC(C)N(C)CC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1813599191 NURVPJYSGPPYBV-UWJYYQICSA-N 453.547 0.740 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H](CNC(=O)CNC(N)=O)[C@@H]1c1cccnc1 1814220586 COYDXYAPBJDMQL-VYDXJSESSA-N 482.969 0.888 50 20 JCGD O=C(CCN1CCCCC1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815355031 LXKQSSVAGYNDPZ-KRWDZBQOSA-N 456.377 0.925 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOCC1)CC2 1817279915 LNJOEUXRRALZME-PJAVDKHJSA-N 487.586 0.911 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817477412 YVSGHSUOQOHJRT-DYVFJYSZSA-N 458.280 0.957 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)n1cncn1 1819404805 ZZNKLANVJNUAEI-MLGOLLRUSA-N 452.479 0.567 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1820204794 LFUUVAACWKFLKU-CZUORRHYSA-N 465.344 0.944 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1824547842 FDPYYBYNYOLRDO-BBRMVZONSA-N 493.354 0.262 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)nc1 1825562168 ASYJDXIOLIEXFJ-QFIPXVFZSA-N 499.398 0.712 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCC([C@H]3CCCCN3C(=O)[C@H](F)Cl)CC2)n(C)c1=O 1827609255 ZYUQHKZNRWYCBB-PBHICJAKSA-N 482.944 0.588 50 20 JCGD COCCn1ccc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n1 1827824713 AZOSQUSHAJLFJY-QFIPXVFZSA-N 468.363 0.756 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1 1828967188 MLUQODLTNSGGLM-KGOJFESUSA-N 488.589 0.391 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccc(C)n3)CCO2)C1 1829722655 TVILZPWCZBASTD-ZIBCTDPXSA-N 494.552 0.994 50 20 JCGD O=C(c1nc2ccc(C(F)(F)F)cn2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830723241 MQBUFNFMKZHQCZ-ACJLOTCBSA-N 491.854 0.418 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831246710 XBTKAGZBPWACTK-JYFHCDHNSA-N 494.353 0.141 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1c(F)ccc(F)c1F)CCO2 1832076454 JSNYLAIUYOFWRT-JOCHJYFZSA-N 486.491 0.476 50 20 JCGD CCC(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551121 BVUGQHPNZFDGKY-XOBRGWDASA-N 461.943 0.554 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C(F)(F)F)o1 1834216985 UTYXETKJPHCBSW-NRFANRHFSA-N 496.247 0.670 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ncccc3F)CC2)CC1)c1ccc(B(O)O)cc1 1834798431 VIKWKXFTIVHEOM-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD Cn1c(=O)c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)nc2ccccc21 1835369459 SDZLLHBZRRGYSO-IBGZPJMESA-N 475.977 0.718 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835589243 OPPWXXUCIVVZGE-FSTVOOFJSA-N 491.029 0.948 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CCc3nc(N)n[nH]3)CC2)CC1 1835836915 BUUICSNFHNKEGP-UHFFFAOYSA-N 451.648 0.743 50 20 JCGD O=C(c1cccc(-c2cnco2)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931896 GDVGXZMBJIEDDI-RUZDIDTESA-N 491.309 0.405 50 20 JCGD O=C(CCc1ccccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935740 PCSAYZHFVGMQHL-XMMPIXPASA-N 486.761 0.723 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836718350 VVQITYHTEGLWQA-KRWDZBQOSA-N 466.000 0.010 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cn3c(nc1=O)SCC3)CCO2 1839044434 GCELDEGTOBGOSI-NRFANRHFSA-N 496.662 0.199 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1 1839198411 ZLIQKCKXVFFEIH-YOEHRIQHSA-N 494.339 0.246 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203354 IRWZHPBYVPYSSA-YEWWUXTCSA-N 460.300 0.996 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccc(O)c3)C2)C1 1840184732 CMJGRUVGMPTLRY-DRGXBFSJSA-N 460.531 0.235 50 20 JCGD C[C@H](Cc1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840473317 URHYNYLHNMTOOH-VGSWGCGISA-N 450.536 0.288 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc(OC)c1C 1840755537 ZRXKEPBFCRUHML-IIBYNOLFSA-N 456.923 0.682 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014506 REDUKNCHWKIESZ-UHFFFAOYSA-N 462.315 0.719 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1843948111 ZRTINCIYOUBKRH-UHFFFAOYSA-N 472.546 0.759 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)Cc1csc3c1c(=O)n(C)c(=O)n3C)C2 1846363600 RNQJTBLEQVUIPX-ZDUSSCGKSA-N 468.963 0.298 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(N3CCCS3(=O)=O)c2)cc1OC 12887633 YZCHSRLIUWNYMV-UHFFFAOYSA-N 477.495 0.862 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1)NC1CCCCC1 725986537 CANFATXOKWTRKH-UHFFFAOYSA-N 495.602 0.821 50 20 JCGD CS(=O)(=O)NCCNC(=S)NNC(=O)COc1ccc(OCc2ccccc2)cc1 727064997 OVRVXUWVAFUQQD-UHFFFAOYSA-N 452.558 0.689 50 20 JCGD Cn1nc(SCC(=O)NN=C2C(=O)N(Cc3ccccc3)c3ccccc32)c(=O)n(C)c1=O 730567779 WZARUKKJXPYEOQ-UHFFFAOYSA-N 464.507 0.638 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NNC(=O)N2CCOCC2)cc1 745995852 FHPPWTLCWQWAIB-FOWTUZBSSA-N 467.486 0.414 50 20 JCGD O=C(NNC(=O)c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1)C(=O)N1CCCC1 748246442 KKJZJAQRYXEDRX-UHFFFAOYSA-N 461.456 0.779 50 20 JCGD Cc1ccc2c(c1)C(=O)N(CC(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)C2=O 804007627 OWOHHLBFOREDIL-QGZVFWFLSA-N 453.407 0.122 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccccc2S(C)(=O)=O)cc1 874003569 XJXPFRNXHYKGGN-UHFFFAOYSA-N 475.570 0.029 50 20 JCGD Cn1nc(C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)c2ccccc2c1=O 874067650 DFMBYNLHOLDVKU-UHFFFAOYSA-N 459.466 0.542 50 20 JCGD Cc1oc(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1S(=O)(=O)N1CCCC1 916123318 ZBAHTRBFVXYDBN-UHFFFAOYSA-N 459.484 0.694 50 20 JCGD COc1ccc(OC)c([C@H](O)CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 916473763 YZXGVWCBVRDAGW-OAHLLOKOSA-N 451.505 0.675 50 20 JCGD O=C(NNC(=O)c1cnc2nc(O)nc(O)c2c1)c1cccc(S(=O)(=O)N2CCCC2)c1 916726069 AJMQWNJZTNBZRN-UHFFFAOYSA-N 458.456 0.295 50 20 JCGD COc1ccnc(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2N2CCOCC2)n1 920454589 SMAQFYMHDBEERO-UHFFFAOYSA-N 478.531 0.100 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4s3)C2)C1 1777753397 ZDHHNVQFUJWXJV-JOCHJYFZSA-N 451.313 0.733 50 20 JCGD C[C@@H]1CC[C@H](C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)O1 1778199267 APWXHTWVFJHTLG-FPGHNAPASA-N 473.574 0.730 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779007423 KCPFZCLHSFFFPN-DEOSSOPVSA-N 480.525 0.158 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030457 ATHWUVCUGCSZBU-IVZQSRNASA-N 453.503 0.024 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn3nccc3c2)C1 1779167076 WDAOOKLZOCGGGP-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cc2cn3c(nc2=O)SCC3)C1 1780544192 ONBZUKVNLIOKTD-WHSLLNHNSA-N 485.006 0.659 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)C3(c4cccc([N+](=O)[O-])c4)CCC3)C2)C1 1781183763 YYGUZKRLFWXTML-XMMPIXPASA-N 493.325 0.840 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)O1 1783019105 SJPHBFHCHBUSLM-TWOQFEAHSA-N 466.332 0.931 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1783550121 AMIVSSAXVPVJKZ-LYDRAKHJSA-N 457.955 0.816 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2NC1=O 1783934477 ASCYGSSURJAEGT-WNSKOXEYSA-N 473.530 0.223 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784813729 ZLKADOBDHIJLEA-WDSOQIARSA-N 489.378 0.263 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(F)c1 1786981865 NSBPCHHVICXYSB-ZRCAFCQKSA-N 456.279 0.421 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611085 LCEHJNZLRCGPAS-GWKIZSTFSA-N 494.552 0.097 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)c3cnccn3)[C@H]2C1 1788700350 DKRXGZNYRYUJMM-MDLJMBGESA-N 482.379 0.606 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1 1791055052 GSBMODHQHCZBOK-NDKCEZKHSA-N 454.387 0.077 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)CC2=O)c1 1792426067 BEJQXBSXJJHZKR-KZWXMACTSA-N 465.934 0.237 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1 1792814706 NHFPPKJOSFDECK-LTCOOKNTSA-N 453.898 0.891 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c(I)c1)C2)[C@H](O)CCl 1792980484 QGSVSWHFBFQCPM-BAESOJJISA-N 494.713 0.800 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCCNC(=O)C2)n1 1794506973 XBBZVRHXWHTGIE-YJHYTUISSA-N 498.411 0.847 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)nc1 1794749262 SGUIBQADTFYAHJ-BTTYYORXSA-N 472.527 0.049 50 20 JCGD O=C(CN1CCOCC1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1795442607 ZZGDDCBEPRYTQU-RCLSDMTESA-N 480.403 0.914 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CS(C)(=O)=O)nc1 1796078662 OABIFXKGJCBSNG-OEYIWLLWSA-N 474.377 0.613 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1nn(-c2ccccc2)c2c1COC2 1796095791 MCBDGDFRSOQHOM-FTUNRGFVSA-N 460.918 0.705 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1occc1Br)C2 1797750811 RELZAXOCWDFCNH-QHBPRCKVSA-N 478.303 0.558 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C2 1800642065 UKRCHEYMJCXUQR-YIDVYQOGSA-N 463.325 0.244 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807367999 PHADKTQGNRSVKT-ZJSXRUAMSA-N 475.358 0.985 50 20 JCGD CC(=O)O[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(C)C 1807376577 TZQXSGYDXNFZMV-BVSLBCMMSA-N 467.331 0.669 50 20 JCGD Cc1cnc2c(C(=O)NC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)cnn2c1 1809834952 IFKSLANRUCRMDF-UGKGYDQZSA-N 484.325 0.746 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(=O)Nc1cccnc1 1810463454 SFBBYFJQLHRRBA-RXVVDRJESA-N 473.298 0.115 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CNC(=O)OC(C)(C)C)[C@H]1c1cccnc1 1812811942 JXIVCAHORXSYFQ-DYESRHJHSA-N 476.578 0.985 50 20 JCGD COc1nccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1F 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NC(=O)c1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)cc1 1823119298 WURBSBIUMBBXNW-LJQANCHMSA-N 461.287 0.808 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCCS3(=O)=O)sc2C1 1824931530 HTVBWWCUKZWJEC-QGEKPWAMSA-N 492.583 0.766 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825504443 PNEAFSFWGFMGRJ-CQSZACIVSA-N 474.348 0.573 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826825877 OSNLIMUSBHSCBP-BBRMVZONSA-N 453.333 0.582 50 20 JCGD COCCOCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828907534 DXGLWXBVUDUMMV-WMZHIEFXSA-N 497.976 0.701 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923888 CIEUYNBSSJABNC-HXUWFJFHSA-N 494.556 0.231 50 20 JCGD O=C(Cc1ccc(Br)nc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733527 OQVQBOXAVQPPAL-KDOFPFPSSA-N 476.755 0.443 50 20 JCGD C[C@@H](Sc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1831164133 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0.935 50 20 JCGD O=C(c1ccnc2c1OCO2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201127 WTWMBXZKROIPKM-DYVFJYSZSA-N 460.256 0.571 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(O)cc(O)cc1O)CCO2 1839372467 BSWJYBGMUSRPBA-HXUWFJFHSA-N 454.552 0.725 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1ccccn1)CCO2 1839667878 NBXDNJUEGWDFIH-AVYPCKFXSA-N 483.363 0.440 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccccc3O)CCO2)C1 1839908039 HNRLWWPLTZLNLG-OTZYPNAKSA-N 483.525 0.525 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1840071925 NRGSHZKIUCAJOU-YQMDMEMYSA-N 493.960 0.738 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3C)C2)C1 1840151062 VEZAOZDTYIIBOY-JTAQYXEDSA-N 465.978 0.753 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(O)c4ccn(C)c34)C2)C1 1840154538 YSXCNMNNCMEKHG-IERDGZPVSA-N 466.922 0.603 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)[S@](=O)c1ccccc1)C2 1796443731 FDMFBACOLSZONQ-PDNGSJIUSA-N 499.593 0.906 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCNC2=O 1797320921 RDAUKCROXMBNEI-JFILPPLUSA-N 468.352 0.251 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)CC1 1797706100 AMMCFQWRCJVBNP-CRWXNKLISA-N 454.362 0.987 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1 1798442678 MVISONMGFIJXSI-BCDXTJNWSA-N 464.526 0.675 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1799878188 JJKNGAYLLIDZBK-DDFXLWFNSA-N 451.867 0.928 50 20 JCGD C=CC[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)NC(=O)OC(C)(C)C 1801014143 HZNKTRWBBVMXSH-WYADAEROSA-N 495.621 0.809 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnn(-c2cccnc2)c1 1805073829 LWVBSCGHVFPIOJ-HYBUGGRVSA-N 496.336 0.976 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1805307400 FYUCWPQTRMOMSC-OXJNMPFZSA-N 457.535 0.516 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cccc(O)n2)[C@@H]1c1cccnc1 1805674679 FZGRTIBDMKHZIH-QRWLVFNGSA-N 461.482 0.814 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H](N)CCC(N)=O)[C@@H]1c1cccnc1 1807041810 FQCDTMBTMYLZKM-UTXMOHQDSA-N 454.369 0.711 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807360216 PFRKCNIFGVEFFO-SCWSEQNSSA-N 496.373 0.994 50 20 JCGD COc1ncc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1F 1807363495 PLQKUJBRDKPSCE-DYESRHJHSA-N 478.289 0.938 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373701 DOMIHPPOOHGQFW-KZKAQZJJSA-N 491.353 0.836 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CN2CCOC2=O)[C@H]1c1cccnc1 1808410747 WTTQOCSGEUACSY-PWCMAEROSA-N 481.513 0.674 50 20 JCGD 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CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725169 GUENOUDTKJQYEU-HYFFOGBASA-N 489.997 0.832 50 20 JCGD Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)nn1C 1830945685 PLCXJWDHAIEBPI-IFXJQAMLSA-N 457.369 0.758 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1833489508 XWRMKJPMXJCRQI-SGTLLEGYSA-N 471.308 0.276 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1833497129 YOZYSXACDHJLJU-XIKOKIGWSA-N 471.308 0.418 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CCN3C(=O)C=CC3=O)CC2)CC1 1833614225 IMQRRCGEMLPEID-UHFFFAOYSA-N 464.639 0.725 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801499 PUHGNMGCNMDWPR-SFHVURJKSA-N 467.379 0.084 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc2n[nH]cc2c1 1834994260 SDYZSOMWVMJELX-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD O=C1CC[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)N1 1835128234 VIEUPAHTPYINOU-SPEDKVCISA-N 494.386 0.728 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc4ncccn4n3)CC2)CC1 1835738020 QHJQSYYHNBIFHB-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1835926613 VBDCNOSQERPMMH-BVZFJXPGSA-N 482.342 0.249 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1 1835931315 MNMMYAPCOXJEQZ-NRFANRHFSA-N 493.247 0.164 50 20 JCGD Cc1cc(Cl)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835941540 NRSHOIZCPBMWQT-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD O=C1Cc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](F)Br)C4)C3)ccc2N1 1836790237 CRNSECSOWMRXTR-APWZRJJASA-N 470.295 0.942 50 20 JCGD C[C@@H](Sc1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837231163 DRXRGJCGXLIXGB-ZHRRBRCNSA-N 490.412 0.679 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)nc1C 1837456805 NKVVHHBQKDQYMV-HSZRJFAPSA-N 468.514 0.081 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCCc3cccnc3)C2)C1 1837461100 ODUAPNVNKYRPFC-XMMPIXPASA-N 482.541 0.173 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837529948 HEGAQPKCUUIKHJ-CAFIBCOWSA-N 466.304 0.662 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnn3C)C2)C1 1838527149 JSZFCPSZZVFCHN-QFIPXVFZSA-N 487.469 0.637 50 20 JCGD O=C(c1ccc2nc(CO)[nH]c2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200977 PQAMDCODFZAOFN-VQIMIIECSA-N 485.310 0.816 50 20 JCGD Cn1nc2c(c1C(=O)N1CCOC[C@]3(C1)CN(C(=O)[C@@H](F)Br)CCO3)CCC2 1839202436 FKVPKDKIPFDKTE-QAPCUYQASA-N 459.316 0.669 50 20 JCGD O=C(c1cccc(N2CCOCC2)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839343401 COPRYBKZTLCSMY-SIKLNZKXSA-N 467.950 0.193 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1 1840035584 WMOGTQMGTGDWHL-RIFZZMRRSA-N 455.349 0.830 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(F)(F)F)nn3C)C2)C1 1840153731 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JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)cc1 17407087 VIHQAONHSLARJK-UHFFFAOYSA-N 482.584 0.168 50 20 JCGD C[C@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NC(=O)C1CCCC1 727096080 ICAZQJSWQRKYIY-OAHLLOKOSA-N 466.560 0.554 50 20 JCGD CC(C)(C)OC(=O)[C@@H]1CC(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)=NN1c1ccccc1 728803669 AHYAEIOIIZEGHC-BBRMVZONSA-N 450.517 0.545 50 20 JCGD O=C(NNc1ccc(S(=O)(=O)C(F)F)cc1)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 728976084 YKEKWEDHQFLQCB-CMPLNLGQSA-N 451.473 0.162 50 20 JCGD CC(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1CCN(C)CC1 916258160 LUKFOONDHNGZGH-FQEVSTJZSA-N 480.635 0.687 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)N[C@@H](C)Cn1cccn1)N(S(C)(=O)=O)CC2 916462529 CSWINQUTOYMGOE-YOEHRIQHSA-N 494.574 0.568 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCC(=O)NC2CCCCC2)cc1 918125567 GFUYSUCWFNSWIT-UHFFFAOYSA-N 453.565 0.785 50 20 JCGD O=C(NNC(=O)N1CCN(C(=O)C(=O)N2CCCC2)CC1)c1ccc(Br)s1 918778460 GJMFFDMDFVNJAP-UHFFFAOYSA-N 458.338 0.632 50 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)nc3C)[C@H]2C1 1784725026 QPJDKZHJZVUWLT-SKFHZHBLSA-N 455.519 0.456 50 20 JCGD COC(OC)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785075271 BPABIYOGXVGVNW-AJNGGQMLSA-N 463.959 0.717 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786986576 MGKJASVVISFKOD-NYVOZVTQSA-N 465.315 0.232 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1 1787449119 NDYYOSHLYWDHNK-YGJAXBLXSA-N 451.923 0.776 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NN(c4ccccc4)C(=O)C3)[C@H]2C1 1787541419 NOALSRVRYRFFAP-QRFRQXIXSA-N 484.557 0.132 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4c(c3)NC(=O)CS4)[C@H]2C1 1790454727 INSWXAJDKXMFPA-ZIEJDFEHSA-N 468.963 0.973 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1792251259 ZPMDOKQZPXWTJV-LEAZDLGRSA-N 473.574 0.158 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792979053 SARMYAHHHYZPDS-JRBZFYFNSA-N 491.969 0.022 50 20 JCGD CC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)C(C)(C)C 1793194204 KKPYSJFVIGQYBB-ACJYEVJMSA-N 474.562 0.261 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1nnc2ccccc21 1793712616 YUYRKFHLOIHUTG-QTLLOYRASA-N 478.513 0.155 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](N)c1ccccn1 1795610258 OUTZPXKURQLQQF-CENPHQPOSA-N 481.981 0.803 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C#N)nc1C(F)(F)F 1795997669 ZJKBGJZNPOOOGV-IVWMJMPLSA-N 482.463 0.548 50 20 JCGD O=C(CN1CCc2sccc2C1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188327 PQKJUESAWSZXII-ACDBMABISA-N 453.373 0.738 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)[C@@H]2C1 1796190309 MXNBVZYUJQUXPF-AEUURAPJSA-N 483.374 0.731 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2 1796395391 YKKMVTBHKDWBOL-RMEBNNNOSA-N 478.384 0.899 50 20 JCGD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(C(F)(F)F)o1 1796407307 NWJDHQVLFJMEEA-AGGWBTHJSA-N 467.209 0.199 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796892128 JUJRIAQNEHCUME-IUOYRKAUSA-N 480.529 0.893 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](N)c1ccccn1)C2 1798522449 YHOZTXOTJDUTNT-IALDWUNLSA-N 483.481 0.818 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCNC(=O)C1)C2 1798522971 KGZHIZMRMWOMDB-CJXDPKRBSA-N 474.470 0.250 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)NC(=O)c1cnccn1 1798550201 JZTOXKQVCPFQOK-SLBVCVMLSA-N 480.529 0.367 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799349564 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1815344306 SLZHYQOBCSTFMH-DOMZBBRYSA-N 458.349 0.354 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1n[nH]c3c1CCCC3)CC2)c1cccc(B(O)O)c1 1815354559 IWNLMJJHIHDFSE-AWEZNQCLSA-N 465.344 0.964 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1nccc3nc[nH]c13)CC2)c1cccc(B(O)O)c1 1815354919 XGAANHGKVSAKNR-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc3n(n2)CCNC3=O)n[nH]1 1816627133 YLORCFZTYKMTHJ-HNNXBMFYSA-N 471.522 0.029 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc4[nH]ncc4c3)sc2C1 1818951351 FVFUQHKQHVCGCN-GFCCVEGCSA-N 477.510 0.953 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1 1819402048 KNSBNZLLEFWOJK-QGZVFWFLSA-N 456.507 0.046 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822117754 FCNNEKGRNMWROQ-QGZVFWFLSA-N 471.323 0.920 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1 1827587675 IEXHJGBXDWKWIS-GOSISDBHSA-N 454.292 0.115 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nccnc2C(N)=O)CC1 1827679247 SSQZQJVWEVYONR-RSXURMKNSA-N 494.556 0.943 50 20 JCGD C#CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCN2C(=O)OCc1ccccc1 1829000447 IBUAVOYTLZWMSE-RUZDIDTESA-N 475.310 0.065 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830719314 BUHPHRRFZSTQCL-SXGZJXTBSA-N 463.959 0.203 50 20 JCGD O=C(c1cnn(Cc2ccccc2)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732971 ZHSCUJKFACIBKN-KNQAVFIVSA-N 462.934 0.601 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830733018 CVQHUHSJVJFSNT-OXJNMPFZSA-N 455.895 0.535 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)Cc2cccnc2)CC1 1831870725 COALBJCYMWFWOL-SFTDATJTSA-N 458.607 0.944 50 20 JCGD Cc1cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccn1 1832625565 DAGLFFIUHBJNPG-DEOSSOPVSA-N 482.541 0.091 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(=O)c1ccco1 1833754222 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1837919163 LHZQSUJHLFDCQU-WGOQTCKBSA-N 467.331 0.691 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C(F)(F)F)ccn1)CCO2 1838087867 SKVLSYRWHNYGGR-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839108440 JKPIYWMYALXATF-FXAWDEMLSA-N 487.439 0.396 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3c(Cl)cccc13)CCO2 1839496426 JXTQRBVUFCNXMJ-JOCHJYFZSA-N 492.964 0.659 50 20 JCGD CCNC(=S)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2 1839966333 BAEUWDVLGSTQLQ-CXAGYDPISA-N 465.414 0.100 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1840153502 PYMZIIUFYKZEJV-QVKFZJNVSA-N 465.890 0.145 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C2)C1 1840154148 MTYBFIJIAWHXIM-XOBRGWDASA-N 485.877 0.647 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1840154576 ZRSIDRDGWKQPIF-LAUBAEHRSA-N 499.904 0.844 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1840154635 ASIWGVPFENAMBA-JLTOFOAXSA-N 484.962 0.450 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2 1840956848 UPWQDOXAYTUXIV-YWZLYKJASA-N 475.970 0.754 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)C1(C#N)CC1)C2 1843428802 QVACGPZXVVHJEC-IBGZPJMESA-N 496.373 0.309 50 20 JCGD C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)C2CCN(S(C)(=O)=O)CC2)C1 1843837059 VYECSIKJOSQOKM-CYBMUJFWSA-N 450.399 0.892 50 20 JCGD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 15053528 JLYMGIYLKPKBFB-IRXDYDNUSA-N 460.535 0.478 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)c1 728208200 MUPHSFSYFYFWHW-UHFFFAOYSA-N 464.548 0.397 50 20 JCGD O=C(NNC(=O)C1(C(=O)NC2CC2)CC1)c1cccc(S(=O)(=O)NCc2ccccc2)c1 749404214 WADMJZMEIFJTOS-UHFFFAOYSA-N 456.524 0.985 50 20 JCGD O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1cc(C(=O)O)ccc1Br 751278980 FRRQUYYSCCZUQC-UHFFFAOYSA-N 462.303 0.948 50 20 JCGD CC(C)(C)OC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C\c1ccccc1 822204939 HCYGUCOOWMDGQA-VSKPTYQZSA-N 461.562 0.936 50 20 JCGD C=CCNC(=S)NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 913438186 WMGNLXULKKFIBA-UHFFFAOYSA-N 453.590 0.289 50 20 JCGD C[C@@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C2=O 915789005 AKQPSDAHACGZFW-MLCYQJTMSA-N 471.923 0.249 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccccc2S(=O)(=O)N(C)C)nc1 916237629 JXKMNNBKEQQJOS-UHFFFAOYSA-N 470.577 0.845 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)ccc1Br 918149156 PTUHPYKRWDSLCH-UHFFFAOYSA-N 481.288 0.835 50 20 JCGD Cc1ccn2cc(CNC(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)nc2c1 918236252 ZBNAMNFOXOSOPD-UHFFFAOYSA-N 472.527 0.808 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)c2ccccc2c1=O 920030518 ZRDJKLUHKSDQIE-XGCMIMOYSA-N 488.504 0.498 50 20 JCGD O=C(NC[C@H]1CCS(=O)(=O)C1)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 1321718054 JNCVPRLMSZKGQA-MRXNPFEDSA-N 469.523 0.824 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@]3(C)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1778182076 IMJMVDGIYAZJND-ZEQRLZLVSA-N 495.621 0.836 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1c(F)ccnc1Cl)CCO2 1779028325 IVHLNVQRUMKBMJ-HXUWFJFHSA-N 462.869 0.630 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779036937 JSYFRQTTXFUGNU-QFIPXVFZSA-N 484.469 0.365 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)cn3)C2)C1 1779425347 QHRHHGLFHAYABW-IBGZPJMESA-N 468.352 0.661 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)Cn3ccnn3)CCO2)C1 1780096702 FTLXSISPIOOOHF-FQEVSTJZSA-N 458.431 0.255 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1)CCO2)NC(=O)NCc1ccccc1 1780968772 FCFVWCRVOBYPKG-ZEQKJWHPSA-N 495.580 0.896 50 20 JCGD O=C(c1cc(=O)nc2cccnn12)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781335007 TUKNTMBVQJIFSB-WMLDXEAASA-N 454.256 0.224 50 20 JCGD CCOC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)CC1 1781627041 MGSSNQIZGZQJSW-IIBYNOLFSA-N 452.552 0.217 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1 1781852691 GMHAQWXLOWPWIJ-FHSNZYRGSA-N 464.357 0.690 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)[C@H]1SC(=N)NC1=O)C2 1782172416 AZJIURDVCIVNSL-QEAYJNAZSA-N 460.984 0.557 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CNC(=O)C3)C2)C1 1783163309 SEBKIKANGPCBPB-LHSJRXKWSA-N 460.443 0.100 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)CCO2 1783875748 SVCVZMMJBDHVCZ-MZKRTTBSSA-N 465.978 0.971 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)cc2NC1=O 1784091019 GVTPVMHOJGJHEZ-XWKYAYKISA-N 451.907 0.599 50 20 JCGD O=C(Cc1cccnc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785163884 IDAJEAYKBGNNBB-WDSOQIARSA-N 457.723 0.251 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3N(C)C)C[C@@H]21 1787508692 HVCPQLAHSDWDIC-YUCXHDEDSA-N 481.557 0.875 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCCO4)C[C@@H]21 1787508784 UFPHVWCJCMOCBB-GDJYOZILSA-N 483.529 0.393 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cn2cc(Cl)ccc2n1 1787858935 CWCZPPVYXYPVKJ-QSFXBCCZSA-N 482.733 0.575 50 20 JCGD COc1cc(F)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611268 QYFLMVYKIFLBHG-GMVOTWDCSA-N 471.489 0.740 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C=CCN3)C[C@@H]21 1789222253 KSMSRJAGMDBUHP-RNVRALISSA-N 458.471 0.641 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCn3c(=O)oc4ccccc43)C[C@@H]21 1791288104 YJAVRUZPISPNJO-ZWOKBUDYSA-N 487.557 0.337 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(F)ccc3F)C[C@@H]21 1791292270 MHLAXCDEAOCHNT-FNHZYXHNSA-N 452.502 0.860 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)COc2ccc(Cl)cc21 1793774203 OHVCZCUIZBPWCE-OOVWBHHBSA-N 486.352 0.909 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc2c(c1)OCO2 1795321791 ZFCHEBAIYNAXMN-GPVSGQMNSA-N 460.531 0.311 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795732887 PAAVGFZAMNPPQN-JWVYWZTKSA-N 454.357 0.750 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc3ccc(F)cn3n1)C2 1798443062 PGORZQAWOZWDID-BTTYYORXSA-N 452.450 0.433 50 20 JCGD CN(C)c1c(F)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1F 1799833378 ZUIOJOCZCUZXTD-CWPLJXCYSA-N 473.285 0.228 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F 1800333229 WSNOULIQPPNXSY-KXKJGPMZSA-N 461.469 0.908 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801014562 ZHXLKSBXQFJWHH-AGYLXNLDSA-N 493.605 0.418 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801021539 SBLVSSXZGNYTLE-RNJOBUHISA-N 482.361 0.836 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1ccncc1=O)NC(=O)NCc1ccccc1 1801258013 RNSWFNATLHCHFQ-ACDBMABISA-N 481.557 0.228 50 20 JCGD COc1ccc(Cl)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1801665471 JJWXXCARIDCEML-DBWKPXFBSA-N 473.917 0.864 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CO)c(F)c1 1801900399 LKVHJWFSIBFTQR-UCNOBMHRSA-N 471.489 0.655 50 20 JCGD COc1nccnc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365132 XDWPIAJSIFJETG-XLIONFOSSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365159 WLVJKDPRTWTESR-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD Nc1nc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cs1 1807370392 CKVYEGXVHIBVTP-YJBOKZPZSA-N 451.317 0.434 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H](CNC(=O)[C@@H](F)Br)[C@H]2c2cccnc2)CC1 1808667593 BXNKWORZWSQTLD-BHIYHBOVSA-N 484.370 0.942 50 20 JCGD C[C@@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)O1 1810301950 DZNWHHDANIHYSA-HIBPSGHXSA-N 452.515 0.967 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1 1814863682 AALGYFKASKNGAS-MCIONIFRSA-N 459.931 0.887 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n1 1817474730 XXCAHPXLRARHLO-IBGZPJMESA-N 450.308 0.909 50 20 JCGD CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)COCCO)[nH]n1)NC(=O)NCc1ccccc1 1820710369 BAZKKKAHYPCCLQ-LJQANCHMSA-N 487.561 0.757 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822410516 LHBJVSIKHWQAHJ-ZFWWWQNUSA-N 471.584 0.103 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822416080 NESAFVBCTZHYJS-IAGOWNOFSA-N 480.522 0.270 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CN3CCCCC3=O)sc2C1 1825868048 PFBKBQHRMVVPKO-ZDUSSCGKSA-N 450.565 0.441 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCCO3)CC2 1826085877 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C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832723882 HQHFVDYBVJBFNH-MGPUTAFESA-N 483.363 0.299 50 20 JCGD Cn1nncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1833224943 ANPMKUUBYXORJB-VBKZILBWSA-N 486.957 0.017 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1 1833292810 KSFWVEJQYWRCAB-HTAPYJJXSA-N 475.933 0.862 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccn4ccnc4c3)CC2)CC1 1835573996 SXOIEDWFWXHAQA-UHFFFAOYSA-N 469.590 0.893 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CN)c1ccccc1)CCO2 1835811711 MMRSDVBNQQQIGE-MIEZJRIHSA-N 496.568 0.319 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](CN)c1ccccc1)CCO2 1835822686 JNJZSYREOBUDNW-RIFZZMRRSA-N 454.365 0.969 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccoc4C3)C2)C1 1837455675 DAUKFIDIWRAYBU-OSPHWJPCSA-N 483.525 0.153 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)c3ccccc3)C2)C1 1837456629 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CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1 1808370254 AZQJIJWAAXIKGJ-KSSFIOAISA-N 458.479 0.406 50 20 JCGD COC(=O)C12CC(C(=O)NC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)[C@@H]3c3cccnc3)(C1)C2 1812835937 JMKALNSENPKTIQ-KFLOIMRSSA-N 492.536 0.743 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1 1813072209 BRPIYWYDEGVWGT-KBXCAEBGSA-N 473.452 0.566 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813072430 BYGDECMUBZQGME-ZWOKBUDYSA-N 451.593 0.574 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3nc4ccccn4n3)sc2C1 1816659698 GWRXUIGGHRZGBG-GFCCVEGCSA-N 456.532 0.785 50 20 JCGD COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)C3CCN(S(C)(=O)=O)CC3)sc2C1 1818644344 ZKAZTWZKBNEGJD-STQMWFEESA-N 479.024 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccncc3O)sc2C1 1820333331 SZLLNKHNVFECFP-JTQLQIEISA-N 453.484 0.782 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1823436789 PBLJOCARIJNTRW-IEBWSBKVSA-N 455.324 0.700 50 20 JCGD CC[C@H](O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548822 PTOLQIVITZKYCD-SPEDKVCISA-N 467.950 0.809 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923572 MTLXAXQXCIJICG-BEFAXECRSA-N 458.563 0.833 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829074160 YWUCDNOYVFGVDC-UWJYYQICSA-N 457.380 0.905 50 20 JCGD Cn1nncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1833236704 QHTBOCRHUAQOBH-UWJYYQICSA-N 492.374 0.891 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(N2CCC(NC(=O)C(F)(F)C(F)F)CC2)CC1 1833646699 DOJWABSSXLUFEJ-UHFFFAOYSA-N 459.249 0.452 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C3CCC(CO)CC3)CC2)CC1)c1cccc(B(O)O)c1 1834799767 ADIKWORMTURDSK-UHFFFAOYSA-N 471.407 0.350 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3C[C@]3(F)Cl)CC2)CC1)c1cccc(B(O)O)c1 1834801492 PPKVVZBEIRYXTH-GHTZIAJQSA-N 451.735 0.476 50 20 JCGD COCCOCCOCCOCC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1 1835082841 GIGKECIPDVGECC-FQEVSTJZSA-N 481.993 0.789 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Cl)CC3)CC2)CC1 1835439972 JVCLXGFEIWVQOG-KRWDZBQOSA-N 467.007 0.764 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccc4occc4c3O)C2)C1 1835932173 RLWIXGAOQDCCSG-XMMPIXPASA-N 480.282 0.202 50 20 JCGD CC(C)(C)Oc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835932242 VXAYIHODRSYSMN-AREMUKBSSA-N 496.369 0.928 50 20 JCGD COc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835935769 QIWQNDYWZDBINK-RUZDIDTESA-N 482.342 0.078 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1 1838063988 FCUVQXZAHMLICL-NTRYICDMSA-N 456.547 0.647 50 20 JCGD O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838524446 MEPRUWWPFJQLKT-OXQOHEQNSA-N 469.878 0.199 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198370 CVRRZIPIXDICJO-PBHICJAKSA-N 453.305 0.865 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3cccc(F)c13)CCO2 1839598852 HMXCECIHCSJTLM-HSZRJFAPSA-N 497.487 0.084 50 20 JCGD O=C(Cn1cnnn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802105 LTXKNHHRFNTQFK-YLJYHZDGSA-N 493.362 0.136 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840045943 HNGVJRALHSVXEZ-ZOCZFRKYSA-N 475.970 0.442 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1840152450 ILFQMBNQWXXPAM-VGSWGCGISA-N 478.933 0.490 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2n1 1840185419 QLHDWCNRLSFSFF-DEOSSOPVSA-N 486.573 0.394 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840803676 PORPFBXHLLPQTD-MDOVXXIYSA-N 463.959 0.346 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCS(=O)(=O)c2ccccc2)C1 1842744352 ZQKNNMPVODSLBN-UHFFFAOYSA-N 471.539 0.366 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013185 RNXVNVXIPITKAA-INIZCTEOSA-N 465.743 0.316 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)Cc2ccccc2NC3=O)C1 1844641319 HGIGLTFOYRSVPS-UHFFFAOYSA-N 479.541 0.687 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1845822699 ZOKCDXBNNQHRBL-UHFFFAOYSA-N 479.342 0.289 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CC3(CCCN3C(=O)CCC(=O)NN(C)C)C1)C2 1846385976 QZEPZFARCSJVSD-MRXNPFEDSA-N 474.562 0.199 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C1(CNC(=O)OC(C)(C)C)CCOCC1 1847711147 LYULEZCQUFIXIU-ROUUACIJSA-N 495.621 0.883 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1 10791581 AQJZNHIHLDPPSF-UHFFFAOYSA-N 450.429 0.463 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 11333889 CWWKZDMNVLRPJO-UHFFFAOYSA-N 489.550 0.953 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)COc3ccccc3F)c2)CC1 15889478 NVRHVFZVZLVXOW-UHFFFAOYSA-N 478.502 0.519 50 20 JCGD Cn1c(=O)c2c(ncn2CCC(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)n(C)c1=O 16161238 ODJUXJXPRVVAOV-UHFFFAOYSA-N 488.504 0.936 50 20 JCGD CCCC(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 727365920 ZXKLPXHPYBNJOW-MRXNPFEDSA-N 454.574 0.934 50 20 JCGD CCS(=O)(=O)CCNC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 727943099 CZDAXWYIWFFMIZ-UHFFFAOYSA-N 457.516 0.767 50 20 JCGD Cc1c(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)c3ccc4c(c3)NC(=O)CO4)CC2)cc(C#N)n1C 731352836 FCKPXFNEHCBGES-RQZCQDPDSA-N 494.533 0.976 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)sc1Br 744464232 ZOPQEYDEPOWQRL-VIFPVBQESA-N 462.303 0.759 50 20 JCGD Cn1cccc1C(=O)NNC(=O)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12 747598593 DEAAIAVTPLGFHY-UHFFFAOYSA-N 459.484 0.375 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1ccc2c(c1)CCO2 821728094 PAYQONIHRXFXGJ-UHFFFAOYSA-N 473.551 0.965 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O 845922979 INVVJQKPIVIDJQ-JLMKVHRTSA-N 461.858 0.460 50 20 JCGD CSC[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 873822208 YTCCQGXPGQGDPZ-BBWFWOEESA-N 496.611 0.605 50 20 JCGD COc1ccnc(NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccc(Cl)cc2)n1 914762830 ODSQKTZVAMOOEX-CYBMUJFWSA-N 477.952 0.364 50 20 JCGD CN1CCN([C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2cccs2)CC1 915902000 OZAOGCHDPFXBID-SFHVURJKSA-N 494.643 0.931 50 20 JCGD C[C@@H]1CN(C(C)(C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C[C@@H](C)O1 916235062 XZFGNXHGWZBSRE-IAGOWNOFSA-N 497.618 0.539 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccccc1O)c(=O)n2Cc1ccccc1 916333495 MXDVDSUWIWYGHJ-UHFFFAOYSA-N 476.493 0.910 50 20 JCGD O=C(Cc1ccc(NS(=O)(=O)c2cccs2)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1 916659083 FSTRWFSRDLFGDU-ZDUSSCGKSA-N 457.555 0.674 50 20 JCGD C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 1262595972 NPLVQYWCSUMBHL-SFHVURJKSA-N 489.598 0.319 50 20 JCGD C[C@H](Nc1nccs1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1778069858 JCXGASXTASPCEV-QXATTWAWSA-N 472.376 0.451 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2 1779031129 LTERSMHMVMDOPS-GOSISDBHSA-N 455.437 0.861 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])cc3c1OCC3)CCO2 1779032693 RTJBMHYUCNBVNR-QHCPKHFHSA-N 496.480 0.286 50 20 JCGD COCc1c[nH]c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1 1779372606 NNRDNDSCVQSRGL-AUSIDOKSSA-N 470.530 0.601 50 20 JCGD CCc1cc(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)nn1C 1779832917 NNGVFFOIUYCBLI-NMWDDECMSA-N 455.519 0.560 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1 1782580481 FKHYHIIHCTYWOW-YQNSVDCASA-N 464.486 0.535 50 20 JCGD CCOC(=O)N1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)CC1 1783130208 UUUYBVBJZJWMKJ-CSODHUTKSA-N 459.971 0.969 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCN(C(=O)OC(C)(C)C)CC3)CCO2)C1 1783884102 PRADSGRKOCQTEN-HTAPYJJXSA-N 489.013 0.623 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C#N)c1 1783934427 GXYJDXRMSXNCAT-QHCPKHFHSA-N 457.531 0.312 50 20 JCGD CSCC[C@@H](O)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783969206 IOWRYXHHTWTLLG-AUSIDOKSSA-N 493.630 0.277 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3nc(C)cc3C)[C@H]2C1 1785339534 WJGUIAWJVSMTFL-RWRPXTCXSA-N 469.546 0.614 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccoc3C(F)(F)F)C[C@@H]21)c1ccc(B(O)O)cc1 1786979834 LGDTVBAXZUIHGP-JQFCIGGWSA-N 466.221 0.885 50 20 JCGD COc1ncc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982278 WOHIUUQIHZPLPR-JVPBZIDWSA-N 473.722 0.331 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]4C3)n2)CCCN1 1787444119 OBYOFMADTAOHBV-PWDMQXDWSA-N 467.929 0.536 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(N2CCOCC2)cc1 1787544682 WMCYXPRSUALNEH-LEAZDLGRSA-N 451.951 0.716 50 20 JCGD COc1nc(C)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610261 TYLGOBBLSZFSPI-JVPBZIDWSA-N 468.514 0.304 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cccs3)C[C@@H]21 1788611719 UVWRDEVJZOWDTB-JVPBZIDWSA-N 457.556 0.973 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3C(=O)CSC3=S)[C@H]2C1 1792241957 LTQSAGIIYOHRGI-RVMXOQNASA-N 478.434 1.000 50 20 JCGD COCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)CBr 1792872007 INZKUYDMZVFWCU-XLMAVXFVSA-N 465.385 0.677 50 20 JCGD Cc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(C)n1 1795736988 SSFJFJYYDWIVTL-JHDGKUDLSA-N 451.332 0.214 50 20 JCGD CC1(C)CCc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)c2O1 1795738719 AVZCUQNVKMGZRB-HATOLVCRSA-N 478.354 0.987 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)nc1 1799092525 SCHRJBWUIQZYFW-CWPLJXCYSA-N 482.541 0.449 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc[nH]1)C2)NC(=O)NCc1ccccc1 1799098004 YWRGXNKHCIVYNB-RMFSNUHRSA-N 454.531 0.564 50 20 JCGD O=C(COCCO)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1799340026 PDNIMMWGXLVROP-SFNKJDCFSA-N 455.349 0.591 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)C2 1800638965 FHCGYMIBCSFANZ-QXMWZZNTSA-N 461.382 0.552 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2 1800977697 CTPJOUGSGPVKJP-FDKIHUSFSA-N 465.978 0.731 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1CNc3ccccc3O1)C2 1801011605 QTQNUVIPFYFUGN-BMCPXHGSSA-N 459.547 0.212 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2)c1cccc(S(=O)(=O)N2CCOCC2)c1 1801883825 WGEFQVRTPPKWDR-CYGHRXIMSA-N 489.953 0.445 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1 1802235335 IBBNVOZDVRNWCX-IBEHDNSVSA-N 490.395 0.995 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1)C2 1802344190 QGMNVAOYLGXBNW-REPLKXPHSA-N 494.637 0.550 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1806341721 FXYWROYCEVCOJC-APWZRJJASA-N 487.420 0.603 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccn(C(F)F)n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360805 LXVXITJSEFQBGD-VQIMIIECSA-N 469.257 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CC(F)(F)C(=O)O)[C@@H]1c1cccnc1 1808295186 SOKGNZASGAFELP-KDOFPFPSSA-N 455.462 0.570 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303264 RRQGKVSQADFRKP-IIMJZQEZSA-N 465.514 0.090 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1CCC(O)CC1 1813193625 HTDXTHAPMQFYGI-HHKCAYGPSA-N 451.332 0.632 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@H]1CCc2nc[nH]c2C1 1813324251 QCDGOYNXTYWWJS-NVVBAYIOSA-N 473.342 0.609 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)CN)[nH]n1 1815704194 GAFJHCXDGLHVMY-UBHSHLNASA-N 457.963 0.820 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819418101 XDEFGOFRHGJQCZ-RDTXWAMCSA-N 463.307 0.686 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)COC(=O)C(F)(F)F)CC2 1819797970 PXXALTUJTWTLNI-MRVPVSSYSA-N 486.432 0.473 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819799731 FYQNRORIFNHHHU-LLVKDONJSA-N 489.558 0.892 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)N1CCN(C)CC1 1826088711 KEIUJSTZZZACCO-HUUCEWRRSA-N 465.624 0.064 50 20 JCGD CCOC(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)OCC 1826378420 WUSHRRWIDHAZGM-OAHLLOKOSA-N 461.349 0.838 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)N1C[C@H]2C[C@H]2C1 1827057928 NUORNJCYKFGKAC-PIBIMKELSA-N 453.392 0.940 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1830539123 BODPJLNCRYUVMI-AUUYWEPGSA-N 471.352 0.767 50 20 JCGD O=C(CCc1nc(-c2ccc(F)cc2)no1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726696 TZLDVKFAGFVYAH-VGSWGCGISA-N 496.923 0.864 50 20 JCGD O=C1CC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)=Cc2ccccc2N1 1830731487 KDZZMWICVBIKSQ-GCJKJVERSA-N 463.918 0.468 50 20 JCGD CC(C)[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830737407 HHEPPKOACOLLHV-PNLZDCPESA-N 492.013 0.982 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2)CC1 1830739202 ZZEMRJWAVJYLHM-XUZZJYLKSA-N 495.020 0.498 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2 1831701655 OADTVGPAJQVSEV-CBNMVNINSA-N 482.264 0.169 50 20 JCGD Cc1cccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1832243526 OCRCZMPRPJEOKG-XMMPIXPASA-N 460.575 0.757 50 20 JCGD COC[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549103 FJTJFCSNWRVMRM-CKJXQJPGSA-N 477.986 0.857 50 20 JCGD CC(=O)NCC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1833546630 XPQBHLLXXPVIEQ-UHFFFAOYSA-N 466.627 0.093 50 20 JCGD COc1nn(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1833860953 PLOIYXPVDQZNNP-ACJLOTCBSA-N 459.341 0.530 50 20 JCGD Cc1oc(C(C)(C)C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1834198579 JRMXWLZJLGTUQB-VWLOTQADSA-N 484.358 0.949 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801143 NJOOXBYMALHROC-UHFFFAOYSA-N 461.444 0.403 50 20 JCGD CC(C)n1nccc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801217 RBEWNUYUTYATKD-UHFFFAOYSA-N 467.379 0.643 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(C)C)CCO2)C1 1835886363 RNCSVBJNTWZAJN-QHCPKHFHSA-N 492.529 0.978 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1 1835931905 GIRYTZKWSATHQE-HSZRJFAPSA-N 498.732 0.280 50 20 JCGD O=C(Cc1ccc2c(c1)CCC2)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934220 QFLVHOFFLYGNHX-AREMUKBSSA-N 478.354 0.168 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4c(Cl)cccc34)C2)C1 1835939400 PHXAJNSMVDVYIV-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1 1836114410 LEMCTDHREPIDEQ-CXAGYDPISA-N 459.366 0.809 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cn[nH]c3cn1)CCO2 1837197905 UTQJXYLJIVFHHS-HGQHNSGJSA-N 494.512 0.162 50 20 JCGD C[Si](C)(C)C#CCCCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837428779 DQOMIHSNFQNADO-XMMPIXPASA-N 486.450 0.488 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(F)(F)F)C2)C1 1837457609 LBCPMRQJGODQQM-GOSISDBHSA-N 459.425 0.098 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H]3[C@H]4SC=C[C@H]43)CC2)CC1 1837921544 LHEGDFJFNHIFSO-HBMCJLEFSA-N 456.373 0.854 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C)COC3)C2)C1 1838526768 CGGUGOUWZJLMSH-JOCHJYFZSA-N 477.470 0.627 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1 1839197388 SUBQTDWIVGPNDO-QAPCUYQASA-N 493.351 0.851 50 20 JCGD COc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1F 1839198356 YPZDNMYAQZRHHZ-CXAGYDPISA-N 464.263 0.990 50 20 JCGD Cc1nn2cc(CC(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)nc2s1 1839198489 FRXSJMKEVOMGNM-RHSMWYFYSA-N 490.355 0.789 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C)c(O)c1)CCO2 1839267677 VAXRIFOAUVJGCJ-MSIOFZDNSA-N 483.525 0.905 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839945892 QTTQJPOFVKTREC-UQBPGWFLSA-N 466.343 0.549 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cnn(C)c3)C2)C1 1839964127 HJSWCBGFYYOLCF-QFBILLFUSA-N 457.369 0.983 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@H](O)CC1)CCO2 1840269972 BPCAZFXJJIPMNR-LYMCUGEGSA-N 475.546 0.128 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2 1840317957 GNJZILHVUDNNHN-IRLDBZIGSA-N 482.965 0.203 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1 1840802960 MWJYJXJXGJANFX-YWZLYKJASA-N 463.959 0.611 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843010578 GLZFKQSURVGVDU-UHFFFAOYSA-N 469.347 0.751 50 20 JCGD CN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1845887622 JFKBUEDQIKRYDP-HUUCEWRRSA-N 474.986 0.551 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cc([N+](=O)[O-])ccc1F 1848055967 JUYQJXLMGLPWPJ-ROUUACIJSA-N 456.434 0.791 50 20 JCGD Cc1cn(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)c(=O)nc1O 1848098882 JRBIDTJIQAPODT-KKUMJFAQSA-N 483.953 0.591 50 20 JCGD Cc1nc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN(C)NC(=O)NCc2ccccc2)no1 1848191074 YFFHVVKNXLGUFM-ROUUACIJSA-N 455.519 0.469 50 20 JCGD COc1cccc2c1OC[C@H](NC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cn1)C2 728398209 BWXLTTWFSVPUAJ-MRXNPFEDSA-N 476.559 0.656 50 20 JCGD Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 729509694 APSCQDIBWKNAJP-UHFFFAOYSA-N 488.526 0.076 50 20 JCGD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=S)Nc3ccc(OC)nc3)C2=O)cc1 729692211 OMFRKOJOUNQPKH-FQEVSTJZSA-N 458.500 0.884 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)Cn2[nH]cc3c(=O)ncnc2-3)c2ccccc2c1=O 730515471 VAVQAZHMUYPSIZ-UHFFFAOYSA-N 450.459 0.433 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CCc1ccccc1 749852037 XLANVAZABRDROP-GOSISDBHSA-N 467.569 0.548 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cccs1 763894714 HAVCHILNXIEZJK-UHFFFAOYSA-N 453.498 0.387 50 20 JCGD CCC1CCC2(CC1)NC(=O)N(CC(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)C2=O 806218561 VUAVNZNOHFZSHX-LPLFELETSA-N 488.497 0.408 50 20 JCGD Cn1ncc2c(O)nc(CCC(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)nc21 822801444 ZDHZICJXNZCEFW-UHFFFAOYSA-N 487.542 0.637 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(CN3C(=O)CNC3=O)c2)cc1OC 825411332 CUTWBIPOZVMCQH-UHFFFAOYSA-N 470.438 0.374 50 20 JCGD COc1ccnc(NNC(=O)[C@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Br)n1 914762725 FLQODBWTFUORQO-ZDUSSCGKSA-N 486.348 0.924 50 20 JCGD C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916517267 ZUUSMWDFIGOXDX-INIZCTEOSA-N 494.549 0.470 50 20 JCGD C[C@@H](Sc1nncn1C)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 917902259 TVNZRJBEHCEPJN-CYBMUJFWSA-N 452.562 0.932 50 20 JCGD O=C(NNS(=O)(=O)c1cccc2c1COC2=O)c1cccc(S(=O)(=O)N2CCCC2)c1 918727818 VURYOKOZWOFOFB-UHFFFAOYSA-N 465.509 0.765 50 20 JCGD C=CCCOCC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 920436382 IOASTNXNKCSLQN-MRXNPFEDSA-N 455.533 0.693 50 20 JCGD O=C(COC(=O)[C@H](CO)NC(=O)c1cccc(Br)c1)NNC(=O)c1ccccc1 920654116 IHJZLIBSIRCHQD-HNNXBMFYSA-N 464.272 0.544 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2Cc3ccccc3CN2)C1 1778036506 LGPJOYSZCPGCQA-DNRQZRRGSA-N 471.602 0.588 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1779279897 FDELKEDFFHBWTK-JLCFBVMHSA-N 474.470 0.654 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1 1780130621 WSLMWKLZTLQVGS-HSZRJFAPSA-N 487.488 0.599 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)ccn1 1780319266 CCKPDGOSJPQTPB-RLWVUDJFSA-N 496.524 0.836 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780774557 DGVGUYZLMJQZHW-ATNYBXOESA-N 481.315 0.686 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967888 BJEBTWMPKSZWGD-HRAATJIYSA-N 496.406 0.946 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1782989551 XHFRXPIIOJQTJL-RCZVLFRGSA-N 479.342 0.766 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1783342167 JHTOIVSDGYWDAI-SJCJKPOMSA-N 475.365 0.455 50 20 JCGD CCOc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1783391858 XPTIOQUOSDBRQI-JVPBZIDWSA-N 468.514 0.386 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCO3)C2)C1)NC(=O)NCc1ccccc1 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0.451 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1790607178 VUVREIRUCSRSRA-GUXQRHPKSA-N 477.518 0.662 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)CC2=O)c1 1792488851 NQJQFYWMVVWXOA-BZNRXQDOSA-N 491.353 0.680 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(C(=O)Nc2ccccc2)CC1 1793403760 WTDGKUZMMQDWPH-CWPLJXCYSA-N 492.536 0.307 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1C(=O)c2ccccc2C1=O)c1cccc(B(O)O)c1 1794117964 GLKKZKMUMYKCHM-REPLKXPHSA-N 475.310 0.305 50 20 JCGD Cn1ncc(I)c1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1797247676 IOXBWFHKTLXGPE-DTHBNOIPSA-N 466.707 0.876 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)c(F)cc1F)C2 1797753125 URNFDBPIYSLLOS-XGISUXEOSA-N 463.416 0.619 50 20 JCGD COC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799864859 QPGWUCJJUFQZNE-REPLKXPHSA-N 459.547 0.924 50 20 JCGD CN[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C(=O)O 1800332981 JQCFYXPSRFZQNX-VALFPGDSSA-N 462.453 0.524 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OC(C)(C)C3)C2 1801011505 QTULNOJWUNPMAG-UPHUGPLXSA-N 458.559 0.976 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)C2 1801014527 XCRBLNSLEFVEFQ-JLVBRIDZSA-N 467.567 0.006 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1 1804948691 DKSGHGFDXUAABT-IERDGZPVSA-N 456.503 0.173 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807362616 LSUUATFITUBMPS-NZQKXSOJSA-N 461.331 0.595 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807368644 WKSQRMQEUHGZMW-KPDCDPCYSA-N 474.326 0.944 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807949562 PNKIBOODKNLBLB-LEWSCRJBSA-N 479.270 0.218 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)Cn2nccn2)[C@@H]1c1cccnc1 1808947098 KHUDUQHLSZFAEJ-RYUIIRDCSA-N 463.502 0.513 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnn3cccnc23)[C@H]1c1cccnc1 1810303499 TZFBIWAOYGQXAB-UZLBHIALSA-N 485.508 0.756 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810540621 GLHCPSAYGRXLQE-GHTZIAJQSA-N 455.396 0.933 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1 1813032312 GTDMFQDDUVMKJP-BTHPGYMESA-N 451.999 0.977 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1)c1cccc(B(O)O)c1 1817476351 QMGSKQYFOWNVGB-MRXNPFEDSA-N 460.263 0.147 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3nncn3c2)[nH]n1)c1cccc(B(O)O)c1 1817476549 WQRCAKCSXBNLJG-GOSISDBHSA-N 459.275 0.752 50 20 JCGD Cc1cc(C(=O)NCC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)no1 1819466523 OSGFMSNKQAOIGA-SFHVURJKSA-N 480.290 0.122 50 20 JCGD C[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1ccnc1 1819792745 ADGAFUOMPNVPRU-NWDGAFQWSA-N 454.516 0.825 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797522 WDQLMSFFXIBWDL-JQWIXIFHSA-N 459.532 0.234 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccnc4c3OCO4)sc2C1 1821234485 UHQVIWLIZFUEBQ-JTQLQIEISA-N 481.494 0.805 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)Nc2cc([C@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)N1 1821781151 ZLIBCKIFYUHZNF-MYPMTAMASA-N 498.993 0.182 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1824547843 FDPYYBYNYOLRDO-XJKSGUPXSA-N 493.354 0.262 50 20 JCGD CC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1825218432 UQTDSQQESCFJSP-VPWXJFHASA-N 459.532 0.714 50 20 JCGD N[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1 1826907618 LUFWAYYOLYKSGU-YADHBBJMSA-N 450.348 0.695 50 20 JCGD COc1nn(C)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830535868 VMQAABBCMWLRTQ-UGSOOPFHSA-N 459.341 0.530 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1831396277 DBRFYDFTMPHARS-HJPURHCSSA-N 489.481 0.628 50 20 JCGD O=C(/C=C/c1ccsc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833139555 WHOVXKNFAAIMAI-XCVUWMKJSA-N 456.329 0.211 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833310768 RJJZOGWAFWOGPD-VBYICHLGSA-N 466.970 0.292 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn(C)c1)CCO2)NC(=O)NCc1ccccc1 1833854539 GLHVAUYWWLNHHO-VWLOTQADSA-N 498.584 0.441 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ncc(Cl)cn1 1834055971 DLNAVBSVKKAMLO-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD CN[C@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1)C(=O)O 1834742508 PESPRFJJEPUCKS-UKRRQHHQSA-N 451.337 0.311 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)n1cccc1C=O 1834801132 QXRCBKYSJWMJBA-SFHVURJKSA-N 480.374 0.427 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)c3cc(C)on3)CC2)CC1 1835773564 SGOLXTMWWDJKGO-QGZVFWFLSA-N 469.970 0.538 50 20 JCGD Cn1ncc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1Cl 1836042500 YWFUPKXKAGYGLU-UHFFFAOYSA-N 473.770 0.252 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)CCO2 1836380975 QCDZGIZTXVXSHL-NRFANRHFSA-N 499.662 0.548 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CC1)CCO2 1836720025 LPVXXJCCSUTPEX-GOSISDBHSA-N 471.436 0.098 50 20 JCGD Cc1cccc(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1836763484 GRPCLRLSOGRNED-UHFFFAOYSA-N 465.359 0.925 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccnc(F)c3)CC2)CC1 1836972032 KVSFZELMQUZEAZ-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD Cc1cncc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837456467 ILNIERNMTHDPGD-DEOSSOPVSA-N 482.541 0.091 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1 1837456615 OZSMUGKGLZVGSU-AUSIDOKSSA-N 471.489 0.466 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)on1 1837484146 SADVKMQFRWKJHH-UHFFFAOYSA-N 456.503 0.908 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1837714566 KTZQZBYOORKZPW-KGVIQGDOSA-N 467.639 0.695 50 20 JCGD CN[C@H](CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1)C(=O)O 1837885966 CMJYWMADLHDCPF-UKRRQHHQSA-N 452.321 0.738 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=C4c5ccccc5C(=O)N4CC3)CCO2)C1 1838458842 FSJGKVBWWJJDGT-YADARESESA-N 489.956 0.967 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)nn1 1838831028 NOPJVUOZHFBDOP-DZQSVEARSA-N 499.528 0.079 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199439 WKCJODSFYXKJKS-WBVHZDCISA-N 452.321 0.440 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840105515 OCDCOHPFKOZYML-MOPGFXCFSA-N 450.363 0.692 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](NC(C)=O)c3ccc(F)cc3)C2)C1 1840154276 RHCKMJDFMSMLAN-JQVVWYNYSA-N 485.940 0.713 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(NC(C)=O)c3ccccc3F)C2)C1 1840155308 WZVDOXHGURQVIE-NMNUPHIUSA-N 499.967 0.887 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C2)C1 1840182366 HRLNBSJTDAIGAB-MHJFOBGBSA-N 476.496 0.548 50 20 JCGD COc1ccc(COCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1840252996 MDAYUYXNPOLBDW-GHTZIAJQSA-N 456.923 0.268 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(F)c1F)CCO2 1840718303 YAELEHSCFBXNOX-JOCHJYFZSA-N 478.232 0.168 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1 1841348301 KIKZALRBZOHHJX-ZSDSOXJFSA-N 457.955 0.673 50 20 JCGD COc1ccc(Cn2cc(CC(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)cn2)cc1 1841994825 LMZYVSGKWQHFLX-UHFFFAOYSA-N 488.353 0.680 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@H]2CC[C@@H]3CCC(=O)N3C2)C1)NC(=O)NCc1ccccc1 1845074554 YTHUFSRUHSPKTL-LEWJYISDSA-N 496.612 0.937 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@@H]1F 1847980103 FVSSIEGTZVMNTK-DEPCRRQNSA-N 489.353 0.362 50 20 JCGD Cn1nc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c2ccccc2c1=O 17193605 ZAESSTUSWSDRFG-UHFFFAOYSA-N 465.438 0.341 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)cc1C 17238811 HGLGNNZFPRQSAZ-LJQANCHMSA-N 497.595 0.611 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cnn(C(C)(C)C)c1)c(=O)n2Cc1ccccc1 117607876 AXCRPHYDLDYTME-UHFFFAOYSA-N 492.540 0.841 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)NNC(=O)COc1ccc(Br)cc1 725872310 MTTQJUKLUOMMAN-UHFFFAOYSA-N 454.237 0.213 50 20 JCGD Cc1ccc(NCC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)cc1 725906505 QSUIIOHJYIIDAU-GOSISDBHSA-N 482.584 0.336 50 20 JCGD O=C(COC(=O)c1nc(N2CCCC2)ncc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1 728329871 WYERPNHQRYDRHJ-HNNXBMFYSA-N 461.862 0.874 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCCC[C@H]2C)cc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 728383012 AUFNFDRSBHRTRI-CABCVRRESA-N 457.574 0.754 50 20 JCGD CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 729051967 CMGOEOLWBBSAEQ-AWEZNQCLSA-N 461.548 0.693 50 20 JCGD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)COc2ccccc2O)c1 730811900 HLWZANKZWNQMIU-CMDGGOBGSA-N 466.468 0.984 50 20 JCGD O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 747405699 JXULOQYQSBNKRO-AWEZNQCLSA-N 461.587 0.152 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CCCn1cccn1)N(S(C)(=O)=O)CC2 748834390 HZWDIHRGMFDCRV-QGZVFWFLSA-N 479.559 0.777 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1 751204327 GSNAVMFDJSYLGN-ZDUSSCGKSA-N 452.464 0.397 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)NNC(=O)CNC(=O)c2cccs2)cc1 751212546 SIHGXDBRLDXVQP-JCVNQNCUSA-N 469.523 0.429 50 20 JCGD CN(C)S(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1 787987108 KXMUDMZQBIOBIC-UHFFFAOYSA-N 468.419 0.602 50 20 JCGD Cc1nnnn1/C(=C/c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 818373606 JVJVDVBEESHMIP-OUQXZNHLSA-N 482.428 0.649 50 20 JCGD Cc1nnc(NNC(=O)CCn2c(=O)oc3cc(S(=O)(=O)N4CCCC4)ccc32)nc1O 821680954 FQBBIOXANKDVFY-UHFFFAOYSA-N 463.476 0.111 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(NC(C)=O)cc1 825615143 JYSMWGWSASRXPW-UHFFFAOYSA-N 463.516 0.534 50 20 JCGD Cc1ccc(CN2C[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2=O)cc1 844154041 RPWVWFHKPNCUDN-FXAWDEMLSA-N 467.478 0.874 50 20 JCGD O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc2c(c1)OCCO2 915918104 WRLMRPAWLXBSPB-UHFFFAOYSA-N 476.511 0.623 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC3CCN(Cc4ccccn4)CC3)nc2)CC1 916382680 URYGROVKZKFEBI-UHFFFAOYSA-N 488.618 0.703 50 20 JCGD CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N(C)CCO)cc2)cc1 1329836350 ULHYWEGZPCKJOI-UHFFFAOYSA-N 451.574 0.997 50 20 JCGD Cc1ncc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)s1 1778392951 AYKPGSIHVSXYIH-DYESRHJHSA-N 458.544 0.891 50 20 JCGD Cc1cn2c(=O)c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)cnc2s1 1778687113 IEJFGNOIZVBFLI-STXHMFSFSA-N 468.963 0.792 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C3\C(=O)Nc4ccccc43)C2)C1 1778907164 WBRRVWNFVVDWJA-JBPJOUFVSA-N 476.493 0.164 50 20 JCGD N#Cc1cc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1F 1779036565 BASDHRWGBSLXQF-QHCPKHFHSA-N 466.473 0.382 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2nc(N)n[nH]2)C1 1779238533 OSADMBCKEBDKEU-SNUQEOBHSA-N 457.373 0.864 50 20 JCGD CCc1[nH]nc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1F 1779371279 ZKWVKEXGUXJQDY-OPAMFIHVSA-N 473.509 0.551 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1 1780057178 QKSBQOKKHOVCGB-JOCHJYFZSA-N 455.519 0.288 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1780939068 RPLILWIMNAJIBO-GUYCJALGSA-N 475.340 0.412 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)N1CCN(C)CC1)C2 1782003349 JZSUBLBPHFCAHC-WOCWXWTJSA-N 459.429 0.920 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782083111 RFDCVIZGTBFJMQ-SWWFSWNPSA-N 489.378 0.407 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc([N+](=O)[O-])c1OC 1782119375 ZIDFRBZEQRINOT-AUUYWEPGSA-N 457.867 0.655 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1ccc(N2C(=O)C=CC2=O)cc1 1783058714 SERUBHADEPZKGL-YZZKKUAISA-N 475.929 0.843 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)[C@H](O)C1 1783478388 IBWWPPRMODOYOK-WEVKCVHISA-N 489.997 0.184 50 20 JCGD CC(=O)C[C@H](C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783829799 YEYZTFPISJZFTB-MHECFPHRSA-N 473.574 0.778 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C[C@@H]1OCCc3ccccc31)CCO2 1783933096 CHUGAXXRGAOZSA-GBXCKJPGSA-N 458.559 0.893 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@H]2C1 1784874120 SPUNFEIOHAEPIR-ZMFAOSFKSA-N 473.452 0.413 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCOCC3)[C@H]2C1 1786724301 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0.667 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1800056744 BTBPDHOLYVBUPU-MUJYYYPQSA-N 490.561 0.478 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCNC(=O)OC(C)(C)C 1800168227 DYUHGWOBIUCGMB-YYIAUSFCSA-N 469.583 0.273 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800850183 PYOAOJMKUXLYSW-TZZQQRSASA-N 457.955 0.575 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1 1804784021 WSGGUHFIPDUYNK-OXQOHEQNSA-N 461.482 0.347 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)[C@H]1SC(=N)NC1=O 1808398951 HDWXHUCKIPAITD-KNEBKQPDSA-N 489.602 0.263 50 20 JCGD CNC(=O)CC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808409545 NXXMQHAISBEUJC-RVGDNOHSSA-N 453.503 0.358 50 20 JCGD COCCn1nccc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808636400 TXYREJNFPGKWKF-SIKLNZKXSA-N 477.330 0.238 50 20 JCGD Cn1cccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1=O 1810294003 HIUJZOVTVYPSGW-OXQOHEQNSA-N 475.509 0.412 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CSc2ncccn2)[C@@H]1c1cccnc1 1810303995 ZJCSZVJEOVBQBH-OXQOHEQNSA-N 492.565 0.982 50 20 JCGD COC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1 1810564337 ISSWDTVXSSDTNB-YHUYYLMFSA-N 459.316 0.929 50 20 JCGD Cc1cnn([C@H](C)C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1813379996 PNLRUYKVBGUAIE-NQSCKRDGSA-N 461.331 0.847 50 20 JCGD CCOC(=O)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1 1815360164 PPQZCQGCLWDWSM-CQSZACIVSA-N 457.317 0.392 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(C)(C)C 1817470839 ZHZPAEFUIBHKKU-QUCCMNQESA-N 469.351 0.946 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401577 ISOZTDPATBVRMC-HNNXBMFYSA-N 475.531 0.620 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1819582880 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CC(C)c1csc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1833286570 SPUGTVKHEVBXKA-QFIPXVFZSA-N 488.570 0.649 50 20 JCGD O=C(COc1ccc(F)cc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834472853 NFEYPGWQMAIADA-UHFFFAOYSA-N 483.349 0.770 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)Cn3cc(Cl)cn3)CC2)CC1 1834814752 DLFHDGCKRJNRGJ-UHFFFAOYSA-N 468.002 0.481 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1)c1cc2n(n1)CCCNC2=O 1835515969 YTGXKPOCYPYXID-KRWDZBQOSA-N 499.385 0.892 50 20 JCGD COc1cccc(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835737052 IYCUQAHHFOYJHQ-UHFFFAOYSA-N 495.584 0.517 50 20 JCGD O=C(CCc1ccc(F)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934372 XWRYDNKOGVFAQV-XMMPIXPASA-N 488.296 0.347 50 20 JCGD Cc1nnc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)s1 1836075011 GWUDTECJMHZFFT-SJKOYZFVSA-N 461.382 0.876 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H]3CNC(=O)O3)CC2)CC1 1836901884 JBLBMJFORMXXCN-MJDKSPQASA-N 474.518 0.227 50 20 JCGD C=CC[C@H](C(=C)C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459369 NHMNEHSHRMHCFY-UZUQRXQVSA-N 457.531 0.524 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461360 VCBQHTWSFMLDPH-XMMPIXPASA-N 485.516 0.445 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]cc3[N+](=O)[O-])CCO2)C1 1837797615 XVJQUWAMJGNOIC-HZPDHXFCSA-N 450.279 0.624 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccccc3C(N)=O)CC2)CC1 1838394806 YXBZIPJAGDKGHK-UHFFFAOYSA-N 494.552 0.710 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)C(C)(C)C)C2)C1 1838526741 BFIZYOVBKIAGLT-CVDCTZTESA-N 493.513 0.997 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(C)cc3-n3nccn3)CCO2)C1 1838631612 KPTKVDLKJYDGOK-AVRDEDQJSA-N 477.949 0.900 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1838982779 FOZSACLISCPKLN-HSZRJFAPSA-N 453.499 0.377 50 20 JCGD COc1cc(C)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1839254919 RNMZQVDVNRWHAM-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1 1840153517 RDQQMRPPEQDWIW-DYESRHJHSA-N 463.922 0.591 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3Cl)C2)C1 1840185516 SOUHNPQKHQNJNL-NRFANRHFSA-N 470.929 0.922 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCCNC(=O)OC(C)(C)C)C2)C1 1840187039 IKEGFLQOECOTDS-QHCPKHFHSA-N 499.609 0.121 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cccc(=O)n2C)C1)NC(=O)NCc1ccccc1 1842351847 IXWXQRBDAPFPHW-UHFFFAOYSA-N 466.542 0.549 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015284 ANPMCYPNMIQLDA-SFHVURJKSA-N 455.320 0.100 50 20 JCGD COC(=O)c1sccc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 28778872 UGURVUKRDOXWBM-UHFFFAOYSA-N 473.554 0.943 50 20 JCGD CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 728505520 KNCUCRTVQAMLRJ-JTQLQIEISA-N 484.350 0.305 50 20 JCGD O=C(NCCCN1C(=O)CNC1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 731118291 QAMXOPPNYIXOFF-UHFFFAOYSA-N 477.485 0.274 50 20 JCGD Cc1cc(=O)c(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nn1-c1ccccc1F 792033194 OHPGWSHKLYTKPI-IBGZPJMESA-N 482.424 0.824 50 20 JCGD Cn1cc(/C=C/C(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)c(=O)n(C)c1=O 877219949 BZZIOBVJDZEKOU-OUKQBFOZSA-N 486.492 0.260 50 20 JCGD O=C(NC[C@H]1CCS(=O)(=O)C1)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 916375066 FRGCYNMCNHJZKV-MRXNPFEDSA-N 469.527 0.767 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(n2)NC(=O)CC3)C1 1777820591 ZXFQOTNWXCMVFD-HOYKHHGWSA-N 486.573 0.467 50 20 JCGD Cn1ncc2cc(C(=O)N3CC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)ccc21 1778021863 WKRBDVIHTFYDBZ-QHCPKHFHSA-N 463.498 0.329 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](F)Cl)C2)N1 1778027963 DTEMCBKDFJNQHF-GJIZYBQMSA-N 490.985 0.215 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnnc3ccccc13)CCO2 1779030166 HKWAUZVRVQXFQN-HSZRJFAPSA-N 461.482 0.386 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2 1779200667 NGSDYWQKJBHFGW-GMIGKAJZSA-N 450.330 0.348 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1 1779364297 VSFIPZXBLAEIFG-HXUWFJFHSA-N 455.462 0.060 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1779901223 LHSXBACVMQLJPJ-LAUBAEHRSA-N 453.923 0.683 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCC(=O)N1)CCO2 1780096898 LMUVFLAYJUUKGB-IERDGZPVSA-N 460.443 0.242 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1780199996 DYYZEXRELZRNOZ-GOSISDBHSA-N 456.286 0.926 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccc(F)cc1 1780915278 OOPQUBKSZBWIKE-HYBUGGRVSA-N 498.515 0.145 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1N(C)C 1781128952 YMYKHBVANURWOE-XMMPIXPASA-N 467.331 0.198 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214359 KUGPWPZPZQHENH-KBMIEXCESA-N 487.601 0.903 50 20 JCGD Cc1ncccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785126023 ZCUVKZNIOJBSTJ-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD CCN1CCC(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)CC1 1785645099 PTKWHINAXWOFRD-VAHWYXDJSA-N 458.563 0.682 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@@H]3CCC(=O)NC3)cc2)CCC1 1785897269 LEPFPEFIBRWUON-CQSZACIVSA-N 450.499 0.959 50 20 JCGD COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1C 1786269680 KJVOXQVVGQQKPA-JVPBZIDWSA-N 468.514 0.304 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)s1 1786984409 FHCHTQVDWBJGAY-YYWHXJBOSA-N 456.373 0.962 50 20 JCGD CN1Cc2ccccc2C[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611480 DDXTZOIDNXPVMK-QGQQZZQASA-N 492.580 0.335 50 20 JCGD CSc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789071697 AZLGZKPSEWAISN-KKXDTOCCSA-N 470.555 0.709 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(F)c1 1790048689 WMQPEDZRAGQTCG-ZRCAFCQKSA-N 456.279 0.421 50 20 JCGD Cc1cn(CC(=O)Nc2ccc(C3(NC(=O)c4cnccc4C(=O)NN)CCC3)cc2)c(=O)nc1O 1792225034 KYXOAXVZPCXECB-UHFFFAOYSA-N 491.508 0.704 50 20 JCGD CC(C)(C)OC(=O)N[C@H](Cc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792975660 TVXOXNMBGYRHEV-XWCCPHMRSA-N 496.992 0.707 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1OCCc2ccccc21 1793274821 NVXHMTZJZUIXCU-DSPLJNTKSA-N 458.559 0.653 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(C(F)(F)F)c1)C2)c1ccc(B(O)O)cc1 1795734717 XBLAFOOLQGROHS-JLVBRIDZSA-N 463.221 0.297 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2 1796443780 JQGHZLBHCIHIES-KUZVOZDVSA-N 458.346 0.946 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798441643 BNTXXNJNIQOSSU-BASYENTBSA-N 490.561 0.213 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1cn2c(nc1=O)SCC2 1799841267 DGSIOSBLIOHKPX-AUHJYUKYSA-N 497.581 0.664 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)[C@@H](O)C1 1801014412 PLSJQDDRYXPOFE-QKGCVVFFSA-N 480.389 0.998 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1802085270 NXARRNDCVFUXIK-NDKCEZKHSA-N 465.906 0.567 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C2=NNC(=O)C2)[C@H]1c1cccnc1 1810221350 ATJCSMQZYYKMGB-XMCMKKQQSA-N 464.486 0.097 50 20 JCGD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1C 1810298944 MSAUJCKUCYHNKA-JXFKEZNVSA-N 462.514 0.755 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)cn2)[C@H]1c1cccnc1 1810299498 RCDJTUHZJLDLEJ-YWZLYKJASA-N 461.482 0.814 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810307534 DNAWUKQFZVCHRZ-PLMTUMEDSA-N 476.541 0.933 50 20 JCGD COC(=O)C12CC(C(=O)NC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)(C1)C2 1812837377 VWWFCUWTPYSOBP-QYQPWLLASA-N 477.326 0.424 50 20 JCGD COCCOCCOCCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812930767 BSDRAKQGNQCTNZ-URXFXBBRSA-N 499.373 0.151 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813020599 DZKJOIXJBGZJGP-SNJCGAMXSA-N 491.353 0.836 50 20 JCGD Cn1ccc(=O)cc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343584 BKARYHZHVFYZGS-AWEZNQCLSA-N 452.301 0.061 50 20 JCGD O=C(Cn1cc(Cl)cn1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1815409209 VKFXBLHNXKPKAT-AWEZNQCLSA-N 459.724 0.599 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)COc2cccnn2)[nH]n1)c1ccc(B(O)O)cc1 1817475717 RGDHSQRLULMINE-KRWDZBQOSA-N 450.264 0.264 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)c2ccco2)n[nH]1 1817602509 WQXKEBRSYOQIOV-INIZCTEOSA-N 480.485 0.737 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819560605 DACYTWJOSNNOPE-KBXCAEBGSA-N 455.324 0.700 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCn1cncn1)CC2 1819801939 VPKNZSLQRAIBJU-LLVKDONJSA-N 455.504 0.049 50 20 JCGD CN1CCN(C2(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)[nH]n3)CC2)CC1 1820794702 FSPPZJDLTMCTGB-FQEVSTJZSA-N 480.378 0.175 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822414988 QEJIKZPJUQGTNV-WMLDXEAASA-N 485.549 0.383 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1825730160 BPXDYPLQFGXQSY-HXUWFJFHSA-N 454.336 0.656 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)n1ccccc1=O 1826087704 JMWCUMUSXVXVGO-ZIAGYGMSSA-N 460.560 0.851 50 20 JCGD CCNC(=S)NCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060697 XPABSYHCNBQBOS-IBGZPJMESA-N 460.409 0.084 50 20 JCGD O=C([C@@H](F)Cl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCN2C(=O)OCc1ccccc1 1829206475 TYDONCIEOLQECM-AYMMHLMVSA-N 482.940 0.696 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(C(F)(F)F)o1 1830728739 XJCQJORLMXYSAW-ZBEGNZNMSA-N 455.817 0.672 50 20 JCGD O=C(c1cccc(-c2cnccn2)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731539 LEISEDNCKZIONZ-DENIHFKCSA-N 460.918 0.813 50 20 JCGD O=C([C@@H](F)Br)N1CCC([C@H]2CCCCN2C(=O)CN(CCO)CCO)CC1 1831489689 GVVDRKAYMMMSHR-NVXWUHKLSA-N 452.365 0.583 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)C1 1831646537 MLHZZEFGOBTBCM-LIRRHRJNSA-N 474.967 0.316 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1832137696 BIMHWOXZMQCYBU-DHIUTWEWSA-N 495.389 0.070 50 20 JCGD C[C@@H](CC(N)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549496 SIEZSWYMFGIEFL-GXZWQRSESA-N 490.985 0.086 50 20 JCGD Cc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1833948355 QKBJJESBFBOSRZ-OAQYLSRUSA-N 459.528 0.439 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CC(N)=O)CC2)CC1 1835116236 CLAKNIBXJXKBLY-SCQWWOTGSA-N 473.578 0.204 50 20 JCGD COc1cscc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835231528 UUJQPPQFWCVCSO-UHFFFAOYSA-N 471.388 0.936 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](COC(C)=O)OC(C)=O)CC2)CC1 1835754508 KMIDMTBFPVFKIS-RBUKOAKNSA-N 475.970 0.307 50 20 JCGD CNC(=S)NCCC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1 1835836912 BQMPYTDWGUDKHV-UHFFFAOYSA-N 457.717 0.894 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc(Cl)nn1 1835879222 YXLZASRBNVGGDY-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837316269 YOUNJXXTNAZMSL-NHYWBVRUSA-N 475.258 0.579 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837318730 ZVMVJNVAQNYWAS-INIZCTEOSA-N 456.490 0.400 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1 1837384958 MRHATQICXANFHM-HBUWYVDXSA-N 463.373 0.324 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)c3ccccc3)C2)C1 1837456627 OZSMUGKGLZVGSU-CVDCTZTESA-N 471.489 0.466 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1Cl)CCO2 1837776334 YSAOVSPOGCEYLF-QVGKIPNLSA-N 488.932 0.939 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838031788 NBKLTBREDSJXFB-UHFFFAOYSA-N 463.535 0.478 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccno3)C2)C1 1838527112 IMMWPDUOSDETDM-NRFANRHFSA-N 474.426 0.892 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1OC 1838931837 KHPNBNFUQMSTMX-HSZRJFAPSA-N 478.546 0.147 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)cc1 1839197410 UKRHAMVYGPUCBS-FRQCXROJSA-N 475.311 0.876 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839204318 NMBCVRZGTWGFIL-BFUOFWGJSA-N 484.377 0.522 50 20 JCGD CC[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1839210976 INDCHTSEKOJIBE-WHSLLNHNSA-N 477.986 0.736 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C)c1 1839407282 DNVHYIYBTFSGHO-RUZDIDTESA-N 482.342 0.376 50 20 JCGD COc1ccc2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)ccc2c1 1840184169 BALFLMADYQTQRJ-RUZDIDTESA-N 499.568 0.686 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840867558 XJYUJNSBAJWGLI-IIBYNOLFSA-N 475.970 0.300 50 20 JCGD Cc1noc(N)c1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1842906836 SYLJUOANOUEPDT-UHFFFAOYSA-N 455.519 0.728 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)CC2=O)c1 1843012938 UOMJOSWHPMZLOG-SFHVURJKSA-N 477.326 0.245 50 20 JCGD CCc1nn(C)c(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1Br 1843147965 FRCRTKXQLZREAL-UHFFFAOYSA-N 475.152 0.556 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2n[nH]cc2I)C1 1844466791 JINQCHHZAJNXMM-UHFFFAOYSA-N 474.303 0.204 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)C1 1847456428 MDFGBLGXESXZDH-PMACEKPBSA-N 492.536 0.281 50 20 JCGD COC(=O)[C@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CCO1 728539339 HOWDVFHDDDDKBW-JVCXIRSZSA-N 467.482 0.741 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)n1 728723178 MCXJNAZMKITMEO-QFIPXVFZSA-N 485.522 0.684 50 20 JCGD CCCOc1c(Br)cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1OC 729276965 PNSYVEXGRBRTMT-SECBINFHSA-N 452.327 0.945 50 20 JCGD O=C(NC[C@@H]1CN2CCC[C@H]2CO1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 729620437 YKKZMRVSKAYPQY-DLBZAZTESA-N 451.549 0.278 50 20 JCGD C[C@@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 750547851 KCWSSEHSOXFBHI-YSIASYRMSA-N 455.559 0.910 50 20 JCGD O=C1CC[C@@H](C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCN(Cc4ccccc4)CC3)cc2)N1 913408284 KTLBPYIEFYOCFV-FQEVSTJZSA-N 485.566 0.233 50 20 JCGD CCc1ccc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)cc1 916516657 MYXOPIFRJWJAGM-UHFFFAOYSA-N 460.560 0.740 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cn1nc(-c2ccccc2)ccc1=O 916746334 LTNUSVXLPKFJNJ-UHFFFAOYSA-N 454.512 0.973 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2ccc(Cl)nc2)cc1S(=O)(=O)N1CCOCC1 917249167 WKZRQYMLEQEOAS-UHFFFAOYSA-N 454.892 0.839 50 20 JCGD O=C(NCC(F)(F)F)c1cccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 917723926 PTQROZSSWMUYRP-UHFFFAOYSA-N 493.489 0.895 50 20 JCGD C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 920050694 GFNXYDKCKMUELM-LBPRGKRZSA-N 469.451 0.810 50 20 JCGD Cc1nccn1CCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779376203 ZXDSIVVDRJBJKN-HYBUGGRVSA-N 483.573 0.798 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1779901225 LHSXBACVMQLJPJ-UWJYYQICSA-N 453.923 0.683 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccnc1C(N)=O)CCO2 1780095055 DDYRDTJMJMYCOY-QHCPKHFHSA-N 497.464 0.771 50 20 JCGD Cc1cc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n[nH]1 1780968298 IDTAAWAPJQSCHS-XMMPIXPASA-N 483.573 0.437 50 20 JCGD COc1ccc(F)c(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1OC 1781819989 KQHJPMZRWQLTDK-QHCPKHFHSA-N 472.278 0.280 50 20 JCGD CN(C)[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccc(Cl)cc1 1782822304 RPZSKGAZHMJWGG-URXFXBBRSA-N 485.777 0.766 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N1CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C1)CC2 1782988914 WDMZEICLBBMKIL-RXFWQSSRSA-N 478.354 0.624 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)c[nH]3)C2)C1)NC(=O)NCc1ccccc1 1783632247 ZINKFDRQHFTAIM-QHCPKHFHSA-N 472.521 0.944 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(=O)N(Cc4ccccc4)C3)C[C@@H]21)[C@@H](O)CCl 1784084232 OBAUIXPAJVGFKQ-WPVAHCMFSA-N 463.962 0.615 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC(=O)CN3C(=O)OC(C)(C)C)[C@H]2C1 1784199235 JIPDUSGNSLHVLW-HILJTLORSA-N 487.981 0.798 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1785446009 TZKSBAVEQXXYTI-ZYZAMLHLSA-N 460.535 0.255 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cnc3O)C[C@@H]21)c1cccc(B(O)O)c1 1786982119 NFVUHCHEHGTUKA-KKXDTOCCSA-N 459.695 0.028 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nnsc3C3CC3)[C@H]2C1 1787679911 QDIGOEJCURVUPC-KKUMJFAQSA-N 450.565 0.382 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccc4[nH]3)[C@H]2C1 1787838649 JNQGRTKQVYFROE-AXHNFQJDSA-N 463.498 0.469 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccccc34)C[C@@H]21 1788611378 XJVGKVGFHSKOOD-IXDGSTSKSA-N 463.498 0.469 50 20 JCGD Cn1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c2cccnc21 1788611380 XLBLXGLMOWYEKE-DCPHZVHLSA-N 477.525 0.479 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21 1791288876 ZBGMKGTWVQZWOI-KKUMJFAQSA-N 450.515 0.393 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]4C3)c2n1 1791291242 PUVQBPSUNUTWKF-WDSOQIARSA-N 471.562 0.312 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1F 1792072510 FMRNWEVFCGYEEU-SDADXPQNSA-N 462.927 0.422 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CC(=O)C3)[C@H]2C1)NC(=O)NCc1ccccc1 1792161943 RFHJWSDUPYOXMU-YYWHXJBOSA-N 471.558 0.291 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NNc1ccccc1 1792506810 SIBJETRLYZVDNK-WITPMNRCSA-N 481.557 0.715 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccnc1 1794867231 XBWJOOJNXKKVFE-IVSAIRAKSA-N 455.943 0.605 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CNc2ccccc21 1795618783 KYIOTCJPQHNXFO-BHRAJHTQSA-N 464.526 0.919 50 20 JCGD Cc1occ(C(F)(F)F)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795739193 ZBSCMVXASBNFBP-ZSBFGKGUSA-N 466.221 0.804 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795740770 LURRORDOZRXYHZ-SJXZZSFPSA-N 481.264 0.455 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797748583 KGAJULSBKRXSEY-OMDNBMQFSA-N 479.537 0.701 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(C)c1 1797752758 FHBYQJOGOAXCAH-YVWYUNDQSA-N 453.499 0.519 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 1799233867 IEZFBTRPZGXXPF-UGNRZPKXSA-N 495.621 0.596 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2sccc2c1O 1800017865 KCTKKJBBZTXCMH-YVWYUNDQSA-N 466.324 0.804 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)n1ccnn1 1800265748 KNCKPGOZTQVVQR-RBGFHDKUSA-N 470.958 0.561 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2 1800759967 UTDIVCPSRNGNRM-AHDPXTMNSA-N 478.384 0.635 50 20 JCGD COc1cc(Cl)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1 1801813070 CMYJPXMDSQNKMO-YVWYUNDQSA-N 452.939 0.925 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802344272 UTCSRXACNAEGIB-WOZUAGRISA-N 475.565 0.884 50 20 JCGD COc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1806039126 OXJMBSKMNMWIJG-DYESRHJHSA-N 461.287 0.193 50 20 JCGD O=C(CN1CCCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1806883113 IMNMGIGRPYFSJE-OFNKIYASSA-N 450.348 0.567 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCN2CCCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371087 PHJMZIIFSLBIEK-QPPBQGQZSA-N 464.375 0.957 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCc2cncnc2)[C@H]1c1cccnc1 1810301866 DDHOQQXQTJRFNZ-GCJKJVERSA-N 474.525 0.823 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cnc(O)nc3O)C2)CC1 1810867305 HTXDUAMRGYBDQD-VULFUBBASA-N 469.502 0.867 50 20 JCGD CC(=O)NCCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1812659645 VTTJGHHVFBXJAP-BHVKKIBXSA-N 467.530 0.748 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1813071098 NCZKDJGNFOXOFF-YCRPNKLZSA-N 456.503 0.580 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)no1 1813331563 HHNNCXWFGTVDNH-HRAATJIYSA-N 463.498 0.939 50 20 JCGD COc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)cn1 1819402269 YMNILQJQGCXANY-INIZCTEOSA-N 465.474 0.827 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1828875988 NFOOJARTHBWOBP-AEFFLSMTSA-N 452.600 0.687 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2C(=O)C=CC2=O)CC1 1828923742 WLTWPDJDPNMROK-IBGZPJMESA-N 482.541 0.234 50 20 JCGD COC(=O)C1(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CC1 1828924372 PLCXITZHAQSLJK-SFHVURJKSA-N 457.531 0.872 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1830450225 OWBXNIWLWMPROS-IQGLISFBSA-N 482.342 0.249 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733486 NLBRMQHBANYRCH-BEFAXECRSA-N 459.858 0.712 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCc3ccncc3)CCO2)C1 1833056666 IQTUOEZYRHPOQL-GQUZIAHASA-N 496.568 0.995 50 20 JCGD Cc1ccccc1NCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834773368 UQDKUEOFIDYVHX-UHFFFAOYSA-N 478.402 0.972 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798838 DJKZIYORTOQBIY-UHFFFAOYSA-N 497.376 0.942 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCSC(=N)N)CCO2)C1 1835643636 HKULEASSGIYJAU-LRDDRELGSA-N 451.387 0.491 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccncc3O)CC2)CC1 1835737940 MYIUEDVIXRKEIP-UHFFFAOYSA-N 467.530 0.285 50 20 JCGD O=C(c1ccc2ncccc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937096 OAROAAJWJXBKOF-VWLOTQADSA-N 475.310 0.298 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1Cl 1835942146 YRPVWMKPSDGCNV-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837483706 XOOPHILDSFNDEL-RVSPLBMKSA-N 460.304 0.424 50 20 JCGD Cc1ncoc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837525115 BRLJEUVMDVRPRU-UHFFFAOYSA-N 456.503 0.908 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1837714638 LUBZXMCLYCBUSM-NRFANRHFSA-N 461.595 0.580 50 20 JCGD CCOC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1837921664 UTMFHECTBTZLCL-UHFFFAOYSA-N 472.347 0.322 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1839152181 PZARPZKKHKROME-OALUTQOASA-N 472.329 0.741 50 20 JCGD O=C(COc1ccc(O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198480 FMPIIYRWGHLFBI-AEFFLSMTSA-N 461.284 0.918 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1 1839986593 UHGJQKKSLPKTHP-IFXJQAMLSA-N 478.384 0.999 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cc(Cl)ccc4n3)C2)C1 1840184271 GDYMYDCJKRBGKV-JOCHJYFZSA-N 492.964 0.431 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)Cn1cnc3c1c(=O)n(C)c(=O)n3C)C2 1841667067 OCTUDKLTXCUKAD-ZDUSSCGKSA-N 450.927 0.045 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1841670607 ZGDCZMYJLQZKLI-SOUVJXGZSA-N 456.996 0.777 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1845620890 NEGCNTHIIAMMND-UHFFFAOYSA-N 451.462 0.911 50 20 JCGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CC(=O)OC)NC(=O)OC(C)(C)C)C1 1846213625 QJKPLBKARQNQAH-KBPBESRZSA-N 461.943 0.900 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CNC(=O)[C@]13CCN(C(=O)OC(C)(C)C)C3)C2 1846365837 XSXSMFAPXBHCDV-PXAQALGRSA-N 499.008 0.817 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1 1846385846 CJMCKJCWETYZHK-HNNXBMFYSA-N 483.566 0.019 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)CCc1c(C)nc(N2CCOCC2)[nH]c1=O 14350720 BITPDFDJQRYMJY-UHFFFAOYSA-N 467.530 0.607 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)OC)c2)c2ccccc2c1=O 20908246 WSCARBJJJRROIE-UHFFFAOYSA-N 459.484 0.673 50 20 JCGD COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)[C@H]1COc2ccccc2O1 21191543 DHVIWDKGIORWAS-DNVCBOLYSA-N 491.522 0.216 50 20 JCGD COCCOc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1C 106088717 CFTHKCFKDOVASC-UHFFFAOYSA-N 456.546 0.937 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(COCC(F)(F)C(F)F)c1)N[C@H]1CCS(=O)(=O)C1 727797328 PDFRBOSZWSNNPY-NSHDSACASA-N 477.458 0.783 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNc2nc(-c3cccnc3)no2)c1OC 728076978 POSBLAJOPKTJMT-UHFFFAOYSA-N 490.498 0.927 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNc3nc(-c4cccnc4)no3)cc2)CC1 728078652 OKMLZUWGVFEKCL-UHFFFAOYSA-N 471.499 0.741 50 20 JCGD CS(=O)(=O)c1ccc(OCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 728339485 WZKSCSCKSYIGEK-SFHVURJKSA-N 478.479 0.390 50 20 JCGD C[C@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1=O 728377896 SHDUVDUYNPZCQM-QVKFZJNVSA-N 458.496 0.189 50 20 JCGD Cn1c(=O)c2c(ncn2CCC(=O)NNC(=O)c2ccc(Br)cc2Cl)n(C)c1=O 728828784 GXWJVTRHLSZDQM-UHFFFAOYSA-N 483.710 0.701 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccc(Br)s1 743746549 QAAZEKCEMPPUFH-SNVBAGLBSA-N 481.394 0.726 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1 747336208 CYHJCWRSTHGPSU-UHFFFAOYSA-N 493.611 0.593 50 20 JCGD CS(=O)(=O)c1ccc(NCCNC(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)c([N+](=O)[O-])c1 748328962 HEMFGDYAGYMJDU-KRWDZBQOSA-N 463.472 0.744 50 20 JCGD Cn1cc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)c(-c2ccc3c(c2)OCCCO3)n1 767830857 LQQWWCQIPYNVIS-UHFFFAOYSA-N 485.526 0.283 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 912852033 AGKAEUJVXGAKTB-UHFFFAOYSA-N 499.546 0.215 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(=O)n(-c3ccccc3)n2)cc1OC 914668290 QWINKKNAGRXCDI-UHFFFAOYSA-N 452.423 0.868 50 20 JCGD CC(=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccc(S(N)(=O)=O)c1 915936718 BRFLVOGOXXCIIS-UHFFFAOYSA-N 494.595 0.828 50 20 JCGD O=C(NCc1nncn1-c1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916580739 SEEOUEWCTZDPON-UHFFFAOYSA-N 485.526 0.432 50 20 JCGD O=C(COC(=O)C1=NN(Cc2ccccc2)C(=O)CC1)NNC(=O)[C@H]1COc2ccccc2O1 917268303 UXSBHPLOGKAQIX-LJQANCHMSA-N 466.450 0.696 50 20 JCGD C[C@@H](C(=O)N(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)n1cccn1 917496337 BNLHFSTWJJKXKE-KRWDZBQOSA-N 498.565 0.842 50 20 JCGD COc1cc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc(C(=O)O)c1OC 917723582 GZZKLDCXEYPLCO-UHFFFAOYSA-N 472.501 0.318 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C[C@H]1CCCO1)c(=O)n2Cc1ccccc1 918016089 CZZFTKIEFLOZBJ-MRXNPFEDSA-N 454.487 0.144 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CCN(c3ccc(F)cc3)C2=O)cc1 919689816 FBRYEIJBXCULKW-GOSISDBHSA-N 462.503 0.955 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 919886630 VLFBNNFUMUPBRO-NSHDSACASA-N 466.969 0.502 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778057385 XZCVLFBZLPLCHP-FKIZINRSSA-N 489.330 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnn(Cc4ccccc4)c3)CCO2)C1 1779032159 DBAKIUWKZRTBNL-VWLOTQADSA-N 489.536 0.687 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779373470 UTRLGVJXCRRELQ-WZONZLPQSA-N 471.562 0.094 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3nn[nH]c3c1)C2 1779374602 RGEWDKKWKDKXNM-AUSIDOKSSA-N 478.513 0.398 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3cccc(F)c13)C2 1779374673 XWQBTRSNNKXKOR-NTKDMRAZSA-N 495.515 0.913 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)n[nH]1)C2)NC(=O)NCc1ccccc1 1780559630 XDGWSHCVGMRINB-NTKDMRAZSA-N 499.572 0.589 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1 1781938795 OHOUDQHBNQNWAB-OAQYLSRUSA-N 470.442 0.056 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCCCC2=O)C1 1782101565 ICXKOBWUFQBLQF-HNZACBBNSA-N 486.573 0.647 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782210857 SHRHGIMJXAILTP-LYHRCORUSA-N 460.579 0.769 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1ON=C(c3ccccc3)O1)C2 1782214235 IVHOQJXOQDVCDQ-DQMJNTIXSA-N 487.557 0.608 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CS(=O)(=O)c3ccc(C)cc3)CCO2)C1 1783876874 SKILSDQAXRWKBJ-YLJYHZDGSA-N 458.964 0.852 50 20 JCGD CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21 1784619140 XYEXPYRDBZPKLU-DUPGQFARSA-N 458.968 0.839 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785348915 VANUBMHUKQMUCF-AOMKIAJQSA-N 469.583 0.493 50 20 JCGD Cn1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1C(F)(F)F 1786983462 UYCRSMPDRYSVHI-BPUTZDHNSA-N 480.252 0.026 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4snnc4c3)C[C@@H]21 1787508226 ALZTVYLHHZJULN-IVXIXMAJSA-N 496.553 0.814 50 20 JCGD COc1ccc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)[nH]c2c1 1787905756 GCFUCNLYXYGBNZ-NYDSKATKSA-N 477.326 0.763 50 20 JCGD CSc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609872 ANEHOLJMNOGJNC-KKXDTOCCSA-N 470.555 0.709 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ncc[nH]3)[C@H]2C1 1791482791 XOBDDVOZMUAACM-HRZAHRDASA-N 455.519 0.456 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2 1792872410 FRUAKVJGPNTKJP-OHTBPHCPSA-N 469.361 0.990 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOCCNC(=O)OC(C)(C)C 1793220965 PSSKWWOJJMULKE-DFGXFYAUSA-N 477.986 0.761 50 20 JCGD CCCC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1C 1795740283 NQOICBFDUDIDMM-IRJINJETSA-N 493.369 0.930 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc(Cl)c2nncn2c1 1796188645 CMIIUYQWGWOZDG-BJWYYQGGSA-N 453.695 0.628 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)(F)F)nn1C)C2 1796441727 WCTBJGAIWVTLAE-ISHQNBSSSA-N 495.462 0.776 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2sc(C)cn2c1=O 1797065443 XCJJYUHHJFATTK-NEBZKDRISA-N 454.936 0.521 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Br)cn1 1798032910 YJWHQKUPZSPZTJ-IVWMJMPLSA-N 468.352 0.420 50 20 JCGD 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CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)nn3-c3cccc(=O)n3C)C2)C1 1839143716 GHJKZPOPZNOBES-SBUREZEXSA-N 491.976 0.967 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839741974 JBYFYIHRHCROMM-KFUYTQMUSA-N 469.872 0.928 50 20 JCGD O=C(COCCO)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802131 MOVCTRLXNRJODJ-NQIIRXRSSA-N 485.375 0.458 50 20 JCGD Cc1cc(C#N)cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840184858 CVHYGRLLZSFROJ-HSZRJFAPSA-N 457.531 0.310 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1 1840187237 OSEKXOYPAHHKCX-GOSISDBHSA-N 465.355 0.964 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)c1ccccn1)CCO2 1840328268 CMQPSXVNLYNBTC-MJHSOURCSA-N 496.568 0.950 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)C1 1841352333 JHYIDSZNRDHIIN-QKPAOTATSA-N 457.955 0.814 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1cccnc1 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CCOc1cc(C=NNC(=O)CSc2nnc(O)nc2O)ccc1O[C@@H](C)C(=O)N(C)C 730558804 RTHDONHTMMOJQS-NSHDSACASA-N 464.504 0.779 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)C[C@@H](C)O1 731794485 WSTJCVLAEZWOHJ-IAGOWNOFSA-N 477.587 0.606 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCN(Cc3ccccc3)C2=O)c1 744878259 UTLPQDCIXXRDEQ-SFHVURJKSA-N 459.528 0.682 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)c3ccc(C#N)cc3)CC2)cc1 747175741 JBWHGIMLUZCTBW-UHFFFAOYSA-N 483.550 0.941 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=S)NCCc3cccs3)CC2)cn1C 747916129 IOQCKZUYOIBCKT-UHFFFAOYSA-N 470.646 0.929 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Br)cc2)n1 758325255 OBGZQLQPQONADX-UHFFFAOYSA-N 469.317 0.877 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc(CO)cc1)c(=O)n2Cc1ccccc1 820685103 HHDYOIYOIHMZIB-UHFFFAOYSA-N 476.493 0.381 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccc[nH]1 822066050 IGKNOFAYYULWCR-LRFDDAOPSA-N 454.530 0.169 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(C)[nH]c1C)c(=O)n2Cc1ccccc1 914756180 KFXZEASNQCLJKV-UHFFFAOYSA-N 493.524 0.461 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c2ccccc2c1=O 915906306 ZHYLXPYZGLSXSG-UHFFFAOYSA-N 469.502 0.615 50 20 JCGD C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1 916391855 JNJQFAPQSKSKGK-CQSZACIVSA-N 457.462 0.696 50 20 JCGD C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1 916391892 MCPGDYVJQHTIHZ-CQSZACIVSA-N 457.462 0.696 50 20 JCGD CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])cc1 916646738 KTSKBSRTHQDVBI-UHFFFAOYSA-N 451.461 0.755 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)[C@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)cc1 920030199 UHXMAPMVZYMYQT-SUJSUNJESA-N 461.478 0.888 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2N2CCOCC2)cc(OC)c1OC 920212950 IAJDTMQLQFEUHX-UHFFFAOYSA-N 494.526 0.271 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1 920824814 DYCAEJPOYYLENB-ZDUSSCGKSA-N 458.924 0.181 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3ncnn3c1)C2 1778091185 PVSBGRKPOGZXEF-VFHFUPNESA-N 492.540 0.991 50 20 JCGD Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)nn1C(F)F 1780307446 IYLQNCPLKJCUGJ-HXUWFJFHSA-N 463.445 0.342 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1780739740 XBVPEEIKKJDYGB-AUSIDOKSSA-N 458.320 0.003 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc(Br)ccc3O)C2)C1 1781194133 GIJCYSWFEBSEQE-NRFANRHFSA-N 497.390 0.900 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(C(F)(F)F)cn1)C2 1782211816 AIISVCVKSLNTGM-OXQOHEQNSA-N 486.495 0.996 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCN1C(=O)OC(C)(C)C)CCO2 1783934579 JFKTZRVVQPBHMY-MHECFPHRSA-N 495.621 0.979 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3C(=O)C=CC3=O)[C@H]2C1 1784801997 BFGLCEVPBYMTKP-QPSCCSFWSA-N 456.337 0.312 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 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RRVMKMBNZAGUCN-CRWXNKLISA-N 468.963 0.079 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc2n(n1)CCCNC2=O 1797965591 JZIPHYDLQJRECB-LCFLCXBCSA-N 480.529 0.402 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1cncn1)C2 1798523164 UWTZXMKFURJMPQ-YVWYUNDQSA-N 472.458 0.405 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Br)c(O)c1 1799585274 PCDQPPDJEPSKTO-HBCWATKFSA-N 483.363 0.731 50 20 JCGD COc1cc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(C)c1 1799723571 QBNSGQWRTJJSDG-VPTLXERWSA-N 467.526 0.828 50 20 JCGD CC(=O)N[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)c1ccc(F)cc1 1799816818 NLYYZHWXUZLBPP-LRSLUSHPSA-N 467.306 0.635 50 20 JCGD NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1800519749 ZBCNLYRIXQXIFV-YYAJDYIMSA-N 452.349 0.848 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(C)(C)C 1803386822 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COc1cnc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1810299530 SIVDPPRLLAACLI-FOIQADDNSA-N 476.497 0.512 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1 1810309128 PNYQZCFXFSTUSF-KSFYIVLOSA-N 475.509 0.743 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1812346052 FRSZVYQFLWVYLQ-WQCNXYOZSA-N 459.934 0.901 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1 1813069881 DPDBONCRKFNPDP-LAUBAEHRSA-N 464.530 0.817 50 20 JCGD O=C(CCc1cncnc1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339947 WMBFYHCLNKLNIL-INIZCTEOSA-N 451.317 0.472 50 20 JCGD C[C@@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816669166 YFZZSMGGBFCPTI-YUMQZZPRSA-N 481.336 0.526 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cncn1)CC2 1817279828 HUBDJDMNSZLDOW-BUGPSZFBSA-N 455.504 0.481 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(Cl)ncn3)sc2C1)c1ccc(B(O)O)cc1 1820933510 HVUKZZPRFIGIIR-GFCCVEGCSA-N 457.708 0.806 50 20 JCGD Cc1cc(C(=O)NCC(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)no1 1826088247 VRKPEVBGXMPWPS-GFCCVEGCSA-N 477.547 0.155 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc3c(c1)CCNCC3)CC2 1826089913 QHRHVEQDEVDNAM-MRXNPFEDSA-N 485.614 0.825 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1 1827677180 LTGYPNQLWNMGDC-CMPFEXHJSA-N 485.545 0.292 50 20 JCGD CCOc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1829552365 WOFGSCMBLAOFDL-QFIPXVFZSA-N 474.344 0.210 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCOc1ccc(F)cc1)CCO2 1830255710 KKLZKZDCPZVWLI-HSZRJFAPSA-N 480.537 0.424 50 20 JCGD O=C(c1nn(-c2ccccc2)c2c1COC2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830723873 SMKHDKQKJMIRSU-WMZHIEFXSA-N 490.944 0.572 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732477 YZEHHYPPAZEDJT-KUDFPVQQSA-N 453.923 0.306 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830735278 FSFUOTVYZJBUDL-CVDCTZTESA-N 495.960 0.311 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccoc3C1)CCO2 1830929746 AIPQDGYGFWCZLZ-QSLUSCNYSA-N 497.552 0.975 50 20 JCGD C[C@@H](Sc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831156638 BZFJWXBDXPHCLJ-HOYKHHGWSA-N 484.383 0.617 50 20 JCGD CC(C)c1csc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)n1 1833287822 FFGLONIKAUHOKY-OAQYLSRUSA-N 467.592 0.710 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1 1833451546 VULKSGQOBYRPLA-WMLDXEAASA-N 467.032 0.140 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(O)cc3)CC2)CC1)c1ccc(B(O)O)cc1 1834798277 BFEAQKHTAQCSLU-UHFFFAOYSA-N 451.332 0.571 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1834846553 UPOAMWHTRZGFAI-RUZDIDTESA-N 482.342 0.078 50 20 JCGD Cc1nnsc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835182889 DNZGZXNBQNOCGT-UHFFFAOYSA-N 457.365 0.025 50 20 JCGD C[C@@H]1CCc2c(C(=O)NC3CCN(C4CCN(C(=O)c5ccc(B(O)O)cc5)CC4)CC3)n[nH]c21 1835360771 SGWZAKJSBSWTNK-MRXNPFEDSA-N 479.390 0.638 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)no1 1835981238 COOLTPQVSVLDGQ-UHFFFAOYSA-N 469.546 0.735 50 20 JCGD O=C(c1cc(Cl)nc2n[nH]cc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836364839 CSTPJLZKIBFTEU-SCLBCKFNSA-N 458.302 0.281 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccncc3Cl)CCO2)C1 1837887041 DLFLRWULKPKHNL-NRFANRHFSA-N 474.905 0.117 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cccc1C=O 1837919411 NYLVNEFDIDDAGS-GOSISDBHSA-N 481.358 0.854 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cccc4nccn34)CC2)CC1 1837920271 UPCZLISKGZLHON-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1sccc1Cl)CCO2 1838222759 JCEQHBUPMNYUPJ-FQEVSTJZSA-N 464.736 0.465 50 20 JCGD CC(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1838979375 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COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)C2)C1 1840153917 FSIKZOQJPXXNOL-VWKPWSFCSA-N 477.986 0.952 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C34CCC(CC3)CC4)C2)C1 1840186098 ZYEKBFVCNZJUDE-UWFXLKAESA-N 450.580 0.786 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C)n1 1840337706 KOAINDILIPOHAA-VWLOTQADSA-N 481.358 0.081 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(c4ccccc4)(C1)C3)CCO2 1840954293 GKKBKHWIJVFTGR-WNMGUVTHSA-N 484.597 0.938 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cccnc2CS(C)(=O)=O)C1 1842240913 MAYYHOWZJDSBLS-MFKUBSTISA-N 486.554 0.577 50 20 JCGD Cc1c(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)cnn1C 1842521857 OKUWTJWYGCYTGS-UHFFFAOYSA-N 453.547 0.892 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012494 TUEXGTBADDAKEZ-UHFFFAOYSA-N 477.326 0.452 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2 1843416711 SBBDJTGOTGFSEO-AEIQVQRHSA-N 490.561 0.600 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C2 1846383505 HCAMNFCQSNRJCK-IRXDYDNUSA-N 481.594 0.181 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccccc1F 14800914 UOAWYXNHXHBUDH-MRXNPFEDSA-N 457.505 0.369 50 20 JCGD COc1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 22887030 NINMOTKJRAEZGE-UHFFFAOYSA-N 473.515 0.533 50 20 JCGD Cc1csc(=O)n1CCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 725907049 NXUJIWNGLHYLRG-UHFFFAOYSA-N 482.584 0.409 50 20 JCGD C[C@@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)C1=O 728377901 SHDUVDUYNPZCQM-VFNWGFHPSA-N 458.496 0.189 50 20 JCGD CC(=NNC(=O)[C@@H](C)NS(C)(=O)=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1 728435793 ACNPKHKMUGBNME-CZUORRHYSA-N 474.561 0.092 50 20 JCGD CS(=O)(=O)NCCc1ccc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)s1 728847497 HUKYHRVLXSGCOY-UHFFFAOYSA-N 452.562 0.307 50 20 JCGD C#Cc1ccc(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC(C)C)n(Cc3ccccc3)c2=O)cn1 728859342 UVRCXSCGEGKGIB-UHFFFAOYSA-N 499.531 0.902 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@@H](CC)N=c2nn[nH]n2-c2ccccc2)c2ccccc2c1=O 729258467 XONHAKDJQNVFKW-GOSISDBHSA-N 475.513 0.856 50 20 JCGD CCCCn1c(=O)nc(O)c2c1nc(CCC(=O)NNC(=O)N1CCOCC1)n2CC(C)C 745991912 KOLPFMPUEOWAKD-UHFFFAOYSA-N 463.539 0.760 50 20 JCGD CC(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 746974092 ZPRAOFPYHSQTIF-UHFFFAOYSA-N 497.599 0.437 50 20 JCGD O=C(CN1C(=O)CCOc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 747406131 VQWMCTRQQSTXDD-UHFFFAOYSA-N 488.522 0.284 50 20 JCGD O=C(COC(=O)Cn1cc(Br)ccc1=O)NNC(=O)[C@@H]1COc2ccccc2O1 914874677 SOHBCPNPEJVWDN-AWEZNQCLSA-N 466.244 0.141 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)CNc3ccc(OC)cc3)cc2S1(=O)=O 916987440 XQXPHJURRULFRM-UHFFFAOYSA-N 462.484 0.359 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2cnn(-c3ccc(Br)cc3)c2)c(=O)n(C)c1=O 917545140 PWCVNDOVILGCAZ-UHFFFAOYSA-N 478.332 0.670 50 20 JCGD Cc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)NCc1ccccc1 919885102 MUZHOPCJLGMZLB-KRWDZBQOSA-N 480.568 0.605 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)c1ccncc1 1321404786 VTVCVSZIRRUWSY-HNNXBMFYSA-N 483.344 0.838 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nc1Br 1779922704 IPYTVCHSOHZZQD-FQEVSTJZSA-N 498.378 0.669 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)nc2)C1 1780127717 LVENDKVSKBMVBW-VGOFRKELSA-N 454.487 0.227 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1OC 1780656032 YSEIPDXOJBUFIW-QHCPKHFHSA-N 454.288 0.141 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CCN3CCCC3)CCO2)C1)NC(=O)NCc1ccccc1 1780970741 XXVITAGKYMUSQM-VWLOTQADSA-N 486.617 0.648 50 20 JCGD COc1ccc(F)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1782923065 WJIANXCIOKYSFP-ZJSXRUAMSA-N 470.306 0.955 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1783537544 TYUJTUWDFPXPGU-JLTOFOAXSA-N 451.365 0.997 50 20 JCGD CC(C)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21 1783850872 WHQZAVOYCPZZEL-HUBLWGQQSA-N 458.968 0.696 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1)CCO2 1783878989 MQHGGTVCLFMXIU-RVHYNSKXSA-N 475.970 0.442 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccnc1OCC1CC1)CCO2 1783936571 PHIRLIBMHPFSMZ-QHCPKHFHSA-N 459.547 0.687 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2 1783937111 PNNUHDGJHWXQPM-RBZFPXEDSA-N 486.495 0.346 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783940143 SAIKPLSGYDCUPE-AOMKIAJQSA-N 469.583 0.493 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)CC1 1785317807 FKGNTNHMAMEPDE-RUZDIDTESA-N 499.373 0.377 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21)c1cc2n(n1)CCNC2=O 1786259704 YTKWWSYDCBIQSQ-HUBLWGQQSA-N 454.325 0.005 50 20 JCGD CC1(C)Cc2cccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)c2O1 1787365792 CWLYCPFCVIMEEM-NYVOZVTQSA-N 478.354 0.987 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)cncc3F)C[C@@H]21 1788610412 ZEZCXICPRRBLKJ-YLVFBTJISA-N 460.441 0.265 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)nn1C(F)F 1789329910 URVFYLXBNOOVNW-NUTKFTJISA-N 477.472 0.492 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CNC(=O)C3)[C@H]2C1 1790855438 NQXHYBRZKWGSJP-QXKUPLGCSA-N 472.970 0.234 50 20 JCGD Cc1cc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1F 1791978912 XJAOGRWWTDXEHE-XERREHJYSA-N 458.270 0.860 50 20 JCGD CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)c1I 1792976964 OZUUAGJPSHWVEC-INTNWOOBSA-N 496.733 0.380 50 20 JCGD COC[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793442631 NGESOIMDJVTEOK-ROPHOZQPSA-N 461.563 0.205 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)[C@@H]1CCc2nc(O)nc(O)c2C1 1794109236 XXSWOOIAEJBNGQ-LSSIXWDNSA-N 469.336 0.367 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(s1)CCCC3)C2)c1ccc(B(O)O)cc1 1795734774 ZMNZTIRUOWKERA-UPHUGPLXSA-N 454.357 0.824 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@@H]3CCC[C@H]1c1ccccc1N3)C2)c1cccc(B(O)O)c1 1795737463 JJHLFSBRCOFGMW-IBWAHOODSA-N 489.381 0.948 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSc1ccccc1[N+](=O)[O-])C2)c1cccc(B(O)O)c1 1795741110 ZVEAGPWYAWYFMX-VPTLXERWSA-N 485.327 0.270 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796367288 DZTVYWSXXHTBNE-KUCCMMOJSA-N 479.933 0.957 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)c2n1 1796441446 JFTXTSUMPLBNFP-CRAKFPHTSA-N 493.524 0.909 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C)nc1O)C2 1796441715 USLAXWDEXGKPKQ-OBAMXFLESA-N 454.487 0.433 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)N1C[C@@H]2C[C@H]2C1 1797629805 IUNGWSIGVVBBDD-GJQARSFISA-N 456.547 0.050 50 20 JCGD COc1cc(OC)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797752771 GHAFVWHSANMMLU-YVWYUNDQSA-N 469.498 0.219 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798524929 QOHLKBMZEJMGSZ-ZCQATVAHSA-N 474.470 0.414 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1ccc(F)cc1 1799050710 TXPVRKJYTOSUAS-UIVXMWCNSA-N 455.914 0.787 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)Cl)C2)NC(=O)NCc1ccccc1 1799097071 ANICSJYBMDHEAT-SCAQPMJSSA-N 473.908 0.754 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(OCCCO)cc1)c1cccc(B(O)O)c1 1799241058 SKZNLQGNSBAUBW-WKCHPHFGSA-N 452.316 0.693 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 1799986680 XQYXAWFBSIJJOC-ADHGMGHFSA-N 481.594 0.225 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])cc3c1OCC3)C2 1800979165 VQQLWZXVRIEMQV-DLTLXFJOSA-N 453.879 0.987 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1[N+](=O)[O-])C2 1801014506 VTOFMIKBZDTNCM-USGNIVHTSA-N 465.482 0.239 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(c2ccccc2)=NN1 1801214696 QUKDFNCKYUXBNY-DLRJPAPCSA-N 461.526 0.703 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1803866826 CXUGWTQYBPUKCL-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD CC(C)(C)OC(=O)CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1803897184 DEDHKUNYHXUTGP-PGRDOPGGSA-N 467.331 0.813 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(C(=O)O)ncn2)[C@@H]1c1cccnc1 1804967891 GJIJSJNWBXXHHA-KUHUBIRLSA-N 490.480 0.202 50 20 JCGD N=C(N)SCCC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807122642 STDDQJQZNSYVHN-APWZRJJASA-N 455.349 0.098 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1nc2ccccn2n1 1807934545 MNSBZZTTZVUAAE-RXVVDRJESA-N 470.298 0.438 50 20 JCGD O=C(CC(F)(F)C(=O)O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808286583 GEFXBVMIZYCDAP-MAUKXSAKSA-N 461.230 0.191 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1nc[nH]c1[N+](=O)[O-] 1808367332 DRQBUUAOOWLUIZ-YJBOKZPZSA-N 464.247 0.026 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)ccn1 1808918895 RANFDDVXLWZTCP-REWPJTCUSA-N 487.325 0.748 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCCO3)[C@@H]1c1cccnc1 1809867988 NKZPHLWIKMXWOY-VGSWGCGISA-N 469.546 0.753 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1ccccc1=O 1810302050 FDJPYOMYQOBEFI-TVTNDZMWSA-N 489.536 0.823 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810478277 RUFSYMPMJFYZLA-WRWLIDTKSA-N 477.529 0.328 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)[C@@H]1c1cccnc1 1811516762 LZQGKLOZUFEIAC-PBEJRMEISA-N 492.577 0.304 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813069538 ZMBMDEMDZSYFKY-RDTXWAMCSA-N 460.564 0.667 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356941 VRRVJQVTFWHYQI-XQGSKJQDSA-N 472.332 0.578 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361392 DGHIBNSGBBDHAJ-DOMZBBRYSA-N 488.375 0.962 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472789 YBBOFWCLYCLPEN-SFHVURJKSA-N 454.292 0.905 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476334 QHWZDVMFRVUTMS-KDOFPFPSSA-N 455.324 0.700 50 20 JCGD CC(C)n1cnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)n1 1817682742 DUXQMHOHKGDRIH-CQSZACIVSA-N 454.321 0.535 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCOCC2)[nH]n1 1818111716 CKEOKSSMTZFZFA-BIKZULFDSA-N 470.534 0.868 50 20 JCGD Cn1ccc(=O)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1820169352 YHRNZHPBTRXBKU-QGZVFWFLSA-N 464.486 0.727 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826088571 YHYPQFXSMKSOMN-RYUDHWBXSA-N 453.569 0.136 50 20 JCGD N[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1 1827054440 AVSVPWJXXDPOHA-FCHUYYIVSA-N 450.348 0.695 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828521229 WYMRXDWSQVWWFP-YCRPNKLZSA-N 498.374 0.780 50 20 JCGD COC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828550804 BOBHJKHBOQYSDK-HTAPYJJXSA-N 496.948 0.394 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1829762980 WLCBRLNUKRDUSU-NEPGBVGISA-N 458.353 0.332 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)CC1 1830157420 WVBYWCHBFYRILQ-JOCHJYFZSA-N 475.358 0.885 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c[nH]c1C 1830720106 SZCNJTBDTDYMDO-VGSWGCGISA-N 485.965 0.489 50 20 JCGD O=C(NC1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1)OCc1ccccc1 1830730770 DPDQRYGHWUKXOR-XMSQKQJNSA-N 495.960 0.502 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732231 WMFWWYPGLHAUTN-PGRDOPGGSA-N 452.935 0.610 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733032 CVQVTRKTVDCACL-JTSKRJEESA-N 478.933 0.725 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737009 CJTRRAOHVFSYJQ-WHSLLNHNSA-N 475.970 0.512 50 20 JCGD C=CCO[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831426894 LFVQZQLGAWKZIW-HRJSYZDASA-N 461.519 0.168 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2 1832387493 XQNRNZXPEQXVBL-DEOSSOPVSA-N 482.317 0.307 50 20 JCGD CC[C@@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 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NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cnccc4n3)C2)C1 1837459664 VLMKKHQBKMGHPK-XMMPIXPASA-N 491.508 0.012 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837627348 SPWCVAFISTWIIK-AUUYWEPGSA-N 469.336 0.508 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837713138 JJWJKITZPJGXBH-NRFANRHFSA-N 461.595 0.959 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n[nH]1 1837919490 YCFMDSCXJWNMPV-UHFFFAOYSA-N 454.336 0.578 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ncoc1C)CCO2 1838203294 JBWUJDCBGAYDMB-GQBLCDNYSA-N 458.475 0.187 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528181 KBGIABDKPXAKGU-UWJYYQICSA-N 499.904 0.844 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838642356 FQJCWQPOGKYMOJ-UHFFFAOYSA-N 466.579 0.867 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839150302 IPAYCQCZQIOHAP-XOKHGSTOSA-N 459.392 0.360 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1839964771 BXDNZQVJDHQXPP-VLIAUNLRSA-N 498.378 0.260 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COCCNC(=O)OC(C)(C)C)C2)C1 1840154980 LZIOIKQYWWLYEV-IERDGZPVSA-N 493.985 0.238 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(Cc3ccccc3)C(=O)OC)C2)C1 1840156435 SGKQXWGUINYFNY-AUSIDOKSSA-N 497.976 0.965 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1 1840183789 AHPOVWWESYEYMK-OAQYLSRUSA-N 464.544 0.937 50 20 JCGD O=C(CSc1nc[nH]n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840381007 HOOLPJPZCHOABK-FZMZJTMJSA-N 452.306 0.044 50 20 JCGD O=C(CSc1nc[nH]n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840381008 HOOLPJPZCHOABK-RISCZKNCSA-N 452.306 0.044 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C)cc1O)CCO2 1840668735 ZLCGZVRBWLYZFO-OTZYPNAKSA-N 483.525 0.905 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840737277 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CC(=NNC(=O)c1ccc(-n2cnnn2)cc1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 729817335 YZSWJRDCBYEGHE-UHFFFAOYSA-N 477.528 0.542 50 20 JCGD COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1 748831341 QBUAEOJMMURORK-UHFFFAOYSA-N 459.503 0.677 50 20 JCGD C[C@H](Cn1cncn1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 749211273 LUYREOIBJICGBK-OAHLLOKOSA-N 457.516 0.789 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(C)C 750873277 LAXUTFNHMZRLEY-ZDUSSCGKSA-N 463.354 0.424 50 20 JCGD Cc1nc2nc(N)nn2c(C)c1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 790768493 SQRDNJSJTBXPIG-UHFFFAOYSA-N 486.558 0.502 50 20 JCGD O=C(COc1ccccc1F)NNC(=O)NCc1ccccc1CS(=O)(=O)N1CCOCC1 806970055 CIWCFIIFIMVTBW-UHFFFAOYSA-N 480.518 0.897 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc(COC)o1)c(=O)n2Cc1ccccc1 849208544 BOQOTCPPDWCEJL-UHFFFAOYSA-N 480.481 0.629 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 913416789 SZUWMCXQGSZYKC-HNNXBMFYSA-N 475.401 0.851 50 20 JCGD CCOCCCC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 915639750 QAJGUZDQKAIVCK-MRXNPFEDSA-N 457.549 0.917 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O)c1ccc([N+](=O)[O-])cc1 918547846 WFUWNLAYSQDYAJ-OAHLLOKOSA-N 474.451 0.993 50 20 JCGD O=S1(=O)CC[C@@H](S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(CCCl)cc3)CC2)C1 919726546 GIQJXYFZTQKDLX-MRXNPFEDSA-N 471.022 0.291 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)cc1 919884475 GQJAGBMDMMCDAX-MRXNPFEDSA-N 466.541 0.927 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H]1CCOC1)c(=O)n2Cc1ccccc1 921202752 DCHCTMSZAVZWMK-KRWDZBQOSA-N 468.514 0.248 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1779034874 VXPGGCSAWIZARG-ATKOVBFVSA-N 456.528 0.607 50 20 JCGD N#Cc1ccc2[nH]nc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c2c1 1779036818 GJEQZHBVPFFWGK-HSZRJFAPSA-N 474.481 0.190 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779037351 WSKOPIMHZNNURJ-MWTRTKDXSA-N 452.515 0.402 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1781047531 CBXHFGUOMOSMCG-NYUBLWNDSA-N 466.376 0.545 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Br)C1 1781997406 UWRILRMJFYKUTO-SZOQZIPDSA-N 468.414 0.612 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)CC1 1781999334 WELVQYHVSJIVHY-WRWLIDTKSA-N 473.412 0.448 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1782081867 COEKVSYQLCZMQX-SEPYTNNBSA-N 483.610 0.787 50 20 JCGD Cc1ncc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)s1 1782506575 QWIIAHLFKKPMJT-XMSQKQJNSA-N 472.571 0.820 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1783234877 XDEYMPAZWNIESQ-ZJSXRUAMSA-N 499.304 0.784 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1 1783532965 UMBAAKQTCZZUSO-FZKQIMNGSA-N 474.377 0.853 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C[C@H]2C[C@H]21 1784105504 UOXSENMKLCBZTA-XTESEXHKSA-N 471.982 0.964 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1784197041 CHYRVSLIOSVZMY-RMEBNNNOSA-N 496.374 0.932 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2)CC1 1785238180 PWQVRSZTWKOSRF-REWPJTCUSA-N 464.994 0.872 50 20 JCGD CN(C)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786980878 CDNBOPVNKKWJIP-NYVOZVTQSA-N 451.332 0.340 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCCC3=O)C[C@@H]21 1789222166 BNYYAMMTOGQYEW-QSFXBCCZSA-N 488.497 0.736 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789921482 LRWNGJXNMXZPNM-PEDHHIEDSA-N 482.347 0.542 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)c(C#N)c3)C[C@@H]21 1791290889 RCUXBLSOQBZIGA-QRFRQXIXSA-N 459.522 0.593 50 20 JCGD 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CC[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)NC(=O)OC(C)(C)C 1799367718 PGZMTFXZSKYMFO-NZGUISNBSA-N 489.378 0.263 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(S(C)(=O)=O)ccc1F 1799862444 JUWQDPMKNVLOET-DJZPMSPPSA-N 462.927 0.686 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccnc2c(O)cccc12 1800096580 TWXLIXGSRRRJCD-VPTLXERWSA-N 461.283 0.137 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)CC1 1802225525 SFLDILBHSPUACX-YYIAUSFCSA-N 459.971 0.823 50 20 JCGD COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(N3CCCNC(=O)C3)n1)C2 1802273950 PKBIXPJLFIXVQX-YYIAUSFCSA-N 463.966 0.914 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803147738 GTLQUSTYIQVOSL-MUQADHOPSA-N 497.980 0.456 50 20 JCGD CN(C)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1805109662 WDRZZGJDUSUUPR-AUSIDOKSSA-N 473.342 0.856 50 20 JCGD Nc1ncc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1 1807273339 AWQOJVKESUXIKB-CRAIPNDOSA-N 451.317 0.434 50 20 JCGD Cc1cc2nnc(C(=O)NC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@H]3c3cccnc3)c(C)n2n1 1809193040 ZZYIZDLEBWDDDD-MBSDFSHPSA-N 493.572 0.829 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1 1809234809 CJSPKYKHKPKZOM-APWZRJJASA-N 465.518 0.212 50 20 JCGD O=C(O)c1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)ncn1 1809975095 SUBWTTWGIXMQDR-UHFFFAOYSA-N 452.276 0.013 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)c2ccccn2)[C@H]1c1cccnc1 1810303910 WOCZOMWGOYYYSC-NDXORKPFSA-N 474.525 0.495 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@@H]1CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]1c1cccnc1)CCC2 1812224872 UJXMLFLAJHYFTQ-PGRDOPGGSA-N 473.342 0.617 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1 1813072474 DWWXNBFDXHOVRZ-HTAPYJJXSA-N 464.530 0.817 50 20 JCGD O=C(/C=C/c1cnccn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813483805 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O=C(CCc1ccc2c(c1)OCO2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830723527 PCHGWVSBLJDGIQ-IERDGZPVSA-N 454.907 0.404 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(C)[nH]3)CCO2)C1 1831857129 RWKIKPIACQGRBM-JOCHJYFZSA-N 487.469 0.935 50 20 JCGD Cc1ccn(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)n1 1832549524 SZJQBXNBFDTAMV-HTAPYJJXSA-N 499.996 0.780 50 20 JCGD Cc1n[nH]cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549586 VDOWJLYBMSQJGZ-HRAATJIYSA-N 485.969 0.920 50 20 JCGD Cc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)cn1 1834078789 XQLNSXCENHAQQF-AOMKIAJQSA-N 497.980 0.987 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3c[nH]c4nccc-4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798036 XJKIPUSKRDTKKZ-UHFFFAOYSA-N 475.358 0.693 50 20 JCGD Cn1nc2c(c1C(=O)N1CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C1)CCC2 1834824636 CSJBZLMFAXCARU-LJQANCHMSA-N 455.353 0.764 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ccn(C)n3)CC2)CC1 1835118202 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C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1839154843 ZXIQZIQLUXHPBD-OALUTQOASA-N 461.346 0.972 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3occc3c1O)CCO2 1839564958 QHPOYWWTXSAZJL-DEOSSOPVSA-N 495.492 0.521 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839668005 UVHOSBWLQOXLNP-OHNRDTAOSA-N 487.326 0.347 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3O1)CCO2 1840139026 IFQXHVVAJNWGKS-RDPSFJRHSA-N 474.558 0.210 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840716818 UMSHEHRLUDZOEP-KOSHJBKYSA-N 471.558 0.757 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)[C@H]2C1 1843014891 MXNXFTMXZJNIRK-VAMGGRTRSA-N 499.373 0.065 50 20 JCGD COC(=O)C12CCC(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)(CC1)CC2 1843942398 ZSSSPXBTFKSRMC-UHFFFAOYSA-N 454.332 0.697 50 20 JCGD C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)N1CSCSC1 1844264625 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O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)NCCc1cccs1 920861272 MZCGUFZDLOTDNM-UHFFFAOYSA-N 493.611 0.934 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCc3cccc([N+](=O)[O-])c3)CCO2)C1 1779029082 QSBKXAJVUXZHEM-HSZRJFAPSA-N 482.497 0.670 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CNC(=O)c3cc(C)on3)C2)C1 1779126611 QNPFRNAGJCCYKW-ACJLOTCBSA-N 457.325 0.716 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779301278 OCAYGVIGGOCFCW-OAQYLSRUSA-N 476.643 0.364 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(-c2cccnc2)[nH]n1 1779754296 QHKUYMAFECITJQ-RCZVLFRGSA-N 489.341 0.593 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])C2)C1 1780123254 DLNFWHWIKHFXQK-JOCHJYFZSA-N 476.534 0.477 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1780361032 WSEJRSCIWVKJTR-SFQCIDFKSA-N 482.423 0.401 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCOC1)C2)NC(=O)NCc1ccccc1 1780559608 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NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3Cl)[C@H]2C1 1791471730 KKVBZDURECBHMF-SOUCHZLYSA-N 487.944 0.665 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(Br)ccc1F 1792694040 KGQOQABCZHJDBK-HBCWATKFSA-N 491.122 0.785 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1792926083 OCYMFJIZIIYADR-GPVSGQMNSA-N 465.290 0.364 50 20 JCGD CCOC(=O)/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1795088889 JQSMCXVZSJHKIU-QMHIHSFGSA-N 475.454 0.843 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(F)ccc3[nH]1)C2)c1cccc(B(O)O)c1 1795739260 XRLTVHAPCAAMKL-VPTLXERWSA-N 451.263 0.504 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1795895129 OVGXWQPDKVGITO-NDKCEZKHSA-N 466.362 0.750 50 20 JCGD Cc1ccc(SCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1797123352 YXJDSICTPQOWEO-OPMZPASUSA-N 454.357 0.670 50 20 JCGD Nc1n[nH]c(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)n1 1797628110 QFMCVRJFFOLSNC-RCJHGTSTSA-N 491.390 0.915 50 20 JCGD CC(C)(C)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)ccn1 1797749634 HWMWZDZAIGYPIG-CWPLJXCYSA-N 466.542 0.895 50 20 JCGD C=CCOCCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799094863 FDISLUGYQHZGNJ-RUMRUAAYSA-N 487.601 0.905 50 20 JCGD Cc1nn2cc(CC(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Br)nc2s1 1799344747 UVGPQIBJXKCVCI-DJBIQUGXSA-N 460.329 0.922 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCOCC2)c1 1799611854 JOMBGHCIYBVBLB-HNJRGHQBSA-N 451.951 0.980 50 20 JCGD C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1 1803012389 YJJQHPJWDOANBW-SUYBPPKGSA-N 466.336 0.670 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2C(=O)C=CC2=O)cc1)c1ccc(B(O)O)cc1 1803875693 ININYYZZFJANOG-NUZGMZIFSA-N 473.294 0.361 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807366989 WPYIPKKJLVRAAG-NTKDMRAZSA-N 484.325 0.526 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1Cc2ccccc2CN1 1808239152 NMPOFVIYTZDJDG-ZKMPZPQNSA-N 484.365 0.796 50 20 JCGD Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(O)n1 1811481215 DSLXUQRTFDLWOK-GHTZIAJQSA-N 460.299 0.804 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2nn(C)c3c2CCC3)[C@H]1c1cccnc1 1813071751 WEQUAZYBUSXKRA-HXOBKFHXSA-N 467.574 0.996 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813074613 UPMPUMGZOBZKDO-BLIXFSHQSA-N 456.551 0.388 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCS2(=O)=O)[C@H]1c1cccnc1 1813075268 ZSMCJFTWKQLTOU-ZWOKBUDYSA-N 465.576 0.038 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)Cc1ccccc1)CC2)c1cccc(B(O)O)c1 1815360707 XRIMDURODMDHSZ-MJGOQNOKSA-N 465.340 0.652 50 20 JCGD C[C@H](Cn1cccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 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C[C@@H](Cn1ccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826825880 OSNLIMUSBHSCBP-XJKSGUPXSA-N 453.333 0.582 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCN(C)CC2)CC1 1827680566 OQVRQZWZLPLTAU-DPRDIOBOSA-N 485.633 0.988 50 20 JCGD NC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc1ccccc1 1829360331 BMLMNPSEMDHNGN-FQEVSTJZSA-N 486.356 0.911 50 20 JCGD CCSc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1829576520 UUTPZSQPYHOVKX-HSZRJFAPSA-N 485.371 0.257 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1830543591 VGTWSHPAQMVYFG-CWTRNNRKSA-N 473.320 0.904 50 20 JCGD O=C(C1CCN(c2ccccc2)CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830719838 LXQZEHKCBLCKRQ-OFNKIYASSA-N 465.978 0.959 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)c1ccccc1 1830719845 MHRAEMAPCDVMMX-CSODHUTKSA-N 469.922 0.140 50 20 JCGD O=C(c1cc(Cl)nc2n[nH]cc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724270 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CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1839147397 PEBIWNNERDQFBN-YWZLYKJASA-N 470.979 0.365 50 20 JCGD C[C@@H](NC=O)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839166031 CZMJQUZIZHUXTA-DHJRUUKHSA-N 462.453 0.463 50 20 JCGD CC(C)c1nc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)no1 1839199171 RTASWRRLOXSIBL-YOEHRIQHSA-N 463.304 0.882 50 20 JCGD N#CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1839363027 DICXTMFMJWEIPL-XMMPIXPASA-N 478.509 0.135 50 20 JCGD CC(C)Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1839404608 FOGLMFGTOBLCDQ-AREMUKBSSA-N 480.370 0.949 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1O 1839472255 KEZMITJDENLOSO-YLJYHZDGSA-N 455.895 0.020 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)nc2nccn12 1839548301 QLQCJAPUDDKFMF-LJQANCHMSA-N 466.336 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)NC(=O)CC3)CCO2 1839609812 GIASWZMPVKOKBQ-XMMPIXPASA-N 487.557 0.014 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(OC4CCOCC4)n3)C2)C1 1840154377 VRSTXWQZXAMPME-FDDCHVKYSA-N 497.976 0.963 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)ccn1 1843600919 CWRKJSFFIIQMOU-VULFUBBASA-N 451.487 0.991 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1843886027 GNOHHOMQLGVTCD-MJGOQNOKSA-N 489.353 0.779 50 20 JCGD Cc1nc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)cn1C 725878242 NIASPZPPTQMHRC-UHFFFAOYSA-N 471.539 0.824 50 20 JCGD CCN1CCCC[C@@H]1C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 729515800 OABSZBFSJDUJAS-QZTJIDSGSA-N 482.603 0.975 50 20 JCGD COc1cccc([C@H](CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)N(C)C)c1 915900859 ICWGXDROOAKZIP-FQEVSTJZSA-N 491.618 0.955 50 20 JCGD CC(=NNC(=O)[C@H](C)CN1C[C@@H](C)O[C@H](C)C1)c1ccc(S(=O)(=O)N2CCNCC2)cc1 916373017 XUMIVOIUBWGLOP-KZNAEPCWSA-N 465.620 0.866 50 20 JCGD COCCn1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccc1=O 917391814 KNWQXHFJOBIZGD-UHFFFAOYSA-N 462.528 0.744 50 20 JCGD COc1ccc(C(=O)N2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)cc1 918776049 GYRCKCATRNCYPI-UHFFFAOYSA-N 474.543 0.801 50 20 JCGD CCO[C@H](CC)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 919979470 UJLJLKSQKJRCIH-MRXNPFEDSA-N 456.503 0.390 50 20 JCGD CN1CCN(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)CC1 1778257754 JAUMDBHURVGXMT-HTAPYJJXSA-N 488.029 0.196 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc2c[nH]nc12 1779037088 NJCPOTJVLMWWNX-HSZRJFAPSA-N 463.498 0.627 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cccc4nscc34)C2)C1 1782414560 PXZOJLMGQVFWLC-QFIPXVFZSA-N 451.313 0.733 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1782469561 XFOZNOYJXQDMDG-OAFZBRQQSA-N 488.358 0.661 50 20 JCGD CCC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21 1784618038 GXZXPOWOUYORFY-QAETUUGQSA-N 450.001 0.799 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1785113952 ZMKQZZQKDGCKDN-QHCPKHFHSA-N 466.498 0.401 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1 1785229138 QORNZUJUJAITQJ-LIRRHRJNSA-N 462.927 0.927 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3cc(C)c(O)nc3=O)C2)C1 1785354693 QTERTXOBCWCYST-UGSOOPFHSA-N 457.325 0.261 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)C3CC(=O)C3)C2)C1)NC(=O)NCc1ccccc1 1785406092 IJKAEBPSDPELBZ-HSZRJFAPSA-N 457.531 0.142 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(S(C)(=O)=O)c3)[C@H]2C1 1785589414 OYOCPMDEDKPPHK-SJWGOKEGSA-N 459.952 0.332 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCBr)[C@H]3C2)c1 1786401270 VYAAMVKEMLXILM-RCBQFDQVSA-N 474.377 0.863 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-c4cnco4)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981666 DXLFASOVOLSYSL-RRPUWOKSSA-N 475.310 0.929 50 20 JCGD CN(C)[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)c1ccccc1Cl 1786984957 CQGHUCKXCTUFHR-RBQRNVLBSA-N 499.804 0.916 50 20 JCGD O=C(NC1(c2ccc(NC(=O)c3cc4n(n3)CCNC4=O)cc2)CCC1)c1ccc(B(O)O)cc1 1787570865 MRVGWGKIQFIVRM-UHFFFAOYSA-N 473.298 0.368 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(N4CCOCC4)n3)[C@H]2C1 1787656899 DHTQSRUZLRUIKX-BMFAXAFESA-N 466.966 0.765 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cnnc2ccccc12 1787884216 GJEGSDTVMOPPLG-BUKVSMQUSA-N 460.299 0.217 50 20 JCGD CN(C)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611728 WGPYFFXPGZNVHU-DCPHZVHLSA-N 467.530 0.053 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)[C@H]2C1 1791540312 NCYDFGDMOAZSCU-NLNMYJFZSA-N 453.971 0.844 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792980988 ORSYZTSOWQMCJB-DJZPMSPPSA-N 455.851 0.323 50 20 JCGD C#CCO[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1793340962 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CFVLUYXYRCLLDJ-DPIQGUFMSA-N 489.330 0.360 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)N1CCOCC1 1798488818 ILJZKXQAQNOEPZ-YJXLLHPSSA-N 476.486 0.423 50 20 JCGD CC[C@H](C)[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095355 OXKDFBFWSCYTDR-DTTOWAHTSA-N 475.590 0.329 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801016174 KDMRPLMGQDIYTN-RNJOBUHISA-N 454.351 0.919 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2 1802343669 IAJLYRPBWGVBHM-GGPHIMKMSA-N 467.526 0.741 50 20 JCGD Cc1nnc(CCC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)s1 1804558389 CGFVZHGMIMHFHJ-XMSQKQJNSA-N 479.371 0.874 50 20 JCGD N[C@H](C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccn1 1807161953 DFVNPLTUDFNFDH-COPCDDAFSA-N 459.315 0.176 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccnc(Cl)n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361862 UIQZAUFMOBILHJ-VQIMIIECSA-N 465.706 0.838 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807374588 LKAIXZSJJBXAQL-OWQGQXMQSA-N 460.137 0.864 50 20 JCGD Cn1nc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c2c1CCC2 1809364827 GTUGZJFKGJEHGW-OPAMFIHVSA-N 488.552 0.936 50 20 JCGD Cc1nccn1CC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810306096 SRERJRYSXZQOAV-UWJYYQICSA-N 462.514 0.605 50 20 JCGD O=C1Cc2cccc(C(=O)NC[C@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)c2N1 1812208725 MCYHEEVBKXWKGI-DVECYGJZSA-N 484.321 0.889 50 20 JCGD COC(=O)C12CC(C(=O)NC[C@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@H]3c3cccnc3)(C1)C2 1812839535 ZKCGAAGNJJLMTJ-GYBSWCFTSA-N 471.558 0.804 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813619417 CTLHIDDYTOBFFZ-PMVMPFDFSA-N 464.375 0.954 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1 1815333905 YUHVFMLJQYTYBA-JGVFFNPUSA-N 466.321 0.883 50 20 JCGD O=C(CSc1ncccn1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815340099 GDEMVFGKJGHCLF-AWEZNQCLSA-N 469.357 0.631 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](F)Cl)[nH]n2)n(C)c1=O 1815799222 ATZVOYXFMYRQTC-NHYWBVRUSA-N 480.888 0.384 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797945 PGAPKPADIDKUKK-QWRGUYRKSA-N 457.516 0.058 50 20 JCGD CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1)NC(=O)NCc1ccccc1 1820710989 IKTKDQXWWGIJNI-GOSISDBHSA-N 495.548 0.435 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2C(=O)CSC2=S)n[nH]1 1823499385 DEEZGGCYTFWTQH-ZDUSSCGKSA-N 481.604 0.635 50 20 JCGD Cc1cnn([C@@H](C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1 1826744811 OVJTUVRBENNLNI-BBRMVZONSA-N 453.333 0.815 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1827401388 KYSHGZDDNGJMJA-UKRRQHHQSA-N 451.915 0.300 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1828873500 QKSXYZWTWAPKMM-HNAYVOBHSA-N 473.578 0.626 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2 1829840118 ZBDWBSVBILXDHV-XMMPIXPASA-N 464.327 0.168 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830363521 ABTBZYJZTVZYPJ-JLTOFOAXSA-N 463.959 0.551 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)N3CCN(C)CC3)C2)C1 1830543295 PESGKAXPRGYEGW-UWVAXJGDSA-N 475.428 0.110 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798263 AEMNFWOLKNTNLB-QGZVFWFLSA-N 458.368 0.353 50 20 JCGD Cc1cnc2c(C(=O)N3CCC(N4CCC(NC(=O)c5ccc(B(O)O)cc5)CC4)CC3)cnn2c1 1834798624 RWYATGNSSZSTTJ-UHFFFAOYSA-N 490.373 0.217 50 20 JCGD COCCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](Cl)COC)CC3)CC2)n1 1835186948 SXOKAONUYWHZGF-GOSISDBHSA-N 455.987 0.969 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3nnsc3C3CC3)CC2)CC1 1835212093 DZDAPHJVWGHHOT-UHFFFAOYSA-N 477.635 0.974 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1 1835838036 ZGRWVBLPXAELHF-UHFFFAOYSA-N 455.676 0.783 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3c3ccc(F)cc3)C2)C1 1835926300 LRGBNBNBPKAYNU-WRALFONMSA-N 482.317 0.379 50 20 JCGD CC1(C)Cc2cccc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2O1 1835935524 IWOCCKZNOSVRGO-SANMLTNESA-N 494.353 0.464 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cc(F)ccc3[nH]1)CCO2 1836806954 IFHWFNRQHAHUOC-QHCPKHFHSA-N 475.521 0.750 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1837396976 PNNQTXGURCJLAP-SBWREMAFSA-N 475.546 0.150 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)cc12 1837459475 RCJSZKJPHPTFIJ-RUZDIDTESA-N 492.536 0.859 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049184 BWBPSOXCMBSQFE-OXJNMPFZSA-N 480.363 0.902 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)N3CCN(C)CC3)CCO2)C1 1839105696 GQCYLLHHXNRRIK-QKLQHJQFSA-N 475.428 0.252 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839683332 YRSVCXZTEHPFAX-GUAQKMMCSA-N 493.517 0.138 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c(=O)cn3)C2)C1 1839743990 ITVAXKUAZZYEMJ-GBXRJUDBSA-N 485.447 0.725 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1839966646 LQGPKOUZACZDDH-DNVCBOLYSA-N 471.352 0.745 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1840033777 PSELAXWGAKCCJR-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)COC3CCCCC3)C2)C1 1840182820 JPPFXDBSTFPUHM-JOCHJYFZSA-N 454.568 0.165 50 20 JCGD CC(C)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)no1 1840183600 ODIGOADQLIYHIT-NRFANRHFSA-N 451.524 0.241 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1OC 1840185913 ZYROKLPTPIFNKH-HSZRJFAPSA-N 478.546 0.147 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OCC4CC4)cc3)C2)C1 1840187395 XOSYWRLZTPVRHA-RUZDIDTESA-N 488.585 0.918 50 20 JCGD CC(C)(C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)c1ncc(Br)cn1 1841453846 OTXYMFXTNKLGQW-UHFFFAOYSA-N 487.163 0.714 50 20 JCGD O=C(c1cc2cc(Br)ccn2n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014170 GVQICVRLYNWETN-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD Cn1cnc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c1C(F)(F)F 1844264113 GHTAUYISVUSILW-UHFFFAOYSA-N 451.409 0.568 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CC(=O)OC)NC(=O)OC(C)(C)C)C2 1846364858 NLQLMEFTDCNVGL-UONOGXRCSA-N 461.943 0.900 50 20 JCGD COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1 9930882 GERPHKPFXAVHLP-OAHLLOKOSA-N 481.552 0.716 50 20 JCGD CN(C)C(=O)c1ccc(SSCCCC(=O)ON2C(=O)C[C@@H](S(=O)(=O)O)C2=O)nc1 514280157 KMRAQLKAJPMTOK-LLVKDONJSA-N 477.542 0.777 50 20 JCGD CN(C)CC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N3CCCCC3)ccc2n1C 727761442 DWPGCJVRNUKMOO-UHFFFAOYSA-N 450.565 0.390 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CN3C(=O)COc4ccccc43)cc2)CC1 728213253 WJBPARSEPMKOTD-UHFFFAOYSA-N 459.528 0.491 50 20 JCGD COCCCNC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)cc1 728262302 CIVLFICJFJBQTN-HUUCEWRRSA-N 462.594 0.882 50 20 JCGD O=C(Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O)NNC(=O)c1ccon1 747150035 QQPGVAXDHRQCCJ-UHFFFAOYSA-N 499.487 0.906 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1cc(C)no1)N(S(C)(=O)=O)CC2 747305449 WFFJRWHGGOLEAK-MRXNPFEDSA-N 481.531 0.780 50 20 JCGD CCCCn1c(CCC(=O)NNC(=O)C(=O)N2CCCC2)nc2cc(S(=O)(=O)N(C)C)ccc21 748247550 QHPSHUDCMSIADB-UHFFFAOYSA-N 492.602 0.789 50 20 JCGD CON(C)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)ccc1Cl 764023034 RSSCLRHBHNUUHM-UHFFFAOYSA-N 490.947 0.834 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)NNC(=O)c1cccs1 825467590 AIVUWDNNLBHPAF-AWEZNQCLSA-N 467.525 0.823 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)cc1 913210894 UVNAYYFIDQMPIQ-UHFFFAOYSA-N 480.510 0.128 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(C3CC3)nc3c2c(O)nc(=O)n3C)c1 914164101 SNBVZYAWLCCLFR-UHFFFAOYSA-N 486.510 0.237 50 20 JCGD COCCN1C[C@H](C(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CC1=O 914462280 JEUDQCICWGMOIS-CYBMUJFWSA-N 466.541 0.805 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CCn1ccccc1=O)N(S(C)(=O)=O)CC2 916159595 VFIAHKMEYFOWHA-QGZVFWFLSA-N 492.554 0.352 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NC1CCN(C2CC2)CC1 916240231 YYQRDHXVYXBWKE-UHFFFAOYSA-N 479.603 0.597 50 20 JCGD CN(C)CCN1CCC(NC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1 916382525 HKVGADIJDCBDFV-UHFFFAOYSA-N 466.608 0.441 50 20 JCGD CO[C@H](C)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 917690040 UMFTVBPMAZBDSK-QGZVFWFLSA-N 460.556 0.989 50 20 JCGD CC[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1ccccc1OCC(=O)NC 918222026 SJNQHXFHFFENPM-KRWDZBQOSA-N 452.475 0.882 50 20 JCGD COc1ccc(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc1S(=O)(=O)NC1CC1 921161265 GBQTVQRNRJJBBD-ZIAGYGMSSA-N 454.549 0.396 50 20 JCGD O=C(Cn1nc2n(c1=O)CCCCC2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 1248558304 NOHWMCBHCICXBL-UHFFFAOYSA-N 462.532 0.017 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cn2cc(F)ccc2n1 1779027713 XHXJANMWVPRXNI-HYBUGGRVSA-N 480.305 0.595 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029716 XNNBUHMKQWBPPO-MWTRTKDXSA-N 467.530 0.134 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2 1779200661 NGSDYWQKJBHFGW-CTWCOEIASA-N 450.330 0.348 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)o1 1779372621 OXDWZSFUAKLHAP-WZONZLPQSA-N 484.513 0.678 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(N(C)C)nc2)C1 1779861434 MURWUTOKRJTLOP-WZONZLPQSA-N 460.579 0.648 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C2)C1 1780237159 QDPXUIRBVAZZPQ-JOCHJYFZSA-N 498.452 0.079 50 20 JCGD Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(-n2nccn2)c1 1780240758 SQPZMPHEPFTZMG-XMMPIXPASA-N 475.314 0.013 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)C#CC3CC3)CCO2)C1)NC(=O)NCc1ccccc1 1780970524 ZPCVVHKGLUIOPW-XMMPIXPASA-N 453.543 0.576 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214286 PUTZBLPEQOWKKB-JBYIUTFZSA-N 453.584 0.178 50 20 JCGD O=C(CCc1cccc(O)c1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782318591 HRPCODPPWXZDGT-RCZVLFRGSA-N 466.343 0.832 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1782842706 CEACQFSTTRDEFJ-GDKCJGSASA-N 450.845 0.573 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(NC(=O)OC(C)(C)C)CC2)C1 1783346330 ATRBDHTXUZIYLG-UZUQRXQVSA-N 495.621 0.931 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2 1783933449 JODSHWTWQSOQQL-ZHRRBRCNSA-N 467.567 0.199 50 20 JCGD CC(C)[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)N1Cc2ccccc2C1=O 1783933670 VFBZTPMEAIOJLN-JYFHCDHNSA-N 499.612 0.870 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(Br)cn1)CCO2 1783934708 LADYXODANWYUTK-IBGZPJMESA-N 468.352 0.661 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21 1784446613 YGZJLFKQNVFCLK-RVFOSREFSA-N 458.408 0.530 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978672 JJAPBUGHYGLLSK-YYWHXJBOSA-N 467.287 0.111 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607862 PPYRRJXDDXUSTA-KNPMLCFXSA-N 468.352 0.309 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C[C@@H]21 1788610792 APLZJPNDAXRQFG-YYWHXJBOSA-N 489.536 0.982 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nn(C)cc4c3)C[C@@H]21 1791293737 GKTCHDYQXXMEEV-QRFRQXIXSA-N 456.547 0.540 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)CC2=O)c1 1792426066 BEJQXBSXJJHZKR-KLSISNOZSA-N 465.934 0.237 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCC(=O)Nc1ccccc1 1792937110 QBAMQLYTNUINPV-GPVSGQMNSA-N 494.552 0.697 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(S(C)(=O)=O)c1 1794321188 NCFBJJFOTWLRQI-HRJSJKBJSA-N 464.371 0.925 50 20 JCGD O=C1CSc2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)ccc2N1 1796728944 DZRNHVLLGRHHNE-BCDXTJNWSA-N 465.340 0.976 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1Cl)C2 1797748607 LZWMMAJWWCPCIV-NXCRSVRDSA-N 475.908 0.924 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1scnc1C1CC1)C2 1797749539 CZTRUXRWZKWNOK-YWVIFJGQSA-N 456.528 0.536 50 20 JCGD CC[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)NC(=O)OC(C)(C)C 1799369352 HOFPHBXMRDGKKJ-KYFSNAEOSA-N 483.610 0.642 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCCC1=O)C2)NC(=O)NCc1ccccc1 1799865015 XZSGUFDXVRBYPF-ACDBMABISA-N 470.574 0.593 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)C1 1803131363 SZYVHTHBWZKXSC-LTVCHDBBSA-N 494.552 0.989 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803140026 XXHQLXJAAIQYIR-FKRYYOTISA-N 460.922 0.821 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1 1804948690 DKSGHGFDXUAABT-HRAATJIYSA-N 456.503 0.173 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1 1807359697 CHVNPEWBMGXDBP-GCJKJVERSA-N 475.314 0.584 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1807364934 UZNGFEPZCGVFCZ-PGRDOPGGSA-N 475.314 0.584 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368178 ZOJSJFNSOVEBJA-PGRDOPGGSA-N 459.315 0.538 50 20 JCGD O=C1CCc2ccc(C(=O)N3CC[C@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)nc2N1 1807370679 IKFRXICMUIMWOZ-AUSIDOKSSA-N 499.336 0.675 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371023 OCJHARFESPPDHY-ZJSXRUAMSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(-n3ccnc3)ccn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376612 WOYIVUNWZPWJGD-HYBUGGRVSA-N 496.336 0.976 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1 1810301710 AIKYKFMWBGVZIJ-UGSOOPFHSA-N 479.457 0.345 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@H]1c1cccnc1 1810306052 RVBWGMJPTCHZQL-AOMKIAJQSA-N 490.524 0.528 50 20 JCGD NC(=O)c1nccnc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1 1811191855 RABLNPYGIVUBLZ-CQDKDKBSSA-N 465.283 0.981 50 20 JCGD CC(=O)N/C(C)=C/C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812318210 FVXGJVVFQTWUAH-JCAKXMGSSA-N 450.304 0.121 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1812365256 GOIIMBCEWVLBFP-BPAFIMBUSA-N 469.303 0.643 50 20 JCGD CC[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1812776136 HFNSNUBWELQAGA-IJEWVQPXSA-N 477.296 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1 1813075037 ZIDZHEFRPZOWCQ-JTSKRJEESA-N 469.546 0.753 50 20 JCGD Cc1nccn1[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813489644 IMBQCNHZLZRANB-CNDZOEFASA-N 461.331 0.847 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1814126485 MAMXFDMVGGYFQL-JRGCBEDISA-N 481.557 0.705 50 20 JCGD CCn1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1C 1815344366 VVYOCBFSRQMKDQ-HNNXBMFYSA-N 453.333 0.887 50 20 JCGD COc1cccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815350528 XFIZIXOALGXHHS-MRXNPFEDSA-N 466.328 0.695 50 20 JCGD COCCn1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815354752 RIQJOYORBYUHOK-HNNXBMFYSA-N 469.332 0.205 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361994 XOUDJDLBQICESD-CQSZACIVSA-N 474.348 0.573 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1)NC(=O)NCc1ccccc1 1815779498 GLSSWPDYPNOODQ-MRXNPFEDSA-N 497.585 0.693 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCOCC1)CC2 1817280184 PHLHPRGMHHNTOJ-WOLHVBPDSA-N 473.559 0.521 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1csc(N)n1)CC2 1819795838 UTCYUNXEGNRTKL-MRVPVSSYSA-N 458.529 0.720 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3cccnn3n1)CC2 1819798031 RFDZWNVGEADMCF-LLVKDONJSA-N 477.510 0.724 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3c1OCCC3)CC2 1819799412 BTFLVDFUCCFIOA-NSHDSACASA-N 482.526 0.660 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Nc3cnccn3)C2)C1 1830539866 JRZAYQMQIPSCPX-ZRGWGRIASA-N 470.368 0.764 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1830542667 BBORMAOPOKNZAB-MXTNKPTQSA-N 486.407 0.875 50 20 JCGD COC(=O)C12CC(C(=O)N3CCOC[C@@]4(CN(C(=O)[C@@H](C)CBr)CCO4)C3)(C1)C2 1830544443 YRNVXYMTURZFPY-PHSYYZNHSA-N 473.364 0.817 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(Cl)c1 1830726595 RMAQOYJZXRUYIK-FXAWDEMLSA-N 461.342 0.947 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN3C(=O)CNC3=O)CC2)CC1 1833679160 PFLXGWWZLQGMBF-HNNXBMFYSA-N 472.384 0.283 50 20 JCGD Cc1ccn(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1833854233 ZLWIYWYNWLSKOF-UHFFFAOYSA-N 468.562 0.075 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3c(s1)CCC3)CCO2 1834545734 UMYLNOMMQCMWBC-QHCPKHFHSA-N 470.356 0.300 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1834818876 FOFUIFIXPSQVEE-XCLFUZPHSA-N 499.362 0.234 50 20 JCGD COCCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](Cl)COC)CC2)CC1 1835179941 JLEAQOXNNRLRDH-GOSISDBHSA-N 455.987 0.969 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1 1835350420 IROWMZJGLZSVHG-IEBWSBKVSA-N 462.927 0.623 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CC3(F)F)CC2)CC1 1835449898 DYGOCMXSCDWZQD-KRWDZBQOSA-N 450.490 0.526 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cscn3)CC2)CC1 1835737215 WYNCOLZVPZMDRO-UHFFFAOYSA-N 457.560 0.641 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1 1835831410 PEEMPWVDLKUHPM-GYTVLKFYSA-N 497.556 0.062 50 20 JCGD Cn1cccc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1=O 1836970418 TZXKHEKXQAENJJ-UHFFFAOYSA-N 482.541 0.310 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CSCc3[nH]cnc3C)CCO2)C1 1837332672 AIFBTPDKZKBZQC-BEFAXECRSA-N 460.984 0.662 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccs3)C2)C1 1837457929 XAKQZOLZMFRUSS-SIAOZKNOSA-N 471.539 0.530 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)n1 1837657037 MFLWVPUNCKADQK-FQEVSTJZSA-N 485.379 0.528 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1837920119 BZKMPSCVESNXCT-UHFFFAOYSA-N 495.341 0.474 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCc3cnn(C)c3)CC2)CC1 1837933426 XADHFZWLGYCENN-UHFFFAOYSA-N 462.595 0.724 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)n1 1838360000 NJMDWOXEVUMNBI-QHCPKHFHSA-N 468.514 0.081 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc4c3OCO4)CCO2)C1 1838474282 CGMNCMNOWAUAAD-YJYMSZOUSA-N 470.320 0.911 50 20 JCGD CCOc1ccc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)nn1 1838560663 AGUHGHZDEVGGLI-UHFFFAOYSA-N 476.578 0.861 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839150845 ZBPTVNAQDAZWJI-OALUTQOASA-N 452.379 0.986 50 20 JCGD O=C(c1ccc(Cl)nn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200355 JDAVJKAZJQHDQZ-WFASDCNBSA-N 451.680 0.891 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1 1839373466 HXBZGTKDURGWBM-ADLMAVQZSA-N 459.293 0.657 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)c(N(C)C)c(F)c1)CCO2 1839469662 ZIQMETQRAFLFIB-HSZRJFAPSA-N 497.543 0.474 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3nn[nH]c3c1)CCO2 1839628977 UPFFOZDLFGBEOP-GOSISDBHSA-N 452.309 0.813 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1840034984 CEXGRZVOPNHZJA-AVYPCKFXSA-N 483.363 0.440 50 20 JCGD CCc1nn(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)c1Cl 1840150405 KDCBGSSRLAIIMU-ORAYPTAESA-N 463.362 0.960 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1 1840183105 REZKIFCJFRHMBG-HXUWFJFHSA-N 453.927 0.178 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1840289825 NZYRKFDYNQPMBJ-IAMHBRQHSA-N 477.917 0.903 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)(C1)C2 1843012353 GOKNRXPYGLWAEG-UHFFFAOYSA-N 469.347 0.631 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCCNC(=N)N)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1844166060 AAEHMWKYLPLIKZ-GJZGRUSLSA-N 489.017 0.336 50 20 JCGD COc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)nc1Br 1844264658 VBVPCHMKJQACKO-UHFFFAOYSA-N 489.330 0.982 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccc(O)nc1)C2)NC(=O)NCc1ccccc1 1845039131 HYYKMSJKZOWDTC-UHFFFAOYSA-N 452.515 0.950 50 20 JCGD Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 10214128 ZMLURFQSSJOKPQ-MRXNPFEDSA-N 465.553 0.669 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 10601935 JNAYMFUCMJSLQG-SFHVURJKSA-N 477.495 0.518 50 20 JCGD COC(=O)c1sccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 28694182 PPCFCTBULAJCIU-UHFFFAOYSA-N 489.553 0.179 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CN2C(=O)CCOc3ccccc32)cc1 726068729 LXPZJNNYUVFWJB-UHFFFAOYSA-N 460.512 0.579 50 20 JCGD CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 727365916 ZXKLPXHPYBNJOW-INIZCTEOSA-N 454.574 0.934 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNC(=O)NCc2ccc(Cl)cc2)n1 728735986 ZZUBAWLDDXMNPX-UHFFFAOYSA-N 453.908 0.837 50 20 JCGD CCOC(=O)C1CCN(C(=O)CN(C)C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1 728942531 XPVPXTLERVEIGK-UHFFFAOYSA-N 458.313 0.865 50 20 JCGD CN1CCN(c2cc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccn2)CC1 728946049 WYGIGYIPGRUHEY-UHFFFAOYSA-N 453.551 0.370 50 20 JCGD CC(C)N1CCC[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 729619930 ZKJSLKQQAKYSPW-QGZVFWFLSA-N 467.592 0.772 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)COc2ccccc2[N+](=O)[O-])CC1 744896161 NFXXWHUWLHGXJV-UHFFFAOYSA-N 466.495 0.857 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCN2CCCS2(=O)=O)cc1 747200308 BKBBRGVJAIBZIF-GHRIWEEISA-N 486.554 0.493 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1 747864014 RFMUWRTYFOZJFV-UHFFFAOYSA-N 464.548 0.397 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2C[C@@H](O)CN2S(=O)(=O)c2ccc(Cl)cc2)cc1 771197335 OJAMVRCXSSSXOH-SJLPKXTDSA-N 495.941 0.777 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)N[C@H](C)c1cccc(S(N)(=O)=O)c1 807127401 XZAVCXJQERMTAT-LLVKDONJSA-N 468.561 0.641 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2CCC(C(=O)N3CC[C@H](B(O)O)C3)CC2)c([N+](=O)[O-])c1 864232907 DDVYGJXHDRQOSV-INIZCTEOSA-N 482.368 0.917 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)cc1 914602272 QJDIGTPMDPVUMR-LBPRGKRZSA-N 478.483 0.256 50 20 JCGD C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cn2)CCO1 916393229 VHPIORMGKRTEDB-CQSZACIVSA-N 451.487 0.698 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)c2ccc(Cl)nc2)c1OC 917253436 LFMVHHGQWBMJMY-UHFFFAOYSA-N 484.918 0.848 50 20 JCGD CN(C)C(=O)COc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 918224643 XKYPBQXUAJAMBH-UHFFFAOYSA-N 477.543 0.548 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)CC(F)(F)F 918364187 LNSALPXYIRELEM-UHFFFAOYSA-N 450.439 0.400 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H](C)OCC(C)C)c(=O)n2Cc1ccccc1 918755721 CXYUWVJJVHYMLQ-INIZCTEOSA-N 470.530 0.636 50 20 JCGD C[C@@H]1CCCN(C(=O)CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1 1351923139 BKPLOFNFAQJTTI-MRXNPFEDSA-N 467.596 0.292 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(N2CCCC2)ccn1 1778227698 DDJOEQLPQVDGPA-ZEQKJWHPSA-N 492.385 0.803 50 20 JCGD COC(=O)C12CCC(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)(CC1)CC2 1778303798 WHWWQYMWVKMPFM-STEQJIOHSA-N 484.358 0.324 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1 1778620634 PAYBNDSQZLLOIS-JOCHJYFZSA-N 452.251 0.139 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)/C=C/C(=O)c3cccs3)CCO2)C1 1779030031 DYKOGFJBWNCJPK-LFTXJPJQSA-N 469.523 0.629 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1OC 1779032564 NLRVZMAAUCXEOJ-HSZRJFAPSA-N 469.498 0.460 50 20 JCGD C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2)n1ccccc1=O 1779527383 PGEFYNCSQIFEPN-LSRZYVKLSA-N 482.541 0.236 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1780778534 LRGTVGLNPFQSRB-DXEZIKHYSA-N 477.986 0.376 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1780803846 MGSBITPAYAQBAO-QXATTWAWSA-N 460.535 0.614 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968071 AAHOJPGKBVAPCA-YADARESESA-N 471.558 0.201 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCC3)C2 1782215122 UBDOIHSYXOGSLQ-AUSIDOKSSA-N 460.579 0.720 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4nccc34)C2)C1 1782332176 LWHBYELGLMHUNP-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C[C@@H]21)[C@H](O)CCl 1784091318 NGRQVWLPJIMXHC-HZCDGDGTSA-N 459.934 0.763 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1CCc2ccccc2[C@H]1O 1784149083 OJUWISQPUXDFJV-PIAWWSJMSA-N 478.354 0.256 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)[C@H]2C1 1786846635 GCLFEPDPBPSKFH-CWVYHPPDSA-N 491.427 0.992 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(OC)c1 1786984983 GCDGKQZHNIOPEK-APTRMMRNSA-N 496.369 0.610 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3COc4ccccc4O3)C[C@@H]21 1787506825 PBQSROVEKGEJRG-LNTZLTSJSA-N 495.536 0.940 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)C#N)C[C@@H]21)NC(=O)NCc1ccccc1 1789724927 RPIMJACFNJDRIE-UFYCRDLUSA-N 470.574 0.862 50 20 JCGD CN1CCC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)CC1 1792552564 GDBLWBWZCUUDNX-IUTQVRIDSA-N 486.617 0.264 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc(Cl)ccc1F 1794233666 VMNZENQVODZESX-CULMDFNYSA-N 462.869 0.390 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1ccc(Br)nc1F 1794239957 WTDINWXHPDDGEI-PKCZLINISA-N 450.692 0.786 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C[C@H]1CCOC1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1796448592 AYRNOCFWYHTHMK-OOOWVJFSSA-N 489.997 0.496 50 20 JCGD Cc1ccc(SCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1797124463 GMEJUOVSUJGYCW-VPTLXERWSA-N 469.567 0.989 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1800320876 ABPQZUTZZFRFRK-IMTAKKMFSA-N 464.872 0.987 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800434832 DKWDOZIJAZXZGV-MUDKKEKZSA-N 498.374 0.647 50 20 JCGD COC(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800435575 BTDXNTUHGLDQFA-KYHPRHEASA-N 468.348 0.938 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(N)=O)cc1 1801654597 FDWHVFZHJLJBQH-ALVKSGCDSA-N 466.498 0.123 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361100 DZGBKGPHBOZVAM-RDPSFJRHSA-N 478.358 0.484 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364976 HTCLZHUMNPXCTC-UAGQMJEPSA-N 464.100 0.772 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n(C)n1 1807365092 WREOZZVOMJGJPG-UWJYYQICSA-N 463.303 0.137 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2[nH]nnc2C)[C@H]1c1cccnc1 1807802538 LKMZTLYSSRROQU-JMBUVSEHSA-N 463.502 0.962 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1 1808416537 BEPDDBIPHGQLCW-BREJEOOZSA-N 492.544 0.555 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810295336 SGQWAXKOXKGONR-NSISKUIASA-N 467.530 0.314 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810301997 FPYQPINDXRARJE-QFBILLFUSA-N 477.529 0.886 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810307536 DPZDZRUQPZTSAF-FDDCHVKYSA-N 490.568 0.993 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2nn[nH]c2C(F)(F)F)[C@@H]1c1cccnc1 1811561685 CSGFKXWNYPWSEB-GUYCJALGSA-N 482.467 0.911 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817471142 AZVPFHHOZWYAFV-AZUAARDMSA-N 462.319 0.360 50 20 JCGD Cn1ccc(CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n1 1819402945 OUESQDNDFUZJMD-KRWDZBQOSA-N 451.491 0.690 50 20 JCGD CCOC(=O)C1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CC1 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CC[C@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828922183 QRUHLGFZJNSAME-PMACEKPBSA-N 458.563 0.833 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C)COC1)CCO2 1830026842 SOAHAACARZLUHS-BTYIYWSLSA-N 475.970 0.611 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cncnc3)C2)C1 1830538287 AZAULAVRCCRTPS-BEFAXECRSA-N 455.353 0.897 50 20 JCGD O=C(c1cc(Br)c(O)cc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731175 HMOAMZATHWYTND-YJBOKZPZSA-N 495.729 0.964 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)C1 1831643782 GXLGWIMAFPYJGY-VBKZILBWSA-N 453.927 0.104 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cccc(N(C)C)c3)CCO2)C1 1832531541 TYTHDDPYIORYDL-DENIHFKCSA-N 469.966 0.842 50 20 JCGD CC(C)(C)n1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1Cl 1833602641 IKQFMJDMNPKIPK-LIRRHRJNSA-N 463.362 0.961 50 20 JCGD Cc1ccncc1CCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833828993 JFGFCECLBHOOOY-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1)CCO2 1834003833 MAUNKGATZPLBAQ-NJRDNMGOSA-N 454.487 0.286 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1834674645 PLOWEODHQVSWDD-HNAYVOBHSA-N 450.411 0.387 50 20 JCGD COc1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(F)c1 1834797335 DMRDLMVTPJNQNO-UHFFFAOYSA-N 484.337 0.408 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCc3ccc[nH]3)CC2)CC1)c1cccc(B(O)O)c1 1834801088 OBVONQORARMFAF-UHFFFAOYSA-N 452.364 0.513 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834823144 LEBZXHOQQBCBQT-KDOFPFPSSA-N 456.341 0.518 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ncnn3C)CC2)CC1 1835118179 DHWQQTWWLMLRTB-JFLMPSFJSA-N 469.550 0.134 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc[n+]([O-])c3)CC2)CC1 1835118196 GYWAHLTYVUMBRV-WPWMEQJKSA-N 481.557 0.639 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835448772 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C[C@@H](Cn1ccnc1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922134 PODAWDYFWOLJLB-SFHVURJKSA-N 468.363 0.511 50 20 JCGD CC[C@H](NC)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528348 SHPODOGOLLMVHP-PGRDOPGGSA-N 478.502 0.588 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)N3CCN(C)CC3)CC2)CC1 1838627105 JMTIWMUEPFMWMU-PXNSSMCTSA-N 459.031 0.875 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(Cl)c1)CCO2 1838920273 PQSUSDDGKVNSPD-NRFANRHFSA-N 452.939 0.783 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1839209844 SXKKNJKPUFPATC-AOMKIAJQSA-N 492.013 0.984 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccccc1F 1839233884 PNJSWYYDZQXWLP-VLCRHTCISA-N 485.940 0.233 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839246659 VXQVTYRLUYSYMK-QHCPKHFHSA-N 491.545 0.308 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1840032866 MJKIZFUBUWYYOK-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)c(C)n2n1 1840033071 SCUWCPVTVHYKJW-BFUOFWGJSA-N 481.351 0.595 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1840155879 FWNNIWADZHGPSS-FAGWGIEHSA-N 470.906 0.527 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4sccn4c3)C2)C1 1840184100 RPFJQFMWWJUTJD-OAQYLSRUSA-N 463.560 0.444 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1OC 1840185414 QKUIBCNVFBYZRW-DEOSSOPVSA-N 492.573 0.455 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)O2)C1 1841080010 OBOMMEYFJQIJKD-LJQANCHMSA-N 499.373 0.352 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C1)C2 1844265074 RZEYJGDXEBKOAB-HNNXBMFYSA-N 495.540 0.138 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1845520300 PWFIURXFRBWMPR-UHFFFAOYSA-N 467.486 0.790 50 20 JCGD CCCCCn1nc(C(=O)NNS(=O)(=O)c2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 18995867 TXDVZTPJKGWPFI-UHFFFAOYSA-N 493.567 0.857 50 20 JCGD O=C1Cc2cc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)ccc2N1 26318572 UWPQSCUKJXVPFP-UHFFFAOYSA-N 478.552 0.979 50 20 JCGD C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)NNC(=O)CNC(=O)c1cccs1 725871120 CPLIAIKMITVYBQ-ZDUSSCGKSA-N 472.527 0.914 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)C1 728203093 FHUWORXEBXCILH-AWEZNQCLSA-N 450.477 0.797 50 20 JCGD Cn1c(CC(=O)NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)nc2ccccc21 729614384 GQIJANSVZUPHKR-UHFFFAOYSA-N 465.562 0.839 50 20 JCGD CC(C)N1CCC[C@@H](CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1 729619053 JUMYHPWFVYWIAG-KRWDZBQOSA-N 453.613 0.764 50 20 JCGD O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)N1CCOCC1 745995783 BCFNBZPOPYSXQT-HXUWFJFHSA-N 451.483 0.573 50 20 JCGD Cc1ccc(CCC(=O)NCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 749160153 FBOUXYSYFLOQHC-UHFFFAOYSA-N 460.556 0.820 50 20 JCGD O=C(NC[C@@H](c1ccccc1)N1CCOCC1)NNC(=O)c1csc(N2CCOCC2)n1 913464973 HSTBXONMNSTJRM-SFHVURJKSA-N 460.560 0.997 50 20 JCGD O=C(NCc1ccc(-n2ccnc2)nc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916236699 SIKQHGKKWUXYFC-UHFFFAOYSA-N 485.526 0.432 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@H]1CCN2CCCC[C@@H]12 916638402 FXAIXBNEQFIYCR-ROUUACIJSA-N 451.549 0.278 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cn(C)c3ccccc23)cc1[C@@]1(C)NC(=O)NC1=O 917731371 UQEXMIUXFYBBRW-OAQYLSRUSA-N 471.495 0.865 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1csnn1)c(=O)n2Cc1ccccc1 918017272 SCBDULRQBQEBCP-UHFFFAOYSA-N 482.526 0.377 50 20 JCGD C[C@@H](OC[C@H]1CCCCO1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 921146162 LUTDDOCZDCQCMN-NVXWUHKLSA-N 455.533 0.443 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778057519 ZAPAVAQSTJCJDE-ZSEKCTLFSA-N 474.905 0.268 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccc(C)n1)C2 1778091687 NHKXKHHOBBGAEQ-RCBCJABQSA-N 469.546 0.839 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1 1778574078 UYMUQUKKMLTCFR-CYUILNSLSA-N 494.508 0.595 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3cccnc3n2)C1 1778989278 SFMSMQIAAKKRTM-VGOFRKELSA-N 457.535 0.230 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1snnc1C1CC1)CCO2 1779030052 FUCGVUINNFOZLL-HXUWFJFHSA-N 457.516 0.171 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097353 YNRWQKFAFNBBHS-HRAATJIYSA-N 477.474 0.411 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C)nc3O)C2)C1 1780271055 BWKBTZGRXDBXSC-IBUSPFOHSA-N 454.487 0.673 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)ccc1O 1780750089 OSEWDIVQXHWOBQ-JKJLQIMHSA-N 469.498 0.978 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2ccnn2c1 1781345186 MRWFAIUXRZCUGO-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Br)c(O)c3)C2)C1 1781697961 FNNSRDYQTNGAJP-HXUWFJFHSA-N 483.363 0.971 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1 1781717432 YYOVZIFELLCKLL-DEOSSOPVSA-N 460.299 0.309 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1COc3ccccc3O1)C2 1782208988 FRPDVPOUWMKKAG-YOSAUDMPSA-N 474.558 0.713 50 20 JCGD C[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1)n1ccnn1 1782764690 GLWMBWWHQVSZMO-FDDCHVKYSA-N 484.561 0.015 50 20 JCGD O=C(COCCOCCOCc1ccccc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1783684388 ZFBBZNDOLCIAQS-NFBKMPQASA-N 484.977 0.666 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc(Cl)n1 1783935894 YBLDFBJFGJRGOW-HXUWFJFHSA-N 453.927 0.560 50 20 JCGD Cc1cc2nc(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)[nH]c2cc1C 1783936255 SSNRSRGKRVYYPK-QHCPKHFHSA-N 456.547 0.996 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1784417213 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50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1796775418 WQPYCPXBISZSNX-YRPNKDGESA-N 487.362 0.254 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc3c(c1)CCCO3)C2 1797750995 YBVPEZAUCBKMHL-FEJSZKPUSA-N 479.537 0.456 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798439578 JUMOJTRMTUNDEI-OACYRQNASA-N 494.552 0.116 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(-c2ccccc2)[nH]n1 1798666087 QSDQSVCEMBHDNF-VPTLXERWSA-N 475.509 0.592 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@@H](O)c1cccc(Br)c1 1799098819 HYIYMYWIGQRCFV-URLPEUOOSA-N 461.740 0.672 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 1799196206 HZZZIGHNBYVUNJ-FQMQPWHVSA-N 475.970 0.058 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)Br)n1 1800757843 RLWNMXOAYKRHLB-DYNIEEOBSA-N 457.281 0.985 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H](O)c1ccccc1 1806801049 OPFPPHWXJSILHS-WWNPGLIZSA-N 459.311 0.815 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C2CC(O)C2)[C@H]1c1cccnc1 1808410289 UKDIWRPHXAWRIL-NRKKJRMYSA-N 452.515 0.992 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)CCN3CCN(C)CC3)C2)CC1 1809551547 XGVNZSASRFALHH-NHFJDJAPSA-N 485.633 0.989 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812716327 MIEHPSSBQHHLJI-LNLFQRSKSA-N 471.396 0.548 50 20 JCGD CCCNC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815335640 IPOPAIXFZARTGH-OAHLLOKOSA-N 458.349 0.355 50 20 JCGD Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c(=O)[nH]c1C 1815336747 BPIKAMFCKMOFIL-AWEZNQCLSA-N 467.316 0.063 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1[nH]nc3ccncc13)CC2)c1ccc(B(O)O)cc1 1815341552 ZZNYHRAQIJRDAJ-CYBMUJFWSA-N 462.300 0.634 50 20 JCGD Cc1nnc(CCC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)s1 1815350201 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496.424 0.042 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1 1840033725 NZQMXZZDPCJZQR-OXQOHEQNSA-N 457.365 0.925 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(N)=O)cc3)C2)C1 1840036950 TZYMWARLPSKPCF-DJJJIMSYSA-N 454.321 0.639 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)OC(=O)NC(C)C)C2)C1 1840154317 SHSRGITYZFMNTC-FOIQADDNSA-N 463.959 0.610 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1 1840185199 NGEVXOSLNVIYGR-DEOSSOPVSA-N 487.557 0.014 50 20 JCGD COC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1840321435 BXDUZSPDXYLUIL-LAUBAEHRSA-N 498.374 0.805 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc(C(F)(F)F)n1 1843011786 SBBCGNPCGXWCPG-UHFFFAOYSA-N 463.221 0.920 50 20 JCGD C[C@H](S)C(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C1 1843428568 AZPMLSLRQFVURU-YJBOKZPZSA-N 491.419 0.324 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 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Cc1nnnn1/C(=C/c1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 873771791 AWSOIIXHOIXURC-LDADJPATSA-N 455.500 0.691 50 20 JCGD COCCc1ccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 914845785 PKJKRMJOYKBRKQ-UHFFFAOYSA-N 455.558 0.814 50 20 JCGD Cc1cccc(OCC(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c1 916516131 GGULVUYTOCNOSC-UHFFFAOYSA-N 476.559 0.251 50 20 JCGD Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(-c3ccco3)nc3ccccc23)cn1 917910409 JSSPQDJVCFWNNE-UHFFFAOYSA-N 454.468 0.968 50 20 JCGD O=C(NNC(=O)N1CCN(C(=O)C(=O)N2CCCC2)CC1)c1ccc(COc2ccccc2)o1 918779548 YYOYAHNSQBXBAE-UHFFFAOYSA-N 469.498 0.980 50 20 JCGD CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 919885672 QBQXHZCBHSRVRQ-OAHLLOKOSA-N 472.589 0.771 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4cccnc4n3)C2)C1 1778478214 YPPSJIMSTJVFIY-QVGKIPNLSA-N 464.486 0.307 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1 1779032874 ZNVXRFWHQBQTKO-HSZRJFAPSA-N 453.499 0.759 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c[nH]c3nccc-3c1)C2 1779373447 SFFKQQCYMXOXLO-NTKDMRAZSA-N 477.525 0.954 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cnc3ccccc31)C2 1779376149 YPJXJJZOTCIKIA-PXDATVDWSA-N 491.552 0.863 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc[n+]([O-])cc3)CCO2)C1 1780097759 IQSNYSGRLQZDCB-QFIPXVFZSA-N 470.438 0.911 50 20 JCGD N#Cc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1Cl 1780191432 AHLHTZYYENKGOQ-QFIPXVFZSA-N 453.691 0.649 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1O 1780752790 ZRWDSWKYGACASJ-JOCHJYFZSA-N 455.471 0.157 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCO[C@]3(CCN(C(=O)[C@@H](F)Br)C3)C2)C1=O 1781332253 XCANPWJXADQNGZ-KDOFPFPSSA-N 454.252 0.955 50 20 JCGD CN(C)C(=O)NCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1783674510 WZBBELFGLKTNDM-VGWMRTNUSA-N 490.001 0.369 50 20 JCGD Cc1c(Br)c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)nn1C 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JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)/C=C/c2cnc[nH]2)[C@@H]1c1cccnc1 1810305594 MDMKEDJNPZUZQU-PPCRGMIQSA-N 460.498 0.836 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2nccn2)[nH]n1 1818113444 LOLQXQKSKAVFBS-WJNWYLSZSA-N 452.479 0.828 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnn2cccnc12 1819019239 TZGLNMGAQLBMQB-SFHVURJKSA-N 459.275 0.752 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@H](O)CCl)CC3)C1 1822721645 NFKXULNDRILEFT-OXHZDVMGSA-N 488.994 0.883 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824522908 LLOZYZPVSRDYGJ-BEFAXECRSA-N 479.603 0.599 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1 1829771174 JRPOIFMZQHAIOI-VKRNSVOSSA-N 458.353 0.475 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCO[C@]3(COCCN(C(=O)CCBr)C3)C2)cc1 1830213447 IKVNXEFDFTWXGA-ICSRJNTNSA-N 471.348 0.970 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccnc3)C2)C1 1830534515 ASVUXLSGGDQGDC-KXBFYZLASA-N 456.337 0.948 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@](C)(O)CC(=O)O)C2)C1 1830543756 CBDKMYXARDKROX-BVGQSLNGSA-N 465.341 0.090 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CSCC(=O)O)C2)C1 1830544516 ZYRAJMMQWNZHAJ-WBMJQRKESA-N 453.355 0.292 50 20 JCGD O=C(c1cn2cc(Cl)ccc2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728100 OYEFEJUILDVKAS-KXBFYZLASA-N 457.314 0.657 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1)C(C)(C)C 1831090132 YWBMEAKBSAIWKD-RXVVDRJESA-N 457.644 0.845 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1 1831190668 RPGOBAWXFAJMDT-GOSISDBHSA-N 490.561 0.749 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1831693974 DNDSXWDPARGKKO-CXAGYDPISA-N 452.321 0.296 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1)n1cncn1 1832203776 MIHIGMJVHUHNJY-BEFAXECRSA-N 454.535 0.771 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1832396398 BFGYTGWLEDCRKM-GOSISDBHSA-N 465.576 0.353 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)n(C)n1 1833439168 NEABSEPWJLNFNI-ACJLOTCBSA-N 459.341 0.530 50 20 JCGD COc1nc(C)ccc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798293 DAYWEWQCBGVKKX-UHFFFAOYSA-N 480.374 0.577 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)C1(O)CCC1 1834800663 WRVSHONRRSVEAO-KRWDZBQOSA-N 457.380 0.103 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc(Cl)s3)CC2)CC1)c1cccc(B(O)O)c1 1834800986 DTSVKTLILZAVSC-UHFFFAOYSA-N 476.795 0.975 50 20 JCGD CCOC(CC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)OCC 1834801509 QSSIUZXUQHDMJR-UHFFFAOYSA-N 475.395 0.341 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1 1835185029 GMGOWYDJFNDDHK-HKUYNNGSSA-N 462.927 0.760 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1 1835797671 FQACJLYKWYPKJC-ZDUSSCGKSA-N 471.389 0.970 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc4cc[nH]c34)C2)C1 1835930671 TWLXLBPGFQCNTM-XMMPIXPASA-N 463.299 0.232 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccc4)on3)C2)C1 1835934554 YMVNUPJGACRIQI-RUZDIDTESA-N 491.309 0.405 50 20 JCGD O=C(c1ncn2nc(N3CCOCC3)ccc12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1836289750 GSQDQPLKSGPCBW-GHTZIAJQSA-N 496.927 0.170 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1)CCO2 1836641411 FUNFVERMHGZZIB-PNLZDCPESA-N 489.997 0.954 50 20 JCGD Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)nn1C 1836772412 QCZIZMMILXINFL-UHFFFAOYSA-N 462.595 0.643 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)CCO2 1836797316 UHZBCKCTERTOMU-XMMPIXPASA-N 499.279 0.510 50 20 JCGD Cc1csc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837456607 OUBKPPHVZSOWHO-NRFANRHFSA-N 459.528 0.439 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1 1837458795 CTNNVEVEWBUMAU-RUZDIDTESA-N 490.520 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cccc(O)c3)C2)C1 1837460798 KPQPKPLHNSMOQR-JVPDDCAZSA-N 481.509 0.174 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc(=O)cco3)CC2)CC1 1837589748 TVBKFTLMYLHUCF-UHFFFAOYSA-N 454.288 0.246 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncsc4[nH]3)CCO2)C1 1837750741 DVJLRWDOPKGBOW-OAQYLSRUSA-N 485.526 0.007 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1 1838421564 CCUQOEVWCSZQDN-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD O=C(c1cc(Br)c(O)cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838608546 VRVRWDGQZONZFE-QAPCUYQASA-N 495.729 0.964 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)nn1 1838831085 ZRARYFCWKATKGL-HXUWFJFHSA-N 452.584 0.797 50 20 JCGD CC(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1838979475 UWSBIIRZEFJCIR-VWLOTQADSA-N 466.343 0.874 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839047309 JFGAUYMHCBWYOA-QRWLVFNGSA-N 480.363 0.759 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054268 QGUQKSUALPJVJB-WMZHIEFXSA-N 496.008 0.806 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1839694582 QLAGOJBIECMTJC-PGRDOPGGSA-N 466.966 0.094 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802030 KIJNNMHNENYEBD-LMVRJCEZSA-N 496.402 0.172 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCS(C)(=O)=O)C2)C1 1839967733 WQRTXFNVNRTSDO-XJKSGUPXSA-N 455.371 0.051 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)cn1 1840182390 IARQCAAKWMUGLO-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nc2ccccc12 1840184621 XYMLTQIXEHMNIJ-RUZDIDTESA-N 483.569 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3Cl)C2)C1 1840185869 UNCVONFXPFTEKQ-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840189331 LLPDZQXIOPIYNO-BFUOFWGJSA-N 484.377 0.522 50 20 JCGD O=C(NCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccccc1 1840800093 GZGBGHZHHOWXQV-FXAWDEMLSA-N 486.338 0.953 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)n(C)c(=O)n3C)c2ccccc2c1=O 60266163 KIEBPMOSYJFDKV-UHFFFAOYSA-N 470.511 0.620 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727099306 QIGAOJOLABBSGQ-UHFFFAOYSA-N 487.318 0.652 50 20 JCGD COc1cccc(C[C@H](C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n2nnnc2C)c1 728845478 IYDBSDISSAJHBS-LJQANCHMSA-N 465.518 0.628 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)c2ccccc2)c1 729275684 QHIFUMWDGJBTBY-ZDUSSCGKSA-N 454.530 0.210 50 20 JCGD O=C(CN1CCN(Cc2ccc(Br)cc2F)CC1)NNC(=O)C(=O)N1CCCC1 729529780 IDXIOVRMQNTEEQ-UHFFFAOYSA-N 470.343 0.476 50 20 JCGD CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(S(N)(=O)=O)c1 729612633 GQOKSIXVWYUPNI-KRWDZBQOSA-N 483.572 0.680 50 20 JCGD COc1ccc(N2CCN(CCNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)cc1 742948290 QELWOWDGQVVSAF-UHFFFAOYSA-N 489.602 0.755 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)n(C)c1 760847323 XSIXFRZKJGWWJP-UHFFFAOYSA-N 471.561 0.367 50 20 JCGD COc1cc2ncn(CCCC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c(=O)c2cc1OC 789863784 RFCNWFZCOBZBDH-UHFFFAOYSA-N 492.492 0.902 50 20 JCGD CCOC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N3CCOCC3)ccc2n1CC 792612232 GBOCVQLTAMVIPG-UHFFFAOYSA-N 453.521 0.787 50 20 JCGD COC(=O)NNC(=O)Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O 913176956 RWRHVLWNFJSTIQ-UHFFFAOYSA-N 462.466 0.844 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O 913635972 LSBUERIKPJNWKP-UHFFFAOYSA-N 479.563 0.487 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2C[C@H](O)CN2C(=O)Cc2ccccc2F)cc1 919185727 YFFHWYXVDHPEOD-PKOBYXMFSA-N 457.458 0.643 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1c[nH]c2ncccc12 919694083 SVFLYVUOVDORSP-UHFFFAOYSA-N 457.512 0.978 50 20 JCGD O=C(NNC(=O)c1cccc(NC(=O)[C@H]2Cc3ccccc3O2)c1)N[C@H]1CCS(=O)(=O)C1 919884044 DLRCXMDQQLRRTG-FUHWJXTLSA-N 458.496 0.760 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCCN2C(=O)CNC2=O)c1 920194759 XYFKHIIAOGDQAT-UHFFFAOYSA-N 489.510 0.589 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCc1ccc(CS(C)(=O)=O)cc1 1115866688 OMUSDQNDJWKUGK-UHFFFAOYSA-N 467.573 0.977 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779277972 KRPYXDJDYWIGJD-VFCRVFHLSA-N 472.970 0.639 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccnc1C(N)=O)CCO2 1780095053 DDYRDTJMJMYCOY-HSZRJFAPSA-N 497.464 0.771 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780774862 OLZAINBVFJFEON-HBUWYVDXSA-N 472.315 0.503 50 20 JCGD CCc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)nn1C 1780969007 RTRQVCCLIWFLDZ-VWLOTQADSA-N 497.600 0.772 50 20 JCGD CCOC(=O)C1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)CC1 1781622821 VMDINFHAIBDIGK-SJUPTTPXSA-N 487.557 0.978 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c12 1782376201 QGUSIXQODFVPHA-QHCPKHFHSA-N 457.531 0.993 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnc(Br)c1)CCO2 1783936482 WRBVWVOUZVDVLF-IBGZPJMESA-N 468.352 0.661 50 20 JCGD CN1Cc2ccccc2C[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785022605 GYIGEZXDMBQEGT-XGAJZPNHSA-N 477.370 0.016 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cc3cccc(F)c3)NC(C)=O)C2)C1 1785457852 FEAINMWDGPPXDX-JQVVWYNYSA-N 469.941 0.957 50 20 JCGD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1)[C@H]1SC(=N)NC1=O 1788141383 WHOCEIMBAXIJKF-FZKQIMNGSA-N 480.355 0.917 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21)C(C)C 1788477517 JBZGZPRRPTXBQR-GTXJVYCPSA-N 475.546 0.688 50 20 JCGD COc1cc(C)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1789998716 XKAUONVEGLBNAZ-JHVJFLLYSA-N 467.526 0.909 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCN3C(=O)OC(C)(C)C)C[C@@H]21 1791288016 OAZGBYGGLLPYLT-XSLAGTTESA-N 481.594 0.349 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)ccc(F)c3F)C[C@@H]21 1791288037 PBHQEWOIEZJDJZ-YEWWUXTCSA-N 470.492 0.999 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792980846 AEMHQJBHUPOCKW-XJTKPRQNSA-N 477.961 0.771 50 20 JCGD COCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795116507 OGYYGODPHBYDHT-JLVBRIDZSA-N 451.358 0.431 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c[nH]nc3c1)C2 1796440526 ONRGPIJNQPAYCJ-UCNOBMHRSA-N 463.498 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3ccc(C)cc13)C2 1796440543 PHLQIHYWEDJHCA-BMDFQBGOSA-N 477.525 0.980 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)N1CCOCC1 1797809184 ZAENHPGGAILOML-AOAJYTEHSA-N 476.480 0.112 50 20 JCGD COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)cn1 1798522751 UPZVTFZLPCSQQX-VTEUUUEMSA-N 485.453 0.836 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1C1CC1)C2)NC(=O)NCc1ccccc1 1799094853 DEBIHDMEVCZQFD-FLQYYVGBSA-N 469.586 0.968 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(C)CCCN1 1799215362 CXHYGTRXALEDCO-QKQGURCUSA-N 458.987 0.850 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)cc([N+](=O)[O-])c1 1799629816 RVMFBKQCBZCEFA-IVWMJMPLSA-N 472.433 0.249 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1F 1800238644 AFMMDURFMZACHW-XZWCOCNFSA-N 481.333 0.809 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(OCC2CC2)c(F)c1 1801894260 XULHAEPXDWKPFM-BBIADKPPSA-N 482.317 0.811 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc([N+](=O)[O-])o1 1802259017 IVXBJLFWHPPZJQ-OXQOHEQNSA-N 464.243 0.896 50 20 JCGD COCC1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1803537811 SYPFAEWLVBYPHT-QFBILLFUSA-N 452.515 0.826 50 20 JCGD Cc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(O)n1 1807359643 BSDHWFDSUGHIAS-RXVVDRJESA-N 460.299 0.804 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375193 PUTDHKUIZHMENF-GBXCKJPGSA-N 475.358 0.674 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccn(C(F)F)c2=O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375844 QLKIYPISLQAVSJ-PXNSSMCTSA-N 496.279 0.952 50 20 JCGD O=C(Cc1cscn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807487926 FNVTUCGFPIGLMZ-UWJYYQICSA-N 450.329 0.780 50 20 JCGD CN(CC(=O)N1CCC2(CCCN(C(=O)[C@H]3CCC(=O)N3)C2)CC1)NC(=O)NCc1ccccc1 1809466939 ZNUOMXAWGPFNOS-HXUWFJFHSA-N 484.601 0.842 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810305910 PXVZZQKORXXILF-IDHHARJASA-N 484.513 0.961 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347645 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C[C@H](NC(=O)c1cnccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819513635 BMLRVGXVNSXNGT-LIRRHRJNSA-N 491.317 0.004 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822410497 LHBJVSIKHWQAHJ-DZGCQCFKSA-N 471.584 0.103 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(CCO)CCO)sc2C1 1825327586 MEPIVPGBHDNDQH-PIGZYNQJSA-N 453.392 0.578 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1826719214 GGWHWIGQZCDPFE-QHCPKHFHSA-N 470.423 0.237 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1830574647 KGDYJIQJPXVCRJ-HRAATJIYSA-N 489.642 0.180 50 20 JCGD O=C(c1ccc(N2CCOCC2)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830727989 MLOHDCXZWVNSLV-UGKGYDQZSA-N 467.950 0.193 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1831644181 QKTQJPKKDMCZFH-JXFKEZNVSA-N 473.979 0.963 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H]2CCNC(=O)C2)CC1 1831941913 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Cn1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n1 1836058660 PSZPGELGPPVILM-HTAPYJJXSA-N 499.996 0.551 50 20 JCGD C[C@H](Sc1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837230710 BBFWIGCAFJNQNH-AOMKIAJQSA-N 490.412 0.679 50 20 JCGD C[C@H](Sc1cccs1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837231156 DRXRGJCGXLIXGB-KSFYIVLOSA-N 490.412 0.679 50 20 JCGD C=CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054048 DAOLSIRTDWILHY-HSZRJFAPSA-N 459.547 0.365 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839150846 ZBPTVNAQDAZWJI-RBUKOAKNSA-N 452.379 0.986 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839156200 GQOBCXAUGIJDCF-KFKAGJAMSA-N 452.379 0.984 50 20 JCGD O=C(c1cc2cccnn2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201181 YTYUJHIRKUFDRI-YOEHRIQHSA-N 456.272 0.490 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C#N)ccc1F)CCO2 1839420354 DIUDTJKTALRPPU-SWOYFSSUSA-N 496.499 0.901 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1840033467 GIPDLCDNDDNVPC-HZMBPMFUSA-N 461.231 0.332 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(F)c1F 1840701360 NKXLRAKWZPROPB-QHCPKHFHSA-N 489.479 0.656 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2ccc(=O)oc2)C1)NC(=O)NCc1ccccc1 1842576347 ACSOECDHHTXUMG-UHFFFAOYSA-N 453.499 0.803 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)C2 1844264339 ILCJVXHLXOJHQB-OAQYLSRUSA-N 450.455 0.237 50 20 JCGD COCCOCCOCCOCC(=O)N1CC2(CCCN2C(=O)[C@@H](C)Br)C1 1846179605 NSJRJTUKWWSFMX-OAHLLOKOSA-N 451.358 0.669 50 20 JCGD Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)CC2)c1C 15639545 OXNUGJKXMBKKQI-SFHVURJKSA-N 485.628 0.903 50 20 JCGD C[C@H]1Cc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc2N1S(C)(=O)=O 16594093 DNKBVEUZQOOZGE-ZDUSSCGKSA-N 480.568 0.722 50 20 JCGD O=C(O)c1cc(Br)cc(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1F 728503543 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CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2F)c1 915164381 LDZKDFUNFUHQBK-UHFFFAOYSA-N 485.515 0.325 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)cc1 916197548 XAMBHNBZZFZWFE-AWEZNQCLSA-N 483.572 0.355 50 20 JCGD CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 919779030 MURKNMSVVNKLKF-GFCCVEGCSA-N 458.500 0.547 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C 920290683 NITNQHZYCJXGME-OIHTYZOASA-N 450.561 0.981 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 920433939 LWIIVMLZLSJQEN-UHFFFAOYSA-N 452.445 0.498 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)cc(O)n1 1778038235 ZYTPDQYSBIDONE-WZONZLPQSA-N 468.514 0.535 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2ccccn2n1 1778480968 GCLMBDDACRFIBK-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1 1778664537 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Oc3ccccn3)C2)C1 1784488840 KXPWGOHWARYTAV-ATHJKFOESA-N 468.514 0.813 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncn(-c4cccc(F)c4)n3)[C@H]2C1 1785546050 DMYBUNQYOIKBJU-SNRMKQJTSA-N 487.536 0.373 50 20 JCGD Cc1ccc(OCCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786982095 LVRIYPMGEYQWFH-VJBMBRPKSA-N 466.343 0.737 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3F)C[C@@H]21 1787509103 SDHRCARWXNBGEQ-VOSSUDFCSA-N 456.478 0.948 50 20 JCGD COc1cc(OC)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610219 QRMRHJNTEOUZNS-WVFSVQOHSA-N 483.525 0.609 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc(Cl)n1 1788610246 SJNKLZNFTLDEMD-ZLIFDBKOSA-N 488.932 0.649 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccccc3C(=O)OCCO)C[C@@H]21 1791254143 OHRQLIRQSWVXIK-QZHFEQFPSA-N 468.934 0.683 50 20 JCGD CC(C)(C)OC(=O)N1CCc2onc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)c2C1 1792981804 WIDCPGRRIQSJIW-YXPYIKCWSA-N 498.964 0.771 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)[C@H](F)C1 1793222876 QWNAPYFUUZIVEF-RNGXCGTMSA-N 477.961 0.771 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(F)(F)F)nc1 1794809975 WMRARWVYGQIGBX-ZSBFGKGUSA-N 457.453 0.677 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)cnc2c1 1796191427 KIFXYNJGZCXVMP-REPLKXPHSA-N 460.299 0.248 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2 1796394491 OKVCLPJMWVCOAY-DFGXFYAUSA-N 473.643 0.967 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(cnn2C)c1 1797083753 HHJIZDBAOMKMEZ-SWLURDMPSA-N 477.525 0.911 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc(C)c1C(=O)O 1797753993 OALIGDPUQSOFET-CWPLJXCYSA-N 481.509 0.517 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797754275 PLIMOOAVDLAWMM-CWPLJXCYSA-N 466.498 0.161 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CN(Cc2ccccc2)CCO1)c1cccc(B(O)O)c1 1797855422 HVHOFKJRJLJLRO-KIHHCIJBSA-N 477.370 0.519 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798443618 NZDGFFIADHMFJV-QDMKHBRRSA-N 460.535 0.852 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1[C@H]2SC=C[C@H]21)NC(=O)NCc1ccccc1 1800253348 UQYWNTZZWIKFJY-ISYHVGNFSA-N 485.610 0.797 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc2c(c1)NC(=O)CS2 1801078645 IJULKYAFJMFDKX-QDMKHBRRSA-N 460.560 0.751 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@]1(C)CC1(F)F)NC(=O)NCc1ccccc1 1802002559 OMRLLAPYJKHNNG-ZRAXVTTISA-N 479.528 0.968 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc(-n2cnnc2)cc1 1806994096 ZTPDVANMLAJNJP-ZJSXRUAMSA-N 496.336 0.976 50 20 JCGD Cc1nc(N)sc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807244469 TUJNZIXRLXJMOP-AEFFLSMTSA-N 465.344 0.742 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C#CC2(O)CCCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361129 PALCMYNIBUYETK-QPPBQGQZSA-N 475.354 0.780 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366293 YEJCHOHLUFVVKP-TZIWHRDSSA-N 463.347 0.363 50 20 JCGD N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807366425 ZEESQVGKBULGQB-APWZRJJASA-N 455.349 0.098 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375384 OOZRSOCFGUQYFF-GCJKJVERSA-N 470.298 0.438 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)N1CCN(C)CC1 1807903354 OSPXCKWAHOYRCY-GREBRCKQSA-N 473.622 0.096 50 20 JCGD CC(C)CNC(=O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808446708 BHPHUHPOHQUJSO-VQIMIIECSA-N 467.530 0.172 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)CC2)C1 1809980156 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NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnncc2C(=O)O)n[nH]1 1819760004 GAAZFCWBMMFWGU-INIZCTEOSA-N 479.457 0.516 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(O)ncn1)CC2 1819793402 MORVOTBDCAOJEY-SECBINFHSA-N 454.472 0.177 50 20 JCGD COC[C@H](Cl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)[nH]n1 1822371831 ZZDXPUFSFYGHFU-RDJZCZTQSA-N 454.959 0.820 50 20 JCGD O=C([C@H](O)CCl)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828548267 HIESADYMRHBRJH-FVJLSDCUSA-N 488.368 0.638 50 20 JCGD O=C1CC(C(=O)N2CCN(C(=O)OCc3ccccc3)[C@@]3(CCN(C(=O)[C@H](F)Cl)C3)C2)=NN1 1829124289 NVRPLXIXGJTIJE-LAUBAEHRSA-N 479.896 0.849 50 20 JCGD O=C(c1c[nH]c2nccc-2c1Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830727909 KMBNDYQOAPRGIC-LIRRHRJNSA-N 457.314 0.838 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)C3=CCCS3)CCO2)C1 1831550088 HTFLTUJLGZSQFV-VQYZLWMVSA-N 461.544 0.598 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn[nH]c3)C2)C1 1832549014 AUJGHZSGNVJMJX-MGPUTAFESA-N 471.942 0.612 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccnc(F)c1 1833587876 SJJITBQXFYPNLE-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4c(c3)COC4)CC2)CC1)c1ccc(B(O)O)cc1 1834798601 OZCNMKGWWRINSS-UHFFFAOYSA-N 477.370 0.896 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1835642700 VFVCURQRXLFEHJ-BIENJYKASA-N 466.938 0.219 50 20 JCGD CC[C@H](NC)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835907789 TZKBYNUHRSRMLO-CKJXQJPGSA-N 477.002 0.573 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835939981 RMNVWFCFFOLANC-VWLOTQADSA-N 466.343 0.296 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccn3cncc13)CCO2 1837110652 FWHUUBQMUCOAGD-VNSNFZHPSA-N 493.524 0.538 50 20 JCGD C/C(=C\c1cccs1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837456902 RWNZEPTXUIXQHA-LJJIPZOBSA-N 485.566 0.920 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1837669425 URQPYCKNQSCNHO-SPYBWZPUSA-N 462.385 0.779 50 20 JCGD O=C(c1ccc(Cl)nn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837838307 ZHGMZIIOECFKMC-DOMZBBRYSA-N 451.680 0.891 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1837918180 GRUUVDSINVLYGF-GFCCVEGCSA-N 481.351 0.813 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cnn4cccnc34)CC2)CC1 1837919341 ZNUVGMFSFQZOSN-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838503551 ZWIPYFVPTCYUJW-XOBRGWDASA-N 494.346 0.333 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1838549151 CJKYGPHFECXOHU-QRWLVFNGSA-N 460.886 0.513 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccc(O)cc1 1839169798 JYILTUFQIPQEJT-GYCJOSAFSA-N 483.525 0.264 50 20 JCGD O=C([C@H]1CCc2nc[nH]c2C1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203281 HJDGFMYRJIKELY-QITLCBANSA-N 459.316 0.662 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)ccc3Cl)CCO2)C1 1839327175 UAFFHTHJEWYFGM-QFIPXVFZSA-N 491.907 0.861 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839765616 YMNKJSVHBXRUAS-IQGLISFBSA-N 484.333 0.454 50 20 JCGD CC(C)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1840001031 PMELYRNWYBPTFY-AREMUKBSSA-N 480.370 0.803 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)C2)C1 1840149889 ALGMNRRPDGRFSE-OXQOHEQNSA-N 473.885 0.987 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(Cl)cncc3Cl)C2)C1 1840183122 RXQYKNGTSGRZAO-FQEVSTJZSA-N 488.372 0.831 50 20 JCGD Cc1cccc2cc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)[nH]c12 1840184509 RIRDGTVVDTYPNX-DEOSSOPVSA-N 471.558 0.919 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)C1=O 1840188455 KODAKIZSDNRWCW-IBGZPJMESA-N 456.282 0.695 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840189130 YUSJZEOEXNIKHF-LJQANCHMSA-N 486.312 0.552 50 20 JCGD COc1ccc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)nn1 1844604200 VDDOLMOFHFQGGM-UHFFFAOYSA-N 467.530 0.648 50 20 JCGD Cc1cc(C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c(C)o1 14803051 SDABTKIBWIVCHO-INIZCTEOSA-N 457.530 0.439 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1 725740797 IAKRXAJVKDZJEY-UHFFFAOYSA-N 459.509 0.557 50 20 JCGD Cc1cccn2cc(CC(=O)NNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)nc12 725877789 KZMMWZCZYAJTAB-UHFFFAOYSA-N 485.566 0.986 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)c2ccccc2c1=O 726283173 XQWQBLWPRPEIAP-QFIPXVFZSA-N 463.454 0.132 50 20 JCGD NS(=O)(=O)c1ccc(CNC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 726433925 BMXCRWYQETXPNZ-UHFFFAOYSA-N 497.624 0.428 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCC[C@H](C)OC)N(S(C)(=O)=O)CC2 726713600 JNHJWFFRRVUZHJ-BBRMVZONSA-N 472.564 0.708 50 20 JCGD CN(C)CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 727365786 BXWBAVSKLRASFP-UHFFFAOYSA-N 459.572 0.516 50 20 JCGD CN(CCc1ccccn1)C(=O)CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 727608376 PKQQLFUKNISISH-UHFFFAOYSA-N 488.570 0.511 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1cccc(S(=O)(=O)N(C)C)c1 727608958 FMCYVXWPOMFKFA-AWEZNQCLSA-N 497.599 0.892 50 20 JCGD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)C1 731214411 NBRTVZSAURJMOV-FUHWJXTLSA-N 460.535 0.668 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)N[C@H](C)CCN(C)C)N(S(C)(=O)=O)CC2 744865059 AZGBRXCGUHIPHQ-RHSMWYFYSA-N 485.607 0.623 50 20 JCGD COc1c(C)cnc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1C 747985604 KSAGMNSOPXLVPM-UHFFFAOYSA-N 463.564 0.864 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)[C@@H](C)Oc2cccc(Br)c2)cn1C 750664314 ZQWIIYZDQDSHJH-LLVKDONJSA-N 488.364 0.774 50 20 JCGD CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 916228551 GAKVOVFLOCJHCO-UHFFFAOYSA-N 488.614 0.779 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl)N[C@H]1CCS(=O)(=O)C1 919886138 QBHCAKRCJAPFRE-LBPRGKRZSA-N 478.980 0.646 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(Br)cc1Br)N[C@@H]1CCS(=O)(=O)C1 919960740 FWJFASMEEXGTHV-MRVPVSSYSA-N 491.183 0.891 50 20 JCGD C[C@H](Oc1ccccc1F)C(=O)NNC(=O)NCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1 921247836 LPYRUXDCYUHBPY-LBPRGKRZSA-N 469.451 0.810 50 20 JCGD Cc1nn(C)c(C)c1C(=O)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1317738218 DPZXGLDVYTWBLV-UHFFFAOYSA-N 477.543 0.021 50 20 JCGD NC(=O)[C@@H]1CCCN(c2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)C1 1318321370 YUBZHVKZOHQSLX-GOSISDBHSA-N 451.531 0.856 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@@H](F)Cl)CCO3)C2)C1 1778087947 SRHXMQNUKKKSRM-ODCFSMADSA-N 463.934 0.969 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CS(=O)(=O)N2CCCC2)C1 1778088332 MBANJBFRHUUQIZ-GPMSIDNRSA-N 494.452 0.957 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1778788688 JCZFFCAKAHUWPH-FVJLSDCUSA-N 498.374 0.887 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ccccc13)C2 1779373113 BOFWOJDXHATPPN-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD NC[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)c1ccccc1 1779373551 YMNWPSUKZKEBCK-PIBDYAPNSA-N 480.569 0.555 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1 1783843455 NAVJYOGLAHSIAF-RDPSFJRHSA-N 465.510 0.522 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cn(C)nc1C(F)(F)F)CCO2 1783934726 LQAKTVSDZNWRLV-SFHVURJKSA-N 460.457 0.255 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCCN3C)[C@H]2C1 1784111458 RHLWHHBDBBWZFU-FMZJDWDBSA-N 458.563 0.584 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCC(=O)N3C(=O)OC(C)(C)C)C2)C1 1784191242 XAZAGRHRBLLXRM-QMHKHESXSA-N 495.577 0.115 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1 1784252575 IQOSYMUIGHRDRD-KNQAVFIVSA-N 458.707 0.197 50 20 JCGD C/C(=C\c1cccnc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1784465498 FOOZJQNLLMELQF-UUFSLDAJSA-N 450.499 0.627 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)CC(N)=O)[C@H]2C1 1784601354 SQLRMLNBEQQZTA-YWKPPDPDSA-N 476.486 0.625 50 20 JCGD O=C(Cc1cc([N+](=O)[O-])ccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785002615 HEKJMDABAVTLJB-ZRCAFCQKSA-N 485.277 0.250 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@@H]3C[C@H](O)CN3C(=O)OCc3ccccc3)C2)C1 1785430207 QWADIAABCUZLNK-PABYOWBDSA-N 495.960 0.188 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1nc(Cl)ccc1F 1785473475 GBNTVABBAKHZMU-QRTARXTBSA-N 461.686 0.461 50 20 JCGD CCOc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cnc2c1cnn2C 1787245637 JULXYGGFTNWNBE-SJWGOKEGSA-N 465.938 0.560 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc(C)c1C(=O)O 1790317449 XOPLAFFWDPEUMK-YYWHXJBOSA-N 480.326 0.589 50 20 JCGD Cc1ncc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)s1 1791734647 RTWCXOXNVGLONU-WMBCKCKVSA-N 455.345 0.438 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1 1795737449 HCPPULPSTSPLME-NHKMSHSESA-N 482.342 0.220 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1cccs1)C2 1796439450 FMCRKRZSVDTKKV-DHMDNZFNSA-N 486.554 0.202 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ncsc1Br 1796492933 DRIYQSSMYKARJK-DABQJJPHSA-N 480.149 0.102 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(c1)CCNCC3)C2)[C@H](F)Br 1799347903 ZNSWYYSPLFRKPV-FSDCSDTHSA-N 455.328 0.664 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Cl)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800872455 XLEJOXMPEJIPAT-VLWCASSMSA-N 494.397 0.198 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(C(F)(F)F)cccc3n1)C2 1801012910 MYHLPZDSAIKIDV-VTEUUUEMSA-N 496.490 0.929 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1801764868 KKTBFHHITUCZND-HEFCWWFNSA-N 462.510 0.829 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccn(C(F)F)c2=O)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359784 DTHKBSCZJKHWGR-FXAWDEMLSA-N 496.279 0.952 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362579 MDHJBBLIWZRNLI-WIYYLYMNSA-N 470.298 0.438 50 20 JCGD C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCCN1 1808083060 OQDRBQRKNATKEW-BTCOZLQPSA-N 451.531 0.542 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCC(=O)NC2)[C@@H]1c1cccnc1 1808410281 UGCMQRWBISQSMU-ICKKQCLQSA-N 479.541 0.748 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ncn(C)n2)[C@H]1c1cccnc1 1808414866 NDDQEFQIXBISST-QRTPEGJISA-N 463.502 0.664 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1 1809767902 IGDILRUFMICHCC-VGOFRKELSA-N 464.530 0.817 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810249668 NQLHYSUOXOIUHF-VDGAXYAQSA-N 466.542 0.973 50 20 JCGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CCCC2(CCN(C(=O)[C@@H](F)Br)CC2)C1 1810488174 PGSKFNMIBFBRMM-GFCCVEGCSA-N 456.276 0.348 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)ccn1 1810839640 YEBXWRFACZEKIF-SIKLNZKXSA-N 460.299 0.798 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1 1811270052 LXAGSPONLIGMNP-HTAPYJJXSA-N 464.530 0.817 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)C(=O)C(=O)O 1812392366 PESBXHIENCCWAB-YUTCNCBUSA-N 459.272 0.321 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813072815 FYMBHSDFIYXSLA-SFGWALBWSA-N 455.563 0.993 50 20 JCGD O=C(CCN1CCCCC1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1814068925 PGHCJRVQEWDUKZ-KRWDZBQOSA-N 456.377 0.925 50 20 JCGD Cn1ccc(=O)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343585 BKARYHZHVFYZGS-CQSZACIVSA-N 452.301 0.061 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nc3ccccn3n2)[nH]n1)c1ccc(B(O)O)cc1 1817471241 HYSHPNYWQJWBOH-KRWDZBQOSA-N 459.275 0.752 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1)c1ccc(B(O)O)cc1 1817472173 MOKILEOHZNWECE-CQSZACIVSA-N 468.197 0.501 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3nccnc3C(N)=O)sc2C1 1821037952 UHZCHLHYMLHPHM-LHXNHHJWSA-N 495.525 0.392 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)CCl)CC1 1824186184 PFAZFQDLURNJPH-CEXWTWQISA-N 453.971 0.676 50 20 JCGD C[C@@](O)(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)C(F)(F)F 1824832178 WXCQHKIZMIPSMJ-FXAWDEMLSA-N 456.270 0.913 50 20 JCGD O=C(CN1CCCCC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825862679 NXEYLLNRVJZUDN-HNNXBMFYSA-N 456.333 0.061 50 20 JCGD Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)nn1C 1827055649 GUWRLHYPOYCPBR-QFIPXVFZSA-N 452.364 0.884 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2nc3ccccn3n2)CC1 1827393386 TXEJTPWRNIQTQO-HXUWFJFHSA-N 461.331 0.956 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)CC1 1827548226 SHXHAKCEWNPTAG-PMACEKPBSA-N 485.614 0.945 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548442 KPDYRPVWTZDLEK-WLENULPWSA-N 494.976 0.550 50 20 JCGD CC[C@H](O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548819 PTOLQIVITZKYCD-NPPFBWRTSA-N 467.950 0.809 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccnc2C(N)=O)CC1 1828923364 GIQRQNZHAGCRCX-LJQANCHMSA-N 479.541 0.726 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)NCCC#N)C2)C1 1830537306 DDFUNJUZJHWEAL-BEFAXECRSA-N 459.385 0.756 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830739016 XJLOKQOOYJSLBB-MDOVXXIYSA-N 496.026 0.299 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831650360 GSUNHBHEPRCHFE-UZLBHIALSA-N 453.927 0.163 50 20 JCGD O=C(NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1cccs1 1833032895 AJCVKHUSUQQJKC-YOEHRIQHSA-N 478.340 0.625 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)n1ccnc1 1834800357 DHODNIJAFTUKIJ-KRWDZBQOSA-N 453.352 0.009 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1cccc1C=O 1834806988 YKKPNVNPQOZRJD-QGZVFWFLSA-N 495.584 0.746 50 20 JCGD CNCCCC(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835118309 NEDZDXUWMRFWBI-WPWMEQJKSA-N 459.595 0.692 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939678 DMTCOVLUONMZSV-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1836215622 GLYSMJFTXAWJDU-UJKGCTCZSA-N 479.933 0.348 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(CC(C)C)nn3C)CCO2)C1 1836337472 DALNHQNKXVSSNF-DYESRHJHSA-N 456.971 0.942 50 20 JCGD CC(F)(F)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456995 VCDXEHWMMCENOY-OAQYLSRUSA-N 469.489 0.437 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1 1837459641 UXSGIQFDIZTDRL-HSZRJFAPSA-N 497.487 0.084 50 20 JCGD Cn1nc2c(c1C(=O)N1CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C1)CCC2 1837715709 FVHCCXJXHVSTDJ-NRFANRHFSA-N 450.612 0.830 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]cc3[N+](=O)[O-])CCO2)C1 1837799023 MMEKBGFYRUVNKE-BZNIZROVSA-N 460.285 0.561 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)N1CCN(C)CC1 1839103317 LUDGOGOVHBDGKQ-AHRSYUTCSA-N 465.422 0.315 50 20 JCGD O=C(c1nn[nH]c1C(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201897 MYLMYVWXOLMOMG-ZWNOBZJWSA-N 474.209 0.584 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)c2n1 1839625616 CFOMPNLBCUZZPJ-UWJYYQICSA-N 450.923 0.621 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839670467 JSSGFRVEYDRSDT-SCLBCKFNSA-N 473.324 0.191 50 20 JCGD CNC(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839742386 WITSVXZTHXNHFJ-XXFFJTNUSA-N 462.453 0.464 50 20 JCGD CC(=O)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839744302 ZFZIPJRZPYJALF-CRAILRFSSA-N 462.453 0.464 50 20 JCGD CC(=O)NCCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839886193 NJRQPIPYTWJWNH-DRTMAPTHSA-N 476.480 0.854 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3sc4nccnc4c3N)C2)C1 1840152042 VKMBAFLBHXSHJW-HXPMCKFVSA-N 469.951 0.597 50 20 JCGD Cc1ccc(C(=O)C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840184737 CPYVGFOXIOFWPJ-HSZRJFAPSA-N 460.531 0.007 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Oc1ccccn1)CCO2 1840424542 QJGXBBOQSZSQRA-CJKYEQCSSA-N 498.540 0.439 50 20 JCGD C[C@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)N1C[C@@H]2C[C@H]2C1 1844192476 RRZMNKCAKCJWDR-GIVPXCGWSA-N 468.602 0.876 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263552 PNXCBEADFYRKSE-QGZVFWFLSA-N 472.546 0.972 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1CCN(Cc3ccccn3)CC1)C2 1844263655 CCDKLJMHKGGGBK-UHFFFAOYSA-N 477.569 0.809 50 20 JCGD CCOc1ccc(CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc1OC 1846265131 IZOWSQDUKBNTSG-UHFFFAOYSA-N 452.316 0.833 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc[nH]n1 1847896245 VQMUQKRITZOONN-UFYCRDLUSA-N 497.361 0.041 50 20 JCGD CCn1nc(C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)c2ccccc2c1=O 25436372 PRNJDAJHWPQTGU-HSZRJFAPSA-N 480.456 0.784 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)CNC(=O)c1ccco1 725739615 KGTUMIMQCUDUSZ-UHFFFAOYSA-N 473.305 0.288 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H](C)N3C(=O)CCC3=O)c2)cc1 727722341 JEEGBCVMRLSHRU-CYBMUJFWSA-N 474.495 0.795 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNC(=O)c2cccc(C#N)c2)cc1 728977284 BTGVBOLINBEEKS-UHFFFAOYSA-N 457.512 0.780 50 20 JCGD O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1 730539323 BRQGKKBLGANCLR-HXUWFJFHSA-N 457.494 0.846 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H]3CCN(CC(F)(F)F)C3)nc2)CC1 747310304 ISBLGYOUNSQDRL-ZDUSSCGKSA-N 465.502 0.280 50 20 JCGD CN(c1ccc(OCC(=O)NNC(=O)C(=O)N2CCCC2)cc1)S(=O)(=O)c1cccs1 748246979 ITSSKMFXGFEOKQ-UHFFFAOYSA-N 466.541 0.722 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)C[C@@H](C)O1 912919052 HKLUDJRQINOMKS-BETUJISGSA-N 477.381 0.374 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2F)c1 913148813 GCHHVDVNDOSXLI-UHFFFAOYSA-N 472.520 0.578 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3ccc4ccccc4n3)n[nH]c2n1 917391853 JYPCFDPLXBVLEO-UHFFFAOYSA-N 466.531 0.906 50 20 JCGD O=C(CCCS(=O)(=O)N1CCCC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 917392138 QIAUFIATWFEYTA-UHFFFAOYSA-N 486.616 0.828 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(CCOC)C2=O 917917449 MAZMGZNVOQOZJL-UHFFFAOYSA-N 485.522 0.851 50 20 JCGD CCOCC(=O)NNC(=O)Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O 920786907 MBAVLGZWPVKWAW-UHFFFAOYSA-N 490.520 0.640 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCOCC3)cc2)c2ccccc2c1=O 1318028264 VFZHPKPKMROTGE-UHFFFAOYSA-N 464.482 0.550 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3ncccn23)C1 1778651099 MCCJMXUDBGHBPU-VFHFUPNESA-N 492.540 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)CCO2 1779029563 UJNNWASLGIYOEB-DEOSSOPVSA-N 492.536 0.548 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CC3Cc4ccccc4C3)CCO2)C1 1779036064 WHVLVFSRFHKHNU-VWLOTQADSA-N 463.538 0.934 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1782103250 RANNIWKOMDDXCQ-JOCHJYFZSA-N 484.469 0.365 50 20 JCGD Cn1cc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)ccc2n1 1782241875 KILQUOZUTLZUHQ-HSZRJFAPSA-N 463.498 0.329 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)C(=O)CC4)C2)C1 1782310685 BUHCIPWQCUJLSI-DEOSSOPVSA-N 463.494 0.571 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1782786592 ASDMDSJPIASKDI-BBRMVZONSA-N 461.244 0.277 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783947590 XVOPTEPLMOEEAA-SGTLLEGYSA-N 454.351 0.896 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CNC(=O)O3)[C@H]2C1 1784583293 HLFULQDNZZGCLI-OKKJGQSOSA-N 460.437 0.960 50 20 JCGD C[C@H](CC(N)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1784593440 QWHQYMRRWYKZLQ-YXMSTPNBSA-N 474.986 0.610 50 20 JCGD COc1ncccc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1785313283 GOGAUBFNMXDGKW-FHWLQOOXSA-N 461.563 0.376 50 20 JCGD COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786979492 PKMRMHCVLGAQNY-NYVOZVTQSA-N 452.316 0.211 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cn1 1786984495 MXPNDMQHKJLGTC-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc2sccn2c1 1787273706 UHSNPSZXXFYRNM-SNRMKQJTSA-N 453.329 0.588 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c(F)cccc34)[C@H]2C1 1788395293 NRONOAFYHGYQBL-IWEFOYFVSA-N 481.488 0.608 50 20 JCGD Cc1nccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1789036516 GMYQACIYHUFIDZ-ACRUOGEOSA-N 495.584 0.725 50 20 JCGD COc1cc(OC)c(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1789236281 COBRPAAOOWYYJZ-ZRCAFCQKSA-N 486.305 0.430 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc2occc2c1O 1790436855 ANVLKGUVXKMMDV-ZRCAFCQKSA-N 464.283 0.725 50 20 JCGD Cc1cc(C)c(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(C)c1 1793240372 ZWOQZVKTMQBAJV-OPMZPASUSA-N 481.553 0.893 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188494 NFKZMQAYYZYKDM-VJICWTENSA-N 467.306 0.576 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2 1798440714 VYJUWXMIYQJPRK-VLVHOKLOSA-N 492.580 0.838 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)c1c[nH]c(=O)cn1 1798636306 IFRQDYNEMNGOLV-RCJHGTSTSA-N 475.343 0.979 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2)[C@H](F)Br 1799344539 NMCBJSXJFXQDJN-XXBVRILMSA-N 473.299 0.273 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc([N+](=O)[O-])c1OC 1799843403 UHKFFVPSVOTBFX-YVWYUNDQSA-N 493.517 0.188 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC12CN(C(=O)OC(C)(C)C)C2 1800708124 BIEQXAGAPBIVNN-CLWJZODNSA-N 493.605 0.206 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CNC(=O)N(C)C)[C@@H]1c1cccnc1 1802676612 HKNHYWIXPMIEBV-RYUIIRDCSA-N 482.545 0.493 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803147638 XVOKIRQCFCKKEX-SVFBPWRDSA-N 487.981 0.383 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1804221511 LGAZCTZVMNYOAY-KAOXLYBCSA-N 481.333 0.505 50 20 JCGD COc1ncc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1F 1804959685 ITHHBWCNUXEPKW-DYESRHJHSA-N 478.289 0.938 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1805024132 GOAANANGCBWHFC-KFKAGJAMSA-N 480.974 0.941 50 20 JCGD Cc1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1805248441 ACJWNNMJDYSBLI-OXJNMPFZSA-N 460.498 0.812 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cccn2c(O)nnc12 1808188307 DCVQBARFUCYKRY-PXNSSMCTSA-N 486.297 0.143 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2c(n1)OCCO2 1808189125 VOCPVVCLGFHMRM-XMSQKQJNSA-N 488.309 0.561 50 20 JCGD CN1CCN(CCC(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)CC1 1809553791 ZUYXQBYVHMYFRU-UHFFFAOYSA-N 471.606 0.167 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1 1810301768 CBPLSNJACFEIHN-PXNSSMCTSA-N 461.482 0.347 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1 1810303299 PSSHXCDATDQRGD-KKSFZXQISA-N 485.508 0.756 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810324899 YUHQNRAMVZJYSY-NBCNXNJRSA-N 474.330 0.372 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1 1813071619 UWUJFCLCOQLZNP-KDOFPFPSSA-N 455.462 0.570 50 20 JCGD O=C(Cc1ccc(O)cn1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813496970 YIWKCKMHFIOVHH-JPYJTQIMSA-N 460.299 0.424 50 20 JCGD CC[C@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1814478721 SWFJVOBTYJCUTC-DOTOQJQBSA-N 456.507 0.629 50 20 JCGD COCCOCCOCCOCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1 1814877567 DPRDFQHIPQFYLH-IRXDYDNUSA-N 476.958 0.698 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337874 XDYNUYSWWHSLCF-CJNGLKHVSA-N 453.333 0.582 50 20 JCGD CCOc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815337948 XWZRVBACXAFKAY-CQSZACIVSA-N 467.316 0.551 50 20 JCGD 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481.557 0.997 50 20 JCGD Cn1cnc(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCN3C(=O)OCc2ccccc2)n1 1828548620 MBDLTANATRZWJB-JTSKRJEESA-N 490.948 0.481 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(O)O)C2)C1 1829340889 SPCJWXIRZVOZHA-IIBYNOLFSA-N 469.922 0.003 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726039 NQLXSSKMIPKGAD-IERDGZPVSA-N 477.986 0.738 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3=CCN(C(=O)OC(C)(C)C)C3)CCO2)C1 1831141541 KDYSDJBWTBRNDW-VGSWGCGISA-N 487.981 0.874 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3csnn3)CCO2)C1 1831743147 HYFAOKLPNMOBQS-DJJJIMSYSA-N 489.982 0.740 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1832545261 NJIASJYPTOLVQA-HTAPYJJXSA-N 487.981 0.610 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1 1833923921 BEHFLPSIVGMNLU-SFHVURJKSA-N 451.955 0.825 50 20 JCGD 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COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nn1 1815360633 KRBYIEALGYPXLA-CYBMUJFWSA-N 453.289 0.161 50 20 JCGD Cn1c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cccc1=O 1816315176 GKOQEVZCJDBYPO-INIZCTEOSA-N 464.486 0.727 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)C1 1817470522 UHSSYNANSKNYCM-FRQCXROJSA-N 468.319 0.985 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nccc2nc[nH]c12 1817929090 VEFZKPHVZPOHGS-KRWDZBQOSA-N 459.275 0.981 50 20 JCGD Cc1c(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)[C@@H](O)CCl)CC3)cn2[nH]cnc(=O)c12 1821217315 FMCLBUKAFGEZHK-SKDRFNHKSA-N 450.908 0.613 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnncc2C(=O)O)[nH]n1 1822414376 CRKBHWRWCMBWGQ-HNNXBMFYSA-N 458.479 0.577 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1825730159 BPXDYPLQFGXQSY-FQEVSTJZSA-N 454.336 0.656 50 20 JCGD N[C@@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1 1826907604 LUFWAYYOLYKSGU-FCHUYYIVSA-N 450.348 0.695 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)CC1 1827677433 SAMFWADGLVYGFZ-VWOYHTDSSA-N 485.545 0.338 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1829160219 LPDJMDJBKJMPOH-QGZVFWFLSA-N 455.280 0.545 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NN(C)C(=O)CC3)C2)C1 1830535857 VIJOVPHHOUGBEX-ACJLOTCBSA-N 459.341 0.082 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnccn3)C2)C1 1830546986 YWYUFBRYEFTVLX-BEFAXECRSA-N 455.353 0.897 50 20 JCGD O=C(c1cc(Cl)c2nncn2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830730554 BFRXGYFDKTZRQW-KBXCAEBGSA-N 458.302 0.052 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CS(C)(=O)=O)CCO2 1831466705 SYWVIJGHYYGJPX-ZQIUZPCESA-N 469.398 0.297 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1831994091 QVQUTAXOXRCQJP-RHSMWYFYSA-N 453.305 0.865 50 20 JCGD O=C(NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1ccc[nH]1 1832877936 ORCKSYSZWGPTMT-QAPCUYQASA-N 475.315 0.282 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(C)nc3)CCO2)C1 1832902290 LEXZDVUDLLUARS-GQUZIAHASA-N 496.568 0.913 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)n3cnnn3)CC2)CC1 1833266061 MIGPDTZULKXVMC-UONOGXRCSA-N 456.389 0.837 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833317319 JLTGBRDJOSOAKE-JOCHJYFZSA-N 456.396 0.036 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cn1 1833429808 GPSKEAJFOZHBGJ-GOSISDBHSA-N 457.325 0.730 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn(C(C)(C)C)c1)CCO2 1833457267 HXFDMVLYMHIINX-JOCHJYFZSA-N 464.567 0.081 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1 1834423649 BURHYTAWSFJHBZ-INIZCTEOSA-N 463.373 0.408 50 20 JCGD O=C(CN1CCCCC1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834611457 SMZUCYDUDFNVFU-UHFFFAOYSA-N 456.396 0.038 50 20 JCGD CC[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1834749540 YHRMHNVPRHLJFX-DHLKQENFSA-N 466.343 0.630 50 20 JCGD CC(C)N[C@@H](C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)C(C)C 1834787874 OYIWTRUDSWUTSR-HSZRJFAPSA-N 466.671 0.954 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4n[nH]cc4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834797839 CEGGVMVQUHHIQG-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cccc(F)c3)CC2)CC1)c1cccc(B(O)O)c1 1834800945 CLOYOTRQRQGLEW-UHFFFAOYSA-N 467.350 0.933 50 20 JCGD CO[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)c1ccccc1 1834924544 HQXXAFAQSKZQPV-RXTVBYMDSA-N 497.552 0.965 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737849 HGHPKBIIGQGKAH-UHFFFAOYSA-N 476.654 0.722 50 20 JCGD O=C(c1ccnc(C(F)(F)F)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935235 JURVWIDWZYESRV-NRFANRHFSA-N 493.247 0.164 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cn3cccnc3n1)CCO2 1836886063 BBDLNYOFOVPWED-GOSISDBHSA-N 452.309 0.584 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)N1CSCSC1)CCO2 1837573971 KFODYZPDRDLHBL-VKJFTORMSA-N 468.041 0.740 50 20 JCGD O=C(c1cc(Br)c(O)cc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838608545 VRVRWDGQZONZFE-MAUKXSAKSA-N 495.729 0.964 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)nn3C)C2)C1 1839962818 RKZQHGNGYOORDN-FZKQIMNGSA-N 459.341 0.672 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(NC(C)=O)c3)C2)C1 1840152829 VVMFKSMONJYAPR-JXFKEZNVSA-N 454.911 0.364 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3cnn4C)C2)C1 1840184205 CXRGCAZXDLEFLU-QHCPKHFHSA-N 472.546 0.016 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1842784553 FBAZFJHECMCCCU-UHFFFAOYSA-N 452.316 0.833 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)C(C)(C)NCCC#N)C1)NC(=O)NCc1ccccc1 1842920585 DLLOKHRJGRJKDC-UHFFFAOYSA-N 469.590 0.818 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)ccc21 1843734212 VWTLTNALRMLPEF-UHFFFAOYSA-N 463.498 0.006 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1CCN(c3ccc(F)cn3)CC1)C2 1844264948 BHPJSOXVJCLIKR-UHFFFAOYSA-N 481.532 0.953 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@]13C[C@@H]1CCN3C(=O)OC(C)(C)C)C2 1846385835 BPNYTDJQKFDTMM-QMHKHESXSA-N 463.579 0.962 50 20 JCGD C[C@@H]1OCCN(C(=O)OC(C)(C)C)[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCC(=O)NN(C)C 1847889610 LKBXFKWAYIVDKU-OGNFBWPZSA-N 481.594 0.586 50 20 JCGD CCn1c(=O)c(=O)[nH]c2cc(C(=O)NNC(=O)CCN3CCN(c4ccccc4)CC3)ccc21 15737576 RDBZWPHHYQUQRI-UHFFFAOYSA-N 464.526 0.683 50 20 JCGD Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)COc1ccccc1-c1ccccc1)c(=O)n2C 15878638 QDZKSMVPVYLGLL-UHFFFAOYSA-N 462.466 0.327 50 20 JCGD NC(=O)CNC(=S)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1 727066262 MNSSWSUDKWWVBZ-UHFFFAOYSA-N 469.976 0.512 50 20 JCGD CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 727604326 VSLITMFHPPQPCH-UHFFFAOYSA-N 490.586 0.373 50 20 JCGD COc1ccc(S(=O)(=O)N2CCC(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)CC2)cc1OC 728179229 IGXPXZGYOOCRTL-INIZCTEOSA-N 489.616 0.597 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3CCN(c4cnccn4)CC3)cc2)CC1 728214207 MXMNVOZOSBMHPU-UHFFFAOYSA-N 459.576 0.772 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)CNC(C)=O)c2ccccc2c1=O 728512917 ZBRGGNLHRBERMM-SFHVURJKSA-N 470.530 0.475 50 20 JCGD O=C(CN1CCN(Cc2cc(=O)n3ccsc3n2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 745981123 OUYFGFQFZBSQQP-UHFFFAOYSA-N 471.499 0.243 50 20 JCGD CSCC[C@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 746110177 ZQLATQGLWVQEHQ-YESZJQIVSA-N 485.566 0.991 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(C#N)cc1 747175298 OFMYFPANQUTZMK-KRWDZBQOSA-N 498.970 0.754 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)CNC(=O)c2cccs2)c1 751209774 STAXKHFHTHSCPT-UHFFFAOYSA-N 495.583 0.026 50 20 JCGD CC(C)C[C@@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 913155892 AGOLZPKVYKTFCR-KSZLIROESA-N 451.487 0.789 50 20 JCGD COc1cc(Cl)ccc1C(=O)NNC(=O)Cn1c(=O)oc2cc(S(N)(=O)=O)ccc21 914604581 KBZWIBVCUQGPFN-UHFFFAOYSA-N 454.848 0.365 50 20 JCGD CCCn1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)c2ccccc2c1=O 914712926 FPGKUTFWNNJLKN-UHFFFAOYSA-N 489.510 0.495 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc(N4CCCC4=O)cc3)nc2)CC1 916219286 YYOSSNLGPQSOGN-UHFFFAOYSA-N 487.586 0.971 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(N3CCO[C@H](C)C3)nc2)cc1 916392744 JTLFRSCZOPSXKZ-QGZVFWFLSA-N 490.586 0.766 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1 916649070 HUAAKTXABPUEPY-UHFFFAOYSA-N 464.500 0.527 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Br)CC)C2 1779201036 QDBGDWKRDSGRAE-YRWGSWDYSA-N 464.357 0.738 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@@]3(CN(C(=O)[C@H](C)Br)CCO3)C2)n1 1779236250 OZZBXMJNYJDILZ-IFXJQAMLSA-N 455.353 0.900 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Cn1cncn1)CCO2 1780097995 WOXNHTVYDSXCQV-NYHFZMIOSA-N 486.485 0.891 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781332476 ZHGMZWHZIOAOLN-PPHDSNJXSA-N 458.288 0.115 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(CCO)CCO)C1 1781838425 GTXHCJXJJWEUAX-ATZDWAIDSA-N 454.395 0.023 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782008557 DZDIGSQOCQOUKD-FQEVSTJZSA-N 454.911 0.568 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@@H]1C[C@H]1c1ccc(F)cc1 1783884923 OWVYEIKWATUMTN-CZIXKKEKSA-N 466.318 0.903 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783946765 HAYVYCPJGACNSC-IBGZPJMESA-N 471.378 0.706 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C2)C1 1785223952 UDDHLHSSYCZKAQ-HTAPYJJXSA-N 461.902 0.813 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1785609103 OIHOSYCDLFCHCZ-RRUGBERISA-N 495.346 0.276 50 20 JCGD CO[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)c1ccccc1 1786466903 JVDZUEQITZXDTC-LRGNLBRXSA-N 467.526 0.666 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4cc(Cl)ccn34)[C@H]2C1 1787238055 CRBNLQWCKVVORP-IXDGSTSKSA-N 497.943 0.893 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(Cl)c3)C[C@@H]21 1788611474 CYIDSLYWRIWQDO-UVBJJODRSA-N 474.905 0.346 50 20 JCGD CC(C)c1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)no1 1788611529 JPWDGMKPXFHLFC-JQFCIGGWSA-N 471.518 0.028 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1[nH]cnc1-c1cccnc1 1789196079 WEYFLYRIZBWWOT-IHPCNDPISA-N 475.314 0.059 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1792186349 SVPHFTQIQRHDLR-VUDPUYKOSA-N 474.562 0.405 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CC1 1792984180 ZOCRQYGCJBCRRS-YVSFHVDLSA-N 457.955 0.743 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnccn1 1793134961 KWFMESPTKBZCHT-KPEUIFRASA-N 467.954 0.741 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cscn1)NC(=O)NCc1ccccc1 1794796817 KDKNBWGMOPQYTH-XEMDLRDOSA-N 472.571 0.693 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)C2 1796441667 NXQIJDQCOIZZFS-ZBRRTKQMSA-N 484.557 0.111 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798443228 ZQLHLHXYHHZNSE-APIJFGDWSA-N 460.535 0.850 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl)[C@@H]1SC(=N)NC1=O 1799275309 PKKCXCFUZROOGJ-CTZDEMLISA-N 451.376 0.615 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(O)c(I)c1 1799842824 PBIMFOXICYKXEW-BAESOJJISA-N 494.713 0.800 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(Cl)cc2)CC1 1800397935 BMAVPIQPGLRWKW-UPHUGPLXSA-N 468.746 0.955 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2 1800754504 PUZWQBNLCNTCQR-NTNQKNOYSA-N 492.370 0.975 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C2 1800975063 HQVVNESCQQEYKA-HIRMHNASSA-N 458.964 0.476 50 20 JCGD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1802104559 WUQRKCVBKBNUNC-WDAIWFPHSA-N 450.380 0.221 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1803137059 ZWPNZFRVDXVHCO-TVFCKZIOSA-N 484.981 0.963 50 20 JCGD CCCNC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1803446469 FNYDTNYJJFNASI-MBSDFSHPSA-N 460.579 0.767 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnc(OCF)cn1 1805030964 KKJTUUCBVFAVFA-LAUBAEHRSA-N 479.277 0.491 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2ncnn2C)[C@@H]1c1cccnc1 1805276592 IKDLARRWVMKUDM-ISOPGZDOSA-N 463.502 0.664 50 20 JCGD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1C 1805590966 IUDSHPBDUSMKQN-OXQOHEQNSA-N 462.514 0.755 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCNC(=O)c2ccc[nH]2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362925 MWOORYQQNJRMJO-XXBNENTESA-N 489.341 0.229 50 20 JCGD COc1cccc(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1807369327 GQYWDFLDTYHZOH-DVECYGJZSA-N 474.326 0.727 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(O)ccc2O)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374548 ZZEMIHLDLBOLTO-VGOFRKELSA-N 461.283 0.806 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374884 KTUXJTAGZJMEKU-RHSMWYFYSA-N 488.235 0.532 50 20 JCGD O=C(CNC(=O)c1ccco1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807587865 LCPZOTILZRNHIH-AVRDEDQJSA-N 476.298 0.104 50 20 JCGD CCCNC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810293221 AYNYCCUHYJAZMJ-VGSWGCGISA-N 481.557 0.706 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)/C=C/C(=O)NCc2ccco2)[C@H]1c1cccnc1 1810471508 YUEOFLJBDCLZBK-ULFHMZPJSA-N 496.568 0.926 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1 1811194263 UGDSONWMRUFLRE-XLIONFOSSA-N 461.482 0.347 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1)C(Cl)Cl 1813075704 IKHOMENYJUOFMU-BXUZGUMPSA-N 450.286 0.936 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2cnccn2)[C@@H]1c1cccnc1 1813446921 LEFBSVUTNKSNOD-JPYJTQIMSA-N 453.547 0.883 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3c(c1)CNC3=O)CC2)c1cccc(B(O)O)c1 1815356644 KMXLTNZPFACQPH-INIZCTEOSA-N 476.323 0.606 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361945 VRYQVWLKOIPEON-RDJZCZTQSA-N 458.349 0.354 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nccc2nc[nH]c12 1817929091 VEFZKPHVZPOHGS-QGZVFWFLSA-N 459.275 0.981 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1819899243 SNWKFLRJJBUAEA-BDKZABQWSA-N 472.332 0.578 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)C3(Br)CC3)sc2C1)c1cccc(B(O)O)c1 1823024160 MQNABXBVGIBJMS-GFCCVEGCSA-N 464.150 0.976 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826806273 NPYSTWSTZSRBFQ-XJKSGUPXSA-N 466.328 0.911 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055840 LUTWOTUQXZKYEG-IBGZPJMESA-N 450.366 0.034 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057419 DYRPDAGBGONXQN-OAQYLSRUSA-N 464.331 0.633 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)CC2=O)c1 1829635812 ABFGIQDAJORIQN-ICPLQIHGSA-N 495.960 0.104 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1830366682 UECCCIUSJOGZPU-FQEVSTJZSA-N 470.910 0.478 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1 1830719866 MVACMODLVDAEKU-VFNWGFHPSA-N 475.970 0.347 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1F 1830730741 DGDSKFBSPKJVFV-IIBYNOLFSA-N 472.897 0.672 50 20 JCGD O=C(c1nnc(-c2ccccc2)o1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732171 VRTGMEFCEIIDAU-FOIQADDNSA-N 450.879 0.406 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1 1833565439 LFAZUCQEDLXLTP-UZLBHIALSA-N 473.979 0.714 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC1CCN(C2CCN(C(=O)CNC(=N)N)CC2)CC1 1833726714 DHVVZEMYDNLLLT-INIZCTEOSA-N 488.033 0.173 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ocnc1C)CCO2 1834366208 YSEIKKJVNUZOAI-MNQDVBFDSA-N 458.475 0.187 50 20 JCGD N[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccc(Cl)c1 1834800912 ANNYZSGRKRTBLZ-QHCPKHFHSA-N 498.820 0.905 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)n1ccccc1=O 1834823457 WAXXKGWSGHTNIS-HNAYVOBHSA-N 456.337 0.651 50 20 JCGD O=C(Cc1ccc2ccccc2c1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1834891042 CFCKYJIQVYHLLB-HHHXNRCGSA-N 488.349 0.832 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CN)CCO2 1835529586 ZGVLCQJFGSGPCI-SPLOXXLWSA-N 464.475 0.185 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc2nc[nH]c2c1 1835556549 BUCNGXRFKLIVIE-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CSc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939947 PWNVPFCTMRQZJC-XMMPIXPASA-N 484.383 0.401 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1836398675 RMAVHAPXPFIYIB-FQEVSTJZSA-N 484.388 0.839 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(NC(C)=O)cc3)CCO2)C1 1836666262 CRXHDMPKYGVTSR-DENIHFKCSA-N 467.950 0.898 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3sccc3[nH]1)CCO2 1837129137 RRYRLNRGPJXVPI-QFIPXVFZSA-N 469.328 0.293 50 20 JCGD Cc1nnc(CCC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1837173090 WTUWGWPNRSLACH-UHFFFAOYSA-N 486.403 0.771 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccccc4o3)C2)C1 1837459653 VEQSAVRCMGTKQV-DEOSSOPVSA-N 479.493 0.815 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1837715597 ZPXUGVSXEIGJRU-WMWRJIBUSA-N 479.606 0.760 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)c1cccc(Br)c1)CCO2 1839054707 JQMRFSIDRYJKBN-GPMSIDNRSA-N 491.766 0.539 50 20 JCGD O=C(c1cnn2c1OCCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202898 SNMSMTGFIARZCI-SUMWQHHRSA-N 461.288 0.426 50 20 JCGD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839912227 NAHRCJVLYZIGGC-SSYAZSBWSA-N 456.348 0.263 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3cnn4C)C2)C1 1840152369 GVFBPZVQPRONNB-UTKZUKDTSA-N 450.923 0.897 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](NC(C)=O)c3ccc(F)cc3)C2)C1 1840154274 RHCKMJDFMSMLAN-DXIQSLLYSA-N 485.940 0.713 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1 1840155578 FEXAAIICXXXCEH-IIBYNOLFSA-N 450.923 0.747 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(N(C)C)c3)C2)C1 1840185466 RIKVFJQHCZVPBG-HSZRJFAPSA-N 461.563 0.196 50 20 JCGD O=C(c1ccc(N2C(=O)C=CC2=O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840190116 FYTXMTRKXZAFLD-OAQYLSRUSA-N 482.320 0.990 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1840277530 AYWAJZNWJHHELA-DYESRHJHSA-N 454.907 0.072 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840945698 BIRGAIGTMSEIST-VCAMNPENSA-N 493.960 0.390 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1 1843012768 OJODKAJCFRYQGK-UHFFFAOYSA-N 476.747 0.554 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1 1846386414 JAIBUMLKIVJHCW-IBGZPJMESA-N 461.538 0.449 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(F)c(F)c1F)c1cccc(S(=O)(=O)N2CCOCC2)c1 16128159 IVLCIOKABBGGOA-UHFFFAOYSA-N 479.458 0.748 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1 725741900 WXWUWRFMLHWRIG-UHFFFAOYSA-N 463.516 0.589 50 20 JCGD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1 727607366 FBFBFHKOJIYLDL-GFCCVEGCSA-N 458.500 0.547 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Br)o2)n1 759054835 PIUNVYGISWMSLN-UHFFFAOYSA-N 459.278 0.470 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)[C@@H]1COc2ccccc2O1 785859766 OSYWXQDMHQLSMG-FQEVSTJZSA-N 499.501 0.649 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)CN(C)[C@H]2CCS(=O)(=O)C2)c2ccccc2c1=O 914531821 GLHFFPMCEHNLHM-HNNXBMFYSA-N 463.560 0.467 50 20 JCGD C[C@@H](CN1CCOCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 916469571 AZFXNAYLRRABDE-INIZCTEOSA-N 453.565 0.526 50 20 JCGD O=C(CNC(=O)c1ccc(F)c(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 918279035 LPYQOAHOVFUGFE-UHFFFAOYSA-N 466.466 0.940 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc(F)cc3Br)c2)CCN1 918341395 KXEFMKLQWQHIEB-UHFFFAOYSA-N 499.318 0.784 50 20 JCGD CC(=O)N[C@H](CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(Br)cc1 919886704 YWKGCDLISCYWMV-ZIAGYGMSSA-N 461.338 0.534 50 20 JCGD 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1817473065 BLLAXJRTRQPDAF-SFHVURJKSA-N 464.291 0.898 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)[nH]n1)c1ccc(B(O)O)cc1 1817475720 RVPKBSDZJRMNPS-OAHLLOKOSA-N 487.372 0.256 50 20 JCGD Cn1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c2c1CCC2 1818717666 PRHHQUVISFDTFV-IBGZPJMESA-N 462.319 0.931 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCC4)sc2C1)c1cccc(B(O)O)c1 1819126930 ACSOHINYRWZBJK-OAHLLOKOSA-N 465.344 0.895 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819452349 LBXVEVMVZZRQAT-MYHAECLISA-N 469.307 0.924 50 20 JCGD CCOc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cn1 1819793681 RBRIZVWKQFIETA-NSHDSACASA-N 482.526 0.870 50 20 JCGD COCc1oncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797550 WIFKNVUNVUZOGP-JTQLQIEISA-N 471.499 0.816 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H](O)Cc1ccccc1 1822078609 AOPOPJGKDGCKMV-NHCUHLMSSA-N 462.315 0.999 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)[nH]n1 1822371828 ZZDXPUFSFYGHFU-NVXWUHKLSA-N 454.959 0.820 50 20 JCGD O=C(CNC(=O)C(F)(F)F)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060408 HNIYDMXHGSNEKB-QGZVFWFLSA-N 469.269 0.278 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(S(C)(=O)=O)c3)CCO2)C1 1830181998 DFNHGAIISKTWAB-PXNSSMCTSA-N 474.963 0.414 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1830538389 DYOKTTZEQWMVSY-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD O=C(c1ccc(Br)cn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731411 LIDSCUIOLUMUPQ-YOEHRIQHSA-N 462.728 0.514 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1831329302 LLXUIVDJTZHASP-KBRIMQKVSA-N 474.407 0.007 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cncn1C)CCO2 1834327213 IWEFYCFNMMLRQX-JOCHJYFZSA-N 487.469 0.637 50 20 JCGD CNC(=S)NCCC(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1 1834423820 KFMZOVKNSQANGV-UHFFFAOYSA-N 462.458 0.827 50 20 JCGD COc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834798471 ZJOMVJIGKYQUMW-UHFFFAOYSA-N 465.359 0.874 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4nonc4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798635 STMYUZLPHVMPGQ-UHFFFAOYSA-N 477.330 0.402 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCCc3ccncc3)CC2)CC1)c1cccc(B(O)O)c1 1834800129 XECSMAKDROBANN-UHFFFAOYSA-N 478.402 0.970 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1 1835131272 NYNOXRIIMAWODK-BMBTXRBNSA-N 488.589 0.453 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1835272927 ZXXUNPKXBRNXPQ-PGRDOPGGSA-N 470.950 0.693 50 20 JCGD Cn1ncc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1Cl 1836042905 LSPZEZXUPAOBQK-UHFFFAOYSA-N 488.980 0.571 50 20 JCGD O=C(NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccco1 1836128306 JAHCXXCHFMYCHK-WMLDXEAASA-N 462.272 0.156 50 20 JCGD Cc1cc2nnc(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)c(C)n2n1 1836717259 QFGHDEACZUYJJJ-QGZVFWFLSA-N 464.954 0.953 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)n1ccnc1 1836777297 CYPXHQDAHPSVFF-QGZVFWFLSA-N 454.336 0.436 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n(C)n1 1837463393 HGWYCFOLXAWVSK-UHFFFAOYSA-N 469.546 0.653 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1 1837530787 QRWXTLNSCAQQHH-YZMFZURSSA-N 462.341 0.755 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)CN3CCOCC3)CC2)CC1 1837803263 MLAULASFNJUIQU-NLRVBDNBSA-N 488.589 0.451 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc(Cl)n1 1838232185 KESFIHYQMWBFPP-NRFANRHFSA-N 483.953 0.187 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]nc3C)C2)C1 1838528100 FLVOBTHAEIPSRT-JOCHJYFZSA-N 487.469 0.935 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1C 1838987177 BWAHZMIKYKAFEK-XMMPIXPASA-N 483.525 0.386 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnco3)C2)C1)NC(=O)NCc1ccccc1 1839053997 AWGDTTXGCBQJEQ-QHCPKHFHSA-N 486.529 0.091 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CCO2 1839384623 MOFAKCQPMPFRKV-TYILLQQXSA-N 494.383 0.317 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622389 BLMSDSQTLKUMLB-QRWLVFNGSA-N 484.395 0.572 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1840034961 BTDMCIXKXTWHFR-SGTLLEGYSA-N 470.299 0.722 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840037360 YPTCOFVIQILQRQ-ORAYPTAESA-N 457.369 0.819 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1 1840149744 ZFTALQNIIFJMBZ-LAUBAEHRSA-N 450.923 0.587 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS[C@@H]3CCCCO3)C2)C1 1840153698 YEAPSHCPVDMBPZ-KVSKMBFKSA-N 450.985 0.956 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840187795 XLLWGEJINLMNSH-ORAYPTAESA-N 484.377 0.786 50 20 JCGD CSCC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1840194779 FEJXCKAESYVVRS-KEYYUXOJSA-N 453.399 0.588 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CCC(O)CC1)CCO2 1840273821 BPCAZFXJJIPMNR-ZSCJQFPRSA-N 475.546 0.128 50 20 JCGD CC(C)N(C)CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1840565220 WADPTYWNWWUQNE-JTSKRJEESA-N 491.029 0.915 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1842758450 KULQHYOLPSEKRL-UHFFFAOYSA-N 471.539 0.284 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1 1846385400 AYTSNGLGLBUDIJ-GOSISDBHSA-N 497.518 0.728 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(CCC(=O)O)cc2)c1 13078732 WCZZIEHPXMLLLN-UHFFFAOYSA-N 455.514 0.577 50 20 JCGD COc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 15639601 JMPYUHRFTYXMOE-AWEZNQCLSA-N 471.491 0.687 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(C(=O)Nc2ccc3c(c2)OCO3)CC1 725873065 ULQJYAIYTLGICV-UHFFFAOYSA-N 457.443 0.830 50 20 JCGD COc1cc(F)c(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(F)c1 726764671 LQUFJPLRBHGNCU-UHFFFAOYSA-N 463.484 0.912 50 20 JCGD O=C(CN1C(=O)N[C@]2(CCc3ccccc32)C1=O)NNC(=O)C1CCN(c2ncccn2)CC1 728847646 JJIJLZYQOJZVLO-QHCPKHFHSA-N 463.498 0.234 50 20 JCGD Cc1ccc(S(=O)(=O)NC2CC2)cc1C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728889424 IQLHDYGSYRQANN-UHFFFAOYSA-N 458.544 0.903 50 20 JCGD CN(C)c1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)cc1 729691140 DRUBQJAAUQEOHO-UHFFFAOYSA-N 476.584 0.505 50 20 JCGD COc1cc2c(cc1OC)CN(C(=O)CCCNC(=O)NNC(=O)C(=O)N1CCCC1)CC2 731119400 QLZGETNAHSNBLY-UHFFFAOYSA-N 461.519 0.322 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)c3cn(CC(=O)N(C)C)nn3)c2)c(C)c1 742782362 VTAAOXNCBFLGAS-UHFFFAOYSA-N 499.553 0.859 50 20 JCGD COc1ccc([C@@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)N2CCOCC2)cc1 806998740 QXRMQBZNQCHDCD-HXUWFJFHSA-N 466.502 0.688 50 20 JCGD COc1ccc(S(=O)(=O)N[C@H](C)C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1 913415742 ZHVPWGXKWDEKBO-GFCCVEGCSA-N 467.500 0.849 50 20 JCGD O=C(CCOCC(F)(F)F)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 914458161 ASFMIFIKHPAWCG-UHFFFAOYSA-N 467.466 0.757 50 20 JCGD O=C(Cn1cc(Br)ccc1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 914863923 LGWJJJFEQVRXBN-UHFFFAOYSA-N 499.343 0.093 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccn1C)C2 1778091382 NIMIIWCQUVHSOU-ZZLSVPGXSA-N 455.519 0.682 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCN(C)C1)C2 1778092605 KIZQLKLEKJBEQR-CYFCGGILSA-N 472.590 0.976 50 20 JCGD COc1ccc2oc(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2c1 1778420332 LDBBITAEUMGCFN-XMMPIXPASA-N 464.283 0.879 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(C(F)(F)F)n3)CCO2)C1 1779031643 COCYFCQNYOUJEO-FQEVSTJZSA-N 478.431 0.856 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1779179440 FPWPSPGPAKGKIB-PPHDSNJXSA-N 458.288 0.115 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)[C@H]1ON=C(c2ccccc2)O1 1779259408 QXPKHTVGAQLBRE-OBNJBMLMSA-N 451.907 0.835 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1 1779595809 RUNWOSHWBNTSHM-VWLOTQADSA-N 474.326 0.369 50 20 JCGD COc1c(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ccc(F)c1F 1781842375 QFICBDSOGJFWIO-JOCHJYFZSA-N 460.242 0.411 50 20 JCGD Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc(Cl)cc1[N+](=O)[O-] 1781999957 UJJYCCUCDRPTNM-QFIPXVFZSA-N 487.705 0.994 50 20 JCGD COc1ncc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1783416607 LYSOEZCSOKMFEA-IGNZVWTISA-N 488.932 0.649 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Oc3cccnc3)C2)C1 1784547730 SPMKCFAFUSOJGG-KCCFIZEVSA-N 468.514 0.813 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786982964 DKAXPQQXCKEDHY-UHMOLFJZSA-N 469.372 0.536 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccnn3)[C@H]2C1 1787121473 QIHWVIUXUCAZGM-FNHZYXHNSA-N 472.458 0.405 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc(C)c1C(=O)O 1788609825 MBFQTQXBMDECDW-YSSFQJQWSA-N 495.536 0.907 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1 1788610993 HOUPXOVMPHDWFB-YYWHXJBOSA-N 495.536 0.308 50 20 JCGD CN(C)c1cccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788611482 DGVJINWRZQRJCZ-SSKFGXFMSA-N 496.568 0.423 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21 1788638742 GFSQSJNFPLZBHT-SIBFUHKCSA-N 467.346 0.697 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cn4c(nc3=O)SCC4)[C@H]2C1 1789707574 AIGDZMHDDYWNMH-JURCDPSOSA-N 485.404 0.655 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ncnn4c3)C[C@@H]21)[C@@H](F)Br 1789923620 XUJHYQLBMVHJPL-AYMQEEERSA-N 454.300 0.942 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]3C2)no1 1791056315 SJLASHGOAFELIR-OSFYFWSMSA-N 457.325 0.476 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1791080774 GCVYAWWYOOIYQB-WOYTXXSLSA-N 459.971 0.965 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C 1792889720 VWXXBBOWLOFAOX-QKGCVVFFSA-N 478.384 0.635 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCOC1=O 1793163483 FIDHMTLHWGMPPK-HBCWATKFSA-N 476.442 0.176 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1793254574 QWRWBTWGHMGUEM-YVSFHVDLSA-N 477.986 0.782 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)C2)[C@H](F)Cl 1796371479 XWELYGFVZSNJOP-MVJTYMMSSA-N 489.953 0.445 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OCCO2 1796960902 KGKFRKMVWVTDDT-IHBLFXCCSA-N 481.509 0.795 50 20 JCGD COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1C 1797753929 CNTRMZDILDRJTP-YVWYUNDQSA-N 453.499 0.519 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc(C(F)(F)F)n1 1798082888 INZRXZZUCFXWLM-ZSBFGKGUSA-N 463.221 0.297 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)C2 1799268428 SIHDCRNMHQCHCY-PHPOFCCKSA-N 459.971 0.821 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1799353992 NOJMSGBXSJVQNF-ZUWCUPBKSA-N 482.347 0.542 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1800802358 PMBATIVVSZWPSD-BJWYYQGGSA-N 453.260 0.854 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1803013959 BSMBRDWUNSSRJU-NOCIGQNYSA-N 469.380 0.769 50 20 JCGD O=C(CN1CCCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1806883085 IMNMGIGRPYFSJE-NFBKMPQASA-N 450.348 0.567 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1806931852 ISWWAIBXXAEHPR-UHFFFAOYSA-N 455.280 0.016 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)[C@@H]2C=CCN2)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1808221286 YIMTYJMNTFRBIB-FIXSFTCYSA-N 491.596 0.962 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809969971 XLTOWJWLZJIKSH-SFHVURJKSA-N 475.351 0.054 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnncc2C(=O)O)[C@@H]1c1cccnc1 1810302450 JFHUYOMWFLVTQE-IFXJQAMLSA-N 490.480 0.202 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1ccnn1 1812397246 FIDMRLXWZVIWCI-OGWOLHLISA-N 463.502 0.252 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCc2ncc[nH]2)[C@@H]1c1cccnc1 1813273668 JWWXTTUCZPWGDV-KKSFZXQISA-N 462.514 0.756 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1815233437 XGIBMGFYCUZRPC-HIFRSBDPSA-N 456.569 0.456 50 20 JCGD N[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1ccccn1 1815339557 GSCOGVWYMJBWDT-KSSFIOAISA-N 451.317 0.144 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361954 WFACXHLAUJIOPJ-CJNGLKHVSA-N 453.333 0.582 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cccnc3)sc2C1 1817188397 WYEJNXSDFXBBQC-BBRMVZONSA-N 480.554 0.332 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCC(=O)N1)CC2 1817280425 VRMLGKBILKYFGT-POKWRQTLSA-N 457.516 0.468 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1 1817812348 CPPQLDIGZKEFLO-BXKDBHETSA-N 478.311 0.873 50 20 JCGD C[C@](Cl)(CCl)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1 1820868468 JAYYLIYDUSQMKC-KSSFIOAISA-N 450.367 0.925 50 20 JCGD CN1CCC[C@@H](C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)C1 1822553023 ZCAHBXXIDHUERT-OLZOCXBDSA-N 457.560 0.709 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCOCC2)CC1 1826751120 QHJCNYRPIIWMOF-HXUWFJFHSA-N 451.612 0.701 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(O)nn2)CC1 1828925467 MOQVTXOJYDMTMO-SFHVURJKSA-N 453.503 0.728 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828925933 VZLDHGGEPYKFGM-WZONZLPQSA-N 475.546 0.534 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830651674 BZGBGPGYFAEBPA-VWLOTQADSA-N 495.316 0.230 50 20 JCGD O=C(c1cnc2cc(Cl)ccn12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724522 XXMUZYCSNYRNQJ-DNVCBOLYSA-N 457.314 0.657 50 20 JCGD O=C(CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)N1CCCC1 1832424895 SHWYWGDDCCLVOV-AEFFLSMTSA-N 464.332 0.536 50 20 JCGD Cc1cccc(CCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1833742981 GLQVLMROHSZGGS-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD Cc1ncccc1CCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833747897 DUGPYOMBWFTZKQ-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD O=C(/C=C/c1ccoc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833753041 VBBGKNLYIYTAFQ-LZCJLJQNSA-N 451.332 0.858 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn(C)c3)CCO2)C1 1834173070 DRMRCCPWFFGKGM-JOCHJYFZSA-N 487.469 0.637 50 20 JCGD CCc1oncc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801253 WFVPPMBBJHOPEW-UHFFFAOYSA-N 454.336 0.416 50 20 JCGD Cc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1835153578 MLFHFDHAQOWIFI-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)Cc3ccncc3)CC2)CC1 1835738323 WPHMVUYHQWHPSD-UHFFFAOYSA-N 465.558 0.508 50 20 JCGD COc1ccccc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836234855 VFWOHDGYBDXSNL-UHFFFAOYSA-N 465.359 0.874 50 20 JCGD C[C@@](O)(C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(F)(F)F 1837019466 AXCUDGCROAVYLY-HXUWFJFHSA-N 472.269 0.292 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(F)c1 1837459944 PBLQLIKQCYQXTR-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc1 1837528602 LGEUONRUCOULSD-UHFFFAOYSA-N 451.332 0.996 50 20 JCGD O=C(c1ccc2nonc2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200704 LLAVAAXPBYLQEH-RHSMWYFYSA-N 457.256 0.983 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839200992 UTIOGHSRMQDECK-DXCKQFNASA-N 460.304 0.424 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)c(F)c1)CCO2 1839271032 KDODDXFFTCTKOD-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2 1839691696 HUKLVVGQAUTZPY-LJQANCHMSA-N 458.462 0.201 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839744241 WGGDDDFYZRNRDS-KVDKEEBASA-N 476.480 0.853 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840018416 JWKQMZVAGPKLEM-RADWXHQJSA-N 483.949 0.357 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1840034298 HOCPTMOIWSOVGK-YMTOWFKASA-N 470.246 0.677 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840650329 JPTZPBTTZWKUFH-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD COc1ccc(CCC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c(OC)c1 1843012119 FRRYLGSUCWOLEY-UHFFFAOYSA-N 452.316 0.833 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013094 HMVSWLRFCRJTBI-UHFFFAOYSA-N 459.352 0.878 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844263503 LFJTWYQYRKAHLN-CVEARBPZSA-N 484.557 0.972 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1847012685 DYXBOJVKJFNKTQ-FQEVSTJZSA-N 482.516 0.389 50 20 JCGD CC(C)[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1)N1Cc2ccccc2C1=O 1847790937 MOSJYYGJPWTNNK-VABKMULXSA-N 475.354 0.862 50 20 JCGD CCc1ccc(C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)cc1 14893213 SSPHUKNDRZPSFN-SFHVURJKSA-N 467.569 0.792 50 20 JCGD CN(CC(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12)S(=O)(=O)c1ccc(Br)cc1 107545819 MOSSLOYLSJQMFC-UHFFFAOYSA-N 494.327 0.767 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1cc(Br)c[nH]1 726292836 IPVPCMDYLGJXBP-UHFFFAOYSA-N 473.305 0.678 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCc2cccc(C(=O)NCCN(C)C)c2)c2ccccc2c1=O 727604176 REEWEFULPAQDRW-UHFFFAOYSA-N 479.541 0.852 50 20 JCGD C[C@H](C(=O)N([C@H]1CCS(=O)(=O)C1)N(C)C)N1C(=O)c2ccc(Br)cc2C1=O 728178161 CJGUNYFVKICTAH-PWSUYJOCSA-N 458.334 0.926 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2C[C@H](O)CN2C(=O)c2ccc(F)cc2)n1 728730625 SRRXPWOXJGYANP-GJZGRUSLSA-N 464.475 0.099 50 20 JCGD CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728955032 CYIXGQDQKWXGIM-UHFFFAOYSA-N 468.562 0.515 50 20 JCGD O=C(NNC(=O)N1CCCN(S(=O)(=O)c2ccccc2)CC1)C1CCN(c2ncccn2)CC1 728959872 RIGFODHLNWAVQB-UHFFFAOYSA-N 487.586 0.830 50 20 JCGD CCN(CC)C(=O)CN1CCCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 728961814 QNSQETXWYAZZNG-UHFFFAOYSA-N 460.583 0.310 50 20 JCGD CC(=O)[C@H]1CC(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)=NN1c1ccccc1 751290485 KYYRZTJJCLNLHS-HXUWFJFHSA-N 471.539 0.987 50 20 JCGD Cc1c(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)CC2)cc(C#N)n1C 914762795 XPAJGGIOYOCKOS-LBRXUCBSSA-N 460.560 0.610 50 20 JCGD CC(=NNC(=O)c1cccc(S(C)(=O)=O)c1)c1ccc(S(=O)(=O)NCC(=O)O)cc1 915052707 XBGSULANRPMIBG-UHFFFAOYSA-N 453.498 0.607 50 20 JCGD CN(CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(=O)OC(C)(C)C 916580196 YHMMIPYMIPVAFM-UHFFFAOYSA-N 499.590 0.909 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CS(=O)(=O)C3)C1 1777714967 KLMVNMZNXKSBAW-ZBQZNYHESA-N 458.968 0.983 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091506 IPPIHWCIQMSTFP-ZVJVYNAXSA-N 474.562 0.549 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(Br)cn3)CCO2)C1 1779032570 UEOBOUFBGSFTOE-HXUWFJFHSA-N 489.330 0.600 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccccc4)[nH]n3)CCO2)C1 1779032694 RUUGOAIMVLUWNQ-DEOSSOPVSA-N 475.509 0.833 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(Cl)c2nncn2c1 1779313737 LDMNKMVRYFDYLR-AUSIDOKSSA-N 497.748 0.504 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ncccn3n1)C2 1779372402 HFZLZSCBIDABLO-WZONZLPQSA-N 478.513 0.169 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cscn1)C2 1779373474 UXZDEWRMDXCKKU-DYESRHJHSA-N 458.544 0.512 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)s1 1780899263 ULRHENILKRZCTG-OAQYLSRUSA-N 466.560 0.280 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)Cn1ccccc1=O)CCO2)NC(=O)NCc1ccccc1 1780970607 YDEMSHKRKWEYMO-VWLOTQADSA-N 496.568 0.024 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2n1 1782578081 HVGSYOTZXLWREW-QHCPKHFHSA-N 456.547 0.768 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)Cn3ccncc3=O)CCO2)C1 1782866950 MIPCFNSSGFAWQS-AKMURLTLSA-N 469.448 0.959 50 20 JCGD CCC1(C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)COC1 1782949417 BIKQAUSFAHWULA-XMMPIXPASA-N 473.574 0.589 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(OC)c1 1782992617 PZVSEDXEVGFKMY-RUZDIDTESA-N 482.342 0.460 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1)C(=O)C(=O)O 1783022940 RIELPRDBYCJEGV-IIBYNOLFSA-N 496.358 0.366 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCCC(=O)Nc3ccccc3)CCO2)C1 1783933363 WBQQPJYOUYEKOA-DEOSSOPVSA-N 473.574 0.998 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(S(C)(=O)=O)c(F)c1)CCO2 1783937067 FMPPFNOSZIWRQA-NRFANRHFSA-N 484.550 0.046 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784094734 PWTOJHHCIKVHRR-RFZNHBKKSA-N 467.950 0.881 50 20 JCGD CC(=O)NC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1784527569 HKPCQMDWODNSQS-RNGGJZMBSA-N 460.535 0.015 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)C3CC(=O)C3)C2)C1)NC(=O)NCc1ccccc1 1785406094 IJKAEBPSDPELBZ-QHCPKHFHSA-N 457.531 0.142 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C/N=C/c3ccco3)C[C@@H]21 1787508221 AFTSZUFJPYFQFO-RDHGHRJDSA-N 468.514 0.812 50 20 JCGD Cn1ccc2cccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)c21 1788024556 BLWSRLPQWKCQTE-NYVOZVTQSA-N 461.327 0.765 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c2cc(O)ccc2n1 1788281537 YMIOBGXRSVSJML-OWSXEPHWSA-N 489.337 0.836 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(=C/c3ccco3)NC(C)=O)[C@H]2C1 1790180872 PEYAXUDGWLTXDA-XYQPEQFWSA-N 453.923 0.990 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790726101 DTBYWNDRPYTHRD-BWPZPKMVSA-N 468.334 0.978 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)C1CN(C(=O)OCc2ccccc2)C1 1790784798 ZQSUYEIIKQZYJH-LEAZDLGRSA-N 479.961 0.834 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccc(O)c3)[C@H]2C1 1791400785 XJUYRXKBTMKKPD-NDXORKPFSA-N 467.526 0.617 50 20 JCGD C[S@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793105873 FMIZQYPJESPQBC-KCLRRUQNSA-N 480.027 0.886 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)[C@H](O)CCl)C4)c2C1 1797956036 SVULDTBYCBSUQM-HLPPOEQASA-N 482.969 0.880 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@@H]1C[C@H](F)CN1C(=O)OCc1ccccc1 1799385620 OMLORWRGWCMNID-XSEPRYCASA-N 497.951 0.925 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(OC)cc1[N+](=O)[O-] 1799404263 KJSGVCXJRVRQFG-MVWRLGRASA-N 455.895 0.989 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC)C2 1800971239 RLKPPXPXWPLYNU-IFTGGNMHSA-N 477.986 0.758 50 20 JCGD CN1CCCC[C@H]1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803172871 SUJCMZNEZXMJGT-QMMLZNLJSA-N 465.558 0.884 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(=O)c1ccccc1 1806236256 NOWDGHJZJSMXCZ-RBBKRZOGSA-N 457.295 0.964 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807361813 JLJNESZYTGPQDH-AZUAARDMSA-N 462.319 0.567 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807366085 SCOBOTUGZXZPID-MAUKXSAKSA-N 466.332 0.288 50 20 JCGD Cc1nc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c(=O)[nH]c1C 1807369435 JTTLJGOHXXNXPK-NQIIRXRSSA-N 475.314 0.095 50 20 JCGD CC(=O)c1cc(C(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)n[nH]1 1807930347 VHXDGMINCVIZCX-UHFFFAOYSA-N 453.503 0.769 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnn2ncccc12 1808174218 QKBKKIGZRGTRDV-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H](O)Cc3ccccc3)CC2)C1 1809980617 YCMXMJLSRRLLRW-JOCHJYFZSA-N 450.344 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc3c(c2)CNC3=O)[C@@H]1c1cccnc1 1810037276 BKORPBVDSJUQIB-VGSWGCGISA-N 499.531 0.957 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810305673 OVTKWVWGIIGNOH-DYESRHJHSA-N 480.525 0.909 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccc(-n2cncn2)c1 1811824700 VJXKMHWOCHRJLL-ZJSXRUAMSA-N 496.336 0.976 50 20 JCGD O=C(CCc1ccc(O)nn1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812324553 QQMYEWVMHPIWBH-MBSDFSHPSA-N 475.314 0.209 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)CN2CCN(C(C)=O)CC2)[C@H]1c1cccnc1 1813031511 WDLNICSALSJZGA-ZJOUEHCJSA-N 465.982 0.505 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1 1814762072 LFYHTHWEVBEFKW-RKDXNWHRSA-N 469.298 0.811 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337877 XDYNUYSWWHSLCF-CZUORRHYSA-N 453.333 0.582 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ncn(-c3ccccc3)n1)CC2)c1cccc(B(O)O)c1 1815354840 UELPIWZZFCSDTH-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCCC3)CC2)c1cccc(B(O)O)c1 1815356702 MMBIWPRKTMMUPM-OAHLLOKOSA-N 465.344 0.895 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361956 WFACXHLAUJIOPJ-XJKSGUPXSA-N 453.333 0.582 50 20 JCGD C[C@](Cl)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816674191 NSCPWOJUIRNTHO-QZTNRIJFSA-N 471.330 0.731 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817473985 JQAFFTCJMDTNPM-SUMWQHHRSA-N 462.337 0.076 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817474881 GZNBTILAUIYREX-KRWDZBQOSA-N 456.308 0.985 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476268 NVPQIKKSEJKDKA-IFXJQAMLSA-N 491.317 0.004 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CC(=O)NC2=O)[nH]n1 1818111350 FMHJPGNAYRJEJZ-HURLIOHXSA-N 483.489 0.088 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=N/O[C@H]1CCCCO1)CC2 1819797439 BUAGJHIIUVUNCA-FUYLHOASSA-N 487.542 0.896 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1822416866 RTYYEUXFVUZTMM-OAHLLOKOSA-N 450.544 0.148 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](COC(C)=O)OC(C)=O)CC2 1826000586 WZMADWPLEARVLG-OBJOEFQTSA-N 461.924 0.804 50 20 JCGD Cn1nncc1C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828641995 QMMDVSIJQMEYJC-XMSQKQJNSA-N 490.948 0.481 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)CC1 1828967193 MLUQODLTNSGGLM-SBSGUARVSA-N 488.589 0.391 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])o1)CCO2 1829484611 KYZOAVHFQLKENZ-KURUZVKSSA-N 488.457 0.392 50 20 JCGD O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830735595 IWOSXHUPSJLPJX-HNAYVOBHSA-N 467.866 0.141 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCOC3=O)CCO2)C1 1831022936 BELRHGRPNYMFDD-VAPFXODJSA-N 490.463 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)c1ccccc1)CCO2 1832227488 XQXMKLPXDNDMTG-XXBNENTESA-N 471.489 0.466 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832881920 WANMVPAGGDOJGY-KUHUBIRLSA-N 471.352 0.374 50 20 JCGD CC1CCN(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1834799890 LBACIGWGBXNOOX-UHFFFAOYSA-N 470.423 0.284 50 20 JCGD Cc1cnn(CC(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1834893902 CMGQNLSCVLYOEP-UHFFFAOYSA-N 468.562 0.075 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CS(=O)(=O)N3CCCC3)CC2)CC1 1835116713 YKOTZZVAAFOYPW-GOSISDBHSA-N 479.043 0.237 50 20 JCGD O=C(Cc1ccc(F)cc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927133 IBUJXJJMURQZCM-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD O=C(Cc1ccccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935335 AZTVIVRCMRUSMV-QHCPKHFHSA-N 472.734 0.333 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1836258153 UUQSHIMLLHAFSZ-QZTJIDSGSA-N 495.385 0.144 50 20 JCGD CN1CC(C(=O)N2CCC(N3CCC(NC(=O)CN(C)NC(=O)NCc4ccccc4)CC3)CC2)C1 1836344135 ZEHNBLHDLKUDHA-UHFFFAOYSA-N 499.660 0.466 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1 1837327447 RESACDODLIVAIA-TVIVXCNVSA-N 463.918 0.732 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1 1837455742 FTRDALQAYNTFEG-NRFANRHFSA-N 474.905 0.117 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1837710290 SUXWNAQGEIACEX-QRQCRPRQSA-N 494.621 0.301 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C(C)(C)C)n[nH]1)CCO2 1837990923 GLYJUOTVKZXWTG-RGXRWQALSA-N 499.572 0.911 50 20 JCGD O=C(c1cccc(-c2cnccn2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838589632 XLAOTMONTMPSJV-UGKGYDQZSA-N 460.918 0.813 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1839154910 BRBYNHKLLMFITC-CVEARBPZSA-N 452.364 0.590 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202551 JIECONGLEXWKEQ-RDJZCZTQSA-N 461.288 0.262 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1840031975 JFZNEKJRQVFBDK-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185235 OABRWNMMAFAERW-HSZRJFAPSA-N 490.536 0.225 50 20 JCGD CCOc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1O 1840185390 PTENTLLAVFDBSZ-QHCPKHFHSA-N 478.546 0.234 50 20 JCGD Cn1c(=O)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)nc2ccccc21 1843743545 BAHSAYDPXXJZKZ-UHFFFAOYSA-N 461.482 0.063 50 20 JCGD O=C([C@H](O)N1CCOCC1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1 1845941600 HKDRLDLTPVLTMS-MJGOQNOKSA-N 466.376 0.847 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O 9930940 QLOKUISPENUWHN-MRXNPFEDSA-N 455.492 0.721 50 20 JCGD O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 15795315 VRELFVKTNNLTHP-KRWDZBQOSA-N 465.459 0.448 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccc(F)cc2)C1)c1ccc(-n2cnnn2)cc1 23787648 DTWHTYZIWWBROX-OAHLLOKOSA-N 473.490 0.663 50 20 JCGD COc1cc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cc(OC)c1OC 726710899 XWXBTZLDGCBMIO-UHFFFAOYSA-N 487.517 0.185 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)c1 728206652 ZCGJWWXHZCLTTI-UHFFFAOYSA-N 453.546 0.634 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1 728261016 NGMLXWXFCGCLLY-NSHDSACASA-N 488.009 0.115 50 20 JCGD O=C(COC(=O)CNC(=O)c1cc(-c2ccccc2)on1)NNC(=O)[C@H]1COc2ccccc2O1 728340634 KWJNXTDNOKFJRK-LJQANCHMSA-N 480.433 0.602 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])n1 731103160 OIFXDKPCRJRWLD-UHFFFAOYSA-N 469.863 0.676 50 20 JCGD O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1C1CC1)NNC(=O)c1nnc(O)c2ccccc12 744305618 GPCBAFPRBSXMOF-LJQANCHMSA-N 460.450 0.572 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1 749475099 AIUUBPYVJWKSRW-JSGCOSHPSA-N 458.334 0.636 50 20 JCGD N#Cc1ccc(CC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 749785254 IDQZKORLQSGSQI-UHFFFAOYSA-N 456.524 0.902 50 20 JCGD O=C(COC(=O)CCN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)[C@@H]1COc2ccccc2O1 784364330 DAOFFHYDGCNPGV-CPUCHLNUSA-N 459.455 0.082 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)C2CCN(C3=NS(=O)(=O)c4ccccc43)CC2)C[C@@H](C)O1 912918896 GFXJVOWLEUSTAO-IYBDPMFKSA-N 477.587 0.494 50 20 JCGD O=C(NNC(=O)c1cc(-c2cccnc2)on1)c1cccc(S(=O)(=O)N2CCOCC2)c1 915802231 NCNFNZNSPXRPMG-UHFFFAOYSA-N 457.468 0.832 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(=O)Nc2ccc(F)c(F)c2)cc1 915893895 GJZPYDOAEYXUQM-UHFFFAOYSA-N 469.470 0.863 50 20 JCGD CC(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1CCOCC1 916254325 UYKZBWFMCZRPMX-IBGZPJMESA-N 467.592 0.772 50 20 JCGD O=C(NC[C@]1(N2CCOCC2)CCSC1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916637238 WDHFFYMMNOGJEU-OAQYLSRUSA-N 497.643 0.623 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C(/C)C1CC1)c(=O)n2Cc1ccccc1 918016950 ORLKUOXVXNOMBT-VBKFSLOCSA-N 480.525 0.558 50 20 JCGD CC(=O)N1C[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)Oc2ccccc21 919345166 PVPICFONGLNMDV-FQEVSTJZSA-N 488.522 0.283 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1c[nH]c3ncccc13)c(=O)n2Cc1ccccc1 919702825 GPYICYHFXHEGNH-UHFFFAOYSA-N 486.492 0.765 50 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453.329 0.816 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C[C@@H]21 1788638746 GFSQSJNFPLZBHT-ZAHIEGGZSA-N 467.346 0.697 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)[C@H]2C1 1790668148 SEXYNVJXKXCMKS-WLNPFYQQSA-N 480.005 0.855 50 20 JCGD COc1ccc(COCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1791382951 OJDIBXISRGTXDS-VJBMBRPKSA-N 482.342 0.185 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CN(C(=O)OC(C)(C)C)CCO3)[C@H]2C1 1792343932 NBROMTCJDAVYIB-KFGODFMUSA-N 489.997 0.856 50 20 JCGD O=C1Nc2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)cc2[C@@H]1C1CCOCC1 1792981909 ZAHHEEGYLQUQHU-LPKWFMKBSA-N 491.972 0.952 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)cc2)CC1 1792983062 APIPXULICQZLKK-YHELAOLJSA-N 464.994 0.631 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1794249785 VFLAXIZZDGMURX-YIYPIFLZSA-N 495.378 0.103 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)n(C)n1)NC(=O)NCc1ccccc1 1794629891 UPFDFTIMNQIPAG-BCDXTJNWSA-N 469.546 0.724 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnccc1C(F)(F)F 1794717903 LILMIRJBWVNISA-ZSBFGKGUSA-N 463.221 0.297 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2ccc(Cl)cc2nn1 1796244259 OPPWFARZRQWIFP-VPTLXERWSA-N 480.717 0.480 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CN)c1ccccc1)C2 1796440331 LKGJETYUJNFIDF-QQNIIYITSA-N 466.542 0.453 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)N1CCN(C)CC1)C2 1796892759 PJKXUSIEYLTDRD-YCLWYYOWSA-N 457.579 0.395 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1799812216 DJBAJMXCDTZFNK-VJICWTENSA-N 467.306 0.576 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)COc1ccc(O)nn1)C2)NC(=O)NCc1ccccc1 1799869304 MBPJMPICYYIGEO-REPLKXPHSA-N 497.556 0.545 50 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O=C(NC[C@@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374962 LTOHTQWQHCGQIJ-MAUKXSAKSA-N 479.220 0.187 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccncc2O)[C@@H]1c1cccnc1 1810665039 SWXCDLMOSYZQHD-YWZLYKJASA-N 461.482 0.814 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc([N+](=O)[O-])[nH]1 1811612817 UUTBXWWOXFJOIV-OXJNMPFZSA-N 463.259 0.631 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2nn[nH]c2c1 1812298294 PBEATBLHYXGAOI-PGRDOPGGSA-N 470.298 0.666 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1 1812388930 UWKDSENOYYEUTC-XNRPHZJLSA-N 469.336 0.661 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CNC(=O)OC(C)(C)C)[C@@H]1c1cccnc1 1812811951 JXIVCAHORXSYFQ-UTKZUKDTSA-N 476.578 0.985 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1cncn1 1813400809 WBHLRAZJUVWFEC-ALKREAHSSA-N 463.502 0.252 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1)NC(=O)NCc1ccccc1 1814407994 AREGTOYATLQGRB-DOTOQJQBSA-N 499.597 0.680 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1 1814795244 IVDNQEFLMJVIMA-RDBSUJKOSA-N 459.931 0.887 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1815228980 PZFPWHFDFMWQLS-MLGOLLRUSA-N 477.547 0.395 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCNC(=O)C3)sc2C1 1826218648 DAYHIRLDUUGXMG-JATIBWBUSA-N 471.543 0.715 50 20 JCGD CN1CCCn2nc(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)CC3)cc2C1 1827060468 KKKBWLDBVOGVTF-XMMPIXPASA-N 493.417 0.946 50 20 JCGD O=C(c1ccnc(Br)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731481 LUNZJHVXMNFJNX-CXAGYDPISA-N 462.728 0.514 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733630 QJIMXEPUFLCBOQ-UGKGYDQZSA-N 465.909 0.973 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1832138105 IRWWRQWAUWEZDF-DHIUTWEWSA-N 495.389 0.070 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnccn3)C2)C1 1832549870 ULWZAUTUQIYHHA-HTAPYJJXSA-N 497.980 0.608 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832729853 NYSLGYVJCOBVBX-WOJBJXKFSA-N 473.357 0.504 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H]3COc4ccccc4O3)CC2)CC1 1833716099 IYDBRVWOLHBEHT-JOCHJYFZSA-N 487.601 0.771 50 20 JCGD Cn1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)n1 1833883889 UELPRBSCGAXSAF-DYESRHJHSA-N 492.374 0.891 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(=O)nc4cccnn34)CC2)CC1)[C@@H](F)Cl 1835084119 MPPVOGTZIPBHQV-GOSISDBHSA-N 450.902 0.809 50 20 JCGD Cc1nc2sccn2c1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835624231 KNIQRFLSKMSMBB-UHFFFAOYSA-N 495.414 0.883 50 20 JCGD O=C(CCc1ccccc1F)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939802 IXGJLBMLTSDDNZ-XMMPIXPASA-N 470.306 0.208 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1836258150 UUQSHIMLLHAFSZ-MSOLQXFVSA-N 495.385 0.144 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1 1836850286 KNEIKMWHAPYVSA-DNVCBOLYSA-N 466.336 0.973 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)no1 1837546355 WYOFPHAAAHOMRP-ORAYPTAESA-N 487.351 0.200 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccc(F)cc1 1839037253 DQBZUYHJWYVVKE-WFXMLNOXSA-N 471.913 0.059 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)NC(=O)c1ccc(F)cc1)CCO2 1839037424 LBSAEOMCOBQKBR-FXCLAUTBSA-N 485.940 0.654 50 20 JCGD O=C(c1[nH]nc2ncccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198758 ARZBDMDRSSOQAX-SUMWQHHRSA-N 456.272 0.718 50 20 JCGD O=C1CCCCN1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202562 JQYFJYJOCHJGDI-NVXWUHKLSA-N 450.305 0.146 50 20 JCGD C[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1840028268 SABHCZFTVSPOCK-VPWXQRGCSA-N 455.349 0.830 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840186362 GLMLZWZZUCXSNO-JOCHJYFZSA-N 498.363 0.862 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)ccn1 1844264699 YCUALZDLYQBNAS-UHFFFAOYSA-N 452.471 0.388 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cnc(N(C)C)o1)C2)NC(=O)NCc1ccccc1 1845038547 RBYZSMMXVNNMMO-UHFFFAOYSA-N 469.546 0.904 50 20 JCGD COc1ccc(N2C[C@H](C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2=O)c(OC)c1 12801873 VVYAPDYMPXPUNS-CYBMUJFWSA-N 475.527 0.811 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCn1cnc2c1c(=O)n(C)c(=O)n2C 16204531 YJVIRZFSNJCTBZ-LLVKDONJSA-N 493.318 0.201 50 20 JCGD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1 22023577 XSMKFIKESFPRNN-UHFFFAOYSA-N 450.425 0.654 50 20 JCGD CN(C)CCNC(=O)c1cccc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 727480438 ZXCLWISMYWKSHW-UHFFFAOYSA-N 475.575 0.415 50 20 JCGD N#CCCCS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 728339963 GSHHWLDHWDIQJZ-LJQANCHMSA-N 487.490 0.908 50 20 JCGD CSCC[C@H](NC(=O)c1ccc(Cl)cc1Cl)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 729277291 YKWXFYSYCXKJRA-RNCFNFMXSA-N 485.415 0.930 50 20 JCGD Cn1[nH]c(Br)c2c(=NCCNC(=O)NNC(=O)c3cccc(C#N)c3)ncnc1-2 729624567 ZOZKXKCUHNETDT-UHFFFAOYSA-N 458.280 0.427 50 20 JCGD COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccccc2O)CC1 730782337 MWDNRLUSFHCEOJ-UHFFFAOYSA-N 491.522 0.806 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl 745992894 LYLWSSXHSFKYSX-UHFFFAOYSA-N 467.331 0.701 50 20 JCGD C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 747725864 RVJMMWNUENATTM-GVDBMIGSSA-N 499.659 0.770 50 20 JCGD COc1cc(C(=O)NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)ccc1OCCC(C)C 749354153 SWEWQTOSJQUQLF-UHFFFAOYSA-N 485.607 0.641 50 20 JCGD O=C(NNC(=O)c1nnn(-c2ccccc2F)c1C(F)(F)F)N[C@H]1CCS(=O)(=O)C1 751361055 JBSCQCQTAZCGDQ-QMMMGPOBSA-N 450.374 0.556 50 20 JCGD Cn1ccnc1[C@](O)(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(F)(F)F 818650046 UGTPNKDIBPFRPZ-GOSISDBHSA-N 489.476 0.806 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)cc1 913587982 OFSSMEKMQSVVCX-UHFFFAOYSA-N 485.522 0.920 50 20 JCGD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 917725408 NZMRJPLGYTUPKQ-UHFFFAOYSA-N 481.961 0.323 50 20 JCGD C[C@@H](Sc1nnnn1C1CC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 918399435 PHIZRSPVQRQRMW-GFCCVEGCSA-N 465.561 0.734 50 20 JCGD CN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c1 919883096 ATKSCASSADNHIX-HNNXBMFYSA-N 466.541 0.643 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)CCC3)CC1)N[C@@H]1CCS(=O)(=O)C1 919883230 BXZAUYUDZIVENR-QGZVFWFLSA-N 484.600 0.094 50 20 JCGD CC(C)(C)OC(=O)N1CCn2ncc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2C1 1778375897 DYWFTDWRKNRLCK-VGSWGCGISA-N 497.980 0.677 50 20 JCGD Cn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c2c1CCC2 1778669676 XGUFOHAYPSWTRE-HYBUGGRVSA-N 466.347 0.030 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccnc1OCC1CC1)CCO2 1779029327 VSNHLVRUZDNECN-XMMPIXPASA-N 480.525 0.626 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)c4ccccc4o3)CCO2)C1 1779029730 XQUREFFIPIXVGK-DEOSSOPVSA-N 477.477 0.549 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779295110 YMDYZUQFPOJETC-HRAATJIYSA-N 473.643 0.944 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371340 QDDIEQLMOUWBNW-WZONZLPQSA-N 469.546 0.477 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1781179642 YZUOOXJRYJUPHY-VWLOTQADSA-N 477.301 0.740 50 20 JCGD COc1cc(C)c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1OC 1781890251 HCMYQSVLUKNQQT-XMMPIXPASA-N 468.315 0.449 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)n3ccnn3)C2)C1 1782759790 KLCOQTGNSBWQSI-SZNDQCEHSA-N 472.458 0.816 50 20 JCGD N#Cc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1783912198 GGYYXMZISGHAQA-PMVMPFDFSA-N 461.327 0.464 50 20 JCGD O=C(/C=C/c1ccc([N+](=O)[O-])o1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784218895 AKZBJVSVMHMCEY-DEEVVMORSA-N 469.259 0.174 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1784348297 DDYQDZQFTNWMHH-QNFRBNBNSA-N 467.530 0.479 50 20 JCGD CC(=O)N(C)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1784933625 WMFJRZFPUGZBCT-XSLAGTTESA-N 489.013 0.967 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](Cl)COC)CCO2)C1 1785516586 OYUQDYHPCNQTIH-PDSXEYIOSA-N 491.969 0.527 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786405861 GOBVZKQXYUMUPN-DVBSWERSSA-N 468.352 0.885 50 20 JCGD N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc(Cl)c1 1786880439 DKGWUVXDSDKGCE-LRGNLBRXSA-N 471.750 0.313 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1OC 1786981101 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456.503 0.978 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)nc(O)c1)C2)NC(=O)NCc1ccccc1 1799094980 NSGBXEFSDFPGQJ-OPMZPASUSA-N 498.540 0.042 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2)[C@@H](F)Br 1799342030 DENYQJMIUWSZNP-GTYSZEQSSA-N 496.333 0.882 50 20 JCGD COCCOCCOCCOCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](Cl)COC 1802284543 LPMAFTPYIVORGJ-MHORFTMASA-N 450.960 0.575 50 20 JCGD CC(=O)N(C)CCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1804070326 STKFOBNTOQFAMS-UTKZUKDTSA-N 467.530 0.268 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1804577407 MCXYHUURAJAZBX-OFNKIYASSA-N 461.331 0.595 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n[nH]1 1805254046 FQLAESTVPDWSPS-UWJYYQICSA-N 461.287 0.321 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1 1806507939 XBMFTQDNILIGIU-UHFFFAOYSA-N 461.331 0.656 50 20 JCGD Cc1nc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(=O)[nH]c1C 1807362586 LFLOUKCCHASNIT-NQIIRXRSSA-N 475.314 0.095 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1(O)CCC1 1807365324 NGASYEFGNLCUQV-PBEJRMEISA-N 451.332 0.632 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)ccn1 1807375080 LHEPZPTVXFLDKS-NFBKMPQASA-N 487.325 0.748 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1 1808134587 HYBJSIDMTICSSQ-QVKFZJNVSA-N 485.508 0.985 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1 1808414885 OEBHUQBNGBJDTH-HBSVRTSBSA-N 491.508 0.934 50 20 JCGD CN1N=C(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)CCC1=O 1815619562 BFHRGAHEXYPZSR-KRWDZBQOSA-N 452.280 0.004 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3ccnn3)sc2C1 1815775295 YARQVCLBWMDGFI-BTQGWNRHSA-N 455.504 0.481 50 20 JCGD Cc1c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cn2[nH]cnc(=O)c12 1821220763 HOQTUALHEWQYDY-AWEZNQCLSA-N 492.326 0.007 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)CCC(N)=O)sc2C1)NC(=O)NCc1ccccc1 1825183349 BNLQZORBARTMHH-HNNXBMFYSA-N 487.586 0.667 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3c(n1)OCCO3)CC2 1826085325 MVRYOEWHTLLXCY-GFCCVEGCSA-N 474.543 0.908 50 20 JCGD CSCC[C@@H](O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1826130239 BYHGOJZJUVSQJX-IINYFYTJSA-N 464.573 0.481 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525489 RYJFNHBICGEVEN-VLIAUNLRSA-N 484.347 0.533 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)N1C[C@H]2C[C@@H]2C1 1828809506 NPNWRFOLCHAJJH-XMXZMMKCSA-N 453.392 0.940 50 20 JCGD Cn1nc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)cc1O 1828925440 LTQWWWJJBCCZOU-GOSISDBHSA-N 455.519 0.671 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1831645954 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C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1836398572 NIBIDVGKDXTKHY-LJQANCHMSA-N 485.376 0.234 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1837375236 OWHVGALSGKROQL-HBUWYVDXSA-N 463.373 0.181 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4C3)C2)C1 1837460976 MHENPVISDKBBHF-IBVKSMDESA-N 493.564 0.560 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=S)NC)CCO2)C1 1837466994 ARZORLCJYAWABI-CXAGYDPISA-N 465.414 0.100 50 20 JCGD O=C(c1ncccc1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838141072 GPABAUCNXKVFEG-CXAGYDPISA-N 451.829 0.770 50 20 JCGD CCOc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn1 1839198100 SYMIHAZMIRQKPZ-PBHICJAKSA-N 461.288 0.636 50 20 JCGD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839203457 LRMKCOOOLDAWGC-ULIAPGIUSA-N 489.294 0.964 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)CCO2 1839396097 WWLNRXINNVXRIA-VWLOTQADSA-N 490.325 0.140 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1O 1839472253 KEZMITJDENLOSO-PXNSSMCTSA-N 455.895 0.020 50 20 JCGD O=C(c1cc2cccnc2nc1O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839513068 VWLFOGCOKYQFNA-MGPUTAFESA-N 450.879 0.005 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)c2n1 1839625613 CFOMPNLBCUZZPJ-DYESRHJHSA-N 450.923 0.621 50 20 JCGD C[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)Oc1ccccc1 1839746452 OFDIERLQCLAONP-CLOONOSVSA-N 482.342 0.294 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2 1840156670 SBIACDQDBUJGSL-XFQAVAEZSA-N 477.986 1.000 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncsc4[nH]3)C2)C1 1840185862 UCHYJRJJEIXRHR-HXUWFJFHSA-N 464.548 0.067 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)nc2N1 1840187632 OHTBGTAUUYWEEW-LJQANCHMSA-N 457.314 0.840 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccccc1C(=O)OCCO)C2 1843416486 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LFZHCBXRVYRGOP-UHFFFAOYSA-N 467.525 0.544 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cccnc3Cl)CC2)C[C@@H](C)O1 818030004 YLVAQPPBYDCVTO-HUUCEWRRSA-N 488.010 0.782 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 914831223 GFRGFNKVQWWNME-SCRDCRAPSA-N 488.360 0.399 50 20 JCGD CC(C)N1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 915896813 CMRJGRIYRYQFPV-UHFFFAOYSA-N 453.565 0.524 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)NC1CCN(C(=O)C2CC2)CC1 916260901 NYZNZSQMSCUYEC-UHFFFAOYSA-N 463.560 0.816 50 20 JCGD CC(=NNC(=O)c1sc(N2CCOCC2)nc1C)c1ccc(S(=O)(=O)NCC(=O)O)cc1 916339896 YDLANYLZQIYNJE-UHFFFAOYSA-N 481.556 0.805 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCCNC(=O)c1ccc(F)cc1 919916892 YLYQKPCCGAOVPW-UHFFFAOYSA-N 450.496 0.801 50 20 JCGD CC(C)CN1C(=O)/C(=C/NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C(=O)NC1=S 920978962 XWIIGJLYFFXVTH-LFIBNONCSA-N 479.584 0.489 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc[nH]c2[N+](=O)[O-])C1 1778060094 MGLWWUWHLPPAOD-FXADWPNGSA-N 486.489 0.579 50 20 JCGD CCc1noc(C)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779775042 HMTQFPGMOZVFAO-AUSIDOKSSA-N 455.320 0.667 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1780858759 QPCAUUWOAOCTPE-QFIPXVFZSA-N 458.707 0.786 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1ccnn1 1780967947 FKIHZBNKVYPBKJ-JPYJTQIMSA-N 484.561 0.015 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1781232487 VDAOSRXOYANCIQ-RTBURBONSA-N 454.314 0.769 50 20 JCGD C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[S@](=O)c1ccccc1 1781499187 HOCIUOAGMVGBIF-JZXWRMKNSA-N 498.410 0.690 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214074 AQNGYBLNDZFSEI-PMAPCBKXSA-N 460.579 0.769 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 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CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1824462340 RKNKFVBTHNGOGG-SJLPKXTDSA-N 473.640 0.307 50 20 JCGD CN1CCN(C2(C(=O)N[C@H]3CCc4nc(NC(=O)CCC(=O)NN(C)C)sc4C3)CC2)CC1 1826088299 CUSOSJAVGWBUCK-HNNXBMFYSA-N 477.635 0.208 50 20 JCGD O=C(c1cnn2ncccc12)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059469 QZIPTEMQJDGFRY-NRFANRHFSA-N 461.331 0.956 50 20 JCGD CNC(=S)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828928650 NLBTYSYBIAENFZ-LJQANCHMSA-N 460.409 0.084 50 20 JCGD O=C(Cn1cnnn1)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829056775 PXEXALYXMLGQSQ-PXNSSMCTSA-N 479.900 0.660 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1829093713 NMXBKGNXKILPKC-BEFAXECRSA-N 456.547 0.609 50 20 JCGD NC(=O)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829303179 IKVZIIIVMXFQFP-VGSWGCGISA-N 480.949 0.304 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)C1CC1 1830066033 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O=C(C1CCN(Cc2ccccn2)CC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833108896 PTHMWDSEDYLFKV-NZQKXSOJSA-N 480.993 0.350 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)n1ccnc1 1833376327 ZJCIBRDMTQDSHY-KRWDZBQOSA-N 453.352 0.009 50 20 JCGD COc1cncc(CCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1833807582 LWRVLUSEILYDTB-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD Cc1cncc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834228458 JGQZZJKJKSSUNY-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD CC(C)N1CCC(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1834797266 ARDKPYVOPLTGQF-UHFFFAOYSA-N 484.450 0.672 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccn1 1834800453 HMSRSJLDLYPSCT-SFHVURJKSA-N 464.375 0.750 50 20 JCGD C=C(Oc1ccccc1O)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835116109 TYCWYGSEDFKELA-UHFFFAOYSA-N 493.369 0.850 50 20 JCGD COC(=O)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cn1 1835167612 CNCPGPBMIBUNBU-UHFFFAOYSA-N 488.589 0.426 50 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AXBPJGBDRVGVAD-YLRDJVGTSA-N 458.353 0.475 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](C)Br)CCO3)C2)C1 1840030420 LNWGAYFITUTGEH-ZTENYAIWSA-N 461.353 0.816 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1840034326 HXBLBWTZPMCSRB-YCRPNKLZSA-N 499.358 0.689 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1 1840155062 OQGYPLCOKYGZGA-VGSWGCGISA-N 465.934 0.895 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840182946 XGFIGCGKPMRIEJ-DEOSSOPVSA-N 476.574 0.512 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(-n2nccn2)c1 1840185234 HKKROCKRLASCSS-XMMPIXPASA-N 499.572 0.019 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](C)(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843011361 VJZAMOJDQNLVFQ-HSZRJFAPSA-N 471.363 0.831 50 20 JCGD Cc1nccc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)n1 1845038640 BXZSJJHZZUBKQY-UHFFFAOYSA-N 451.531 0.948 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1[C@@H]3C[C@H](O)[C@H](C3)N1C(=O)OC(C)(C)C)C2 1846386066 ZMCGLPFWYSNTQK-BOSXTWCSSA-N 493.605 0.322 50 20 JCGD C[S@@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847442442 GLOVLTGWVXEQSZ-RYAKEDGJSA-N 466.000 0.450 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C 1847502106 LHVPDQBKOZOGFT-RFGFWPKPSA-N 475.384 0.988 50 20 JCGD CCN(CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C1CC1 726281125 AGNLQQNQVYFNCA-UHFFFAOYSA-N 467.592 0.455 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727162676 RIUIVWQMEYVPLC-UHFFFAOYSA-N 465.264 0.128 50 20 JCGD COc1ccc(Br)c(C(=O)NNS(=O)(=O)c2ccc(S(N)(=O)=O)cc2)c1 728508702 XMUMUVRILASWQF-UHFFFAOYSA-N 464.319 0.728 50 20 JCGD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N1CCN(C(=O)NNC(=O)Cc2cccnc2)CC1 728957187 LUHCLNWCTPJWPB-UHFFFAOYSA-N 495.583 0.083 50 20 JCGD Cc1nc2cc(O)nn2c(C)c1CC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 729533557 BIFFANKBJCUXDT-UHFFFAOYSA-N 473.559 0.674 50 20 JCGD Cc1ccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1C 778144861 IKCWFHGUFLVINY-IBGZPJMESA-N 491.522 0.502 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2cccnc2)c2ccccc2c1=O 821680115 BZHZDRRXDVSNTJ-UHFFFAOYSA-N 472.527 0.721 50 20 JCGD O=C(c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1)N1CC[C@H](B(O)O)C1 864233918 NCUUFTIAAMOBKN-INIZCTEOSA-N 451.354 0.387 50 20 JCGD Cn1cc(S(=O)(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)cc1C(=O)O 912979289 CCMDWIASDRPRHZ-UHFFFAOYSA-N 450.502 0.767 50 20 JCGD Cn1nc(C(=O)NNC(=O)NC2CCN(CC(=O)Nc3ccccc3)CC2)c2ccccc2c1=O 916240110 SYJVOIJISXVHQZ-UHFFFAOYSA-N 477.525 0.981 50 20 JCGD O=C(COC(=O)CS(=O)(=O)Cc1ccc(Cl)s1)NNC(=O)[C@@H]1COc2ccccc2O1 916533574 YLBORICKZWKAHS-AWEZNQCLSA-N 488.927 0.847 50 20 JCGD C[C@@H]1CCCN(S(=O)(=O)c2ccc(CNC(=O)NN[C@]3(C)CCS(=O)(=O)C3)cc2)C1 918228230 MSFYOQLVTITWFM-DNVCBOLYSA-N 458.606 0.988 50 20 JCGD CCCCN1C(=O)C[C@H](C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)[C@@H]1c1ccc(OC)cc1 919886554 XPFRPBMELUZUQL-AYBZRNKSSA-N 466.560 0.902 50 20 JCGD Cn1ccc2cccc(C(=O)N3CC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c21 1777969825 BVWCASMMJZDNQZ-XMMPIXPASA-N 462.510 0.934 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc4c(c3)CCC4)CCO2)C1 1779028137 FFGDRTPFNZXVMM-RUZDIDTESA-N 463.538 0.860 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779035952 ROMVOICCEXDHCH-QFIPXVFZSA-N 457.462 0.590 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)n1cccc1C=O 1779373540 YBZYDIWCVPKWLY-SRDOKRBCSA-N 482.541 0.688 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1 1780185288 PEEDESOSVQCKMN-VWLOTQADSA-N 472.310 0.581 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)[C@H](F)Br)C3)C2)CC1 1781330639 ZVILOLVBIMRJIP-XJKSGUPXSA-N 470.361 0.178 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)Cn3nccn3)C2)C1 1781421055 DLIVGVQXWLUJCT-FQEVSTJZSA-N 458.431 0.255 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc(OC(F)F)cc3)C2)C1 1781700061 RBPZJYFEUOVFKA-JOCHJYFZSA-N 460.242 0.725 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2 1782178051 DXSUCZYXVMGXED-DHYLWCPWSA-N 463.959 0.597 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Br)cn3)C[C@@H]21)[C@H](O)CCl 1784085334 GOCNODWIXQLECP-KSYCFECVSA-N 460.756 0.966 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)n3ccnc3C)C2)C1 1784633089 YGRVSTMAAFMXLY-RTHMJFCDSA-N 455.519 0.716 50 20 JCGD CN1CCc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cnccc5C(=O)NN)[C@H]4C3)ccc21 1788610064 ADYCKAYPMRFYOG-XJABCFGWSA-N 478.553 0.585 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(-c2ccccc2)[nH]n1 1789319049 FRRMMSLVDYXILY-LEDOBFOHSA-N 474.326 0.664 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@H]1CCc2ccccc2O1 1791226385 TYCDZDMTXMXGRT-MHADKKCISA-N 464.327 0.354 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@H]21 1791293700 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NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCn2ccnn2)[C@H]1c1cccnc1 1813432709 JPWFEQOHNURCPN-OXQOHEQNSA-N 463.502 0.082 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)Cc1ccccc1)CC2)c1cccc(B(O)O)c1 1815360708 XRIMDURODMDHSZ-PKOBYXMFSA-N 465.340 0.652 50 20 JCGD CC(=O)c1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n[nH]1 1819402151 PWMFRYUPXZGHES-KRWDZBQOSA-N 465.474 0.954 50 20 JCGD O=C1C[C@H](C(=O)N2CCN(C(=O)OCc3ccccc3)[C@@]3(CCN(C(=O)[C@H](O)CCl)C3)C2)CN1 1829305879 IZDFBPDGKQNQMK-YZZKKUAISA-N 492.960 0.174 50 20 JCGD C#CC(=O)N1CC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCN2C(=O)OCc1ccccc1 1829356026 ITMAXHQIYNFSFW-DEOSSOPVSA-N 469.542 0.445 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1 1831113868 NSPIOMBTROEFKN-IBGZPJMESA-N 468.319 0.174 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1831877247 VQAHZFKJZLUAOX-MRXNPFEDSA-N 483.660 0.839 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2 1832363863 ILVZAQNYQFILHP-DEOSSOPVSA-N 482.317 0.307 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c(=O)[nH]c1C 1833390361 WDZZNXXWFORYCF-BBATYDOGSA-N 457.325 0.240 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(=O)[nH]c1C 1833390390 WGJGOWBSTMWUGZ-GUYCJALGSA-N 461.288 0.147 50 20 JCGD C[C@@H](NC=O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)CC1 1833726701 CSELIAMPNGVVOT-QAPCUYQASA-N 488.029 0.825 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4c(F)cccc34)CC2)CC1)c1cccc(B(O)O)c1 1834800132 RQCDXSJUGOCVEU-UHFFFAOYSA-N 493.348 0.881 50 20 JCGD COC(=O)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cn1 1835165552 IWTQQLSWCLDDFZ-GOSISDBHSA-N 452.939 0.653 50 20 JCGD CSc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1O 1835931167 HSRHQSLJTOIIOR-QHCPKHFHSA-N 486.355 0.178 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)n1 1837656257 YJKWUIXYBCJWFA-QVKFZJNVSA-N 499.406 0.774 50 20 JCGD N[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccn1 1837872973 CUPUSHPRIQQPQV-JOCHJYFZSA-N 466.347 0.074 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1838357184 VGIVLWXNYMDDKD-UONOGXRCSA-N 468.320 0.740 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c[nH]nc1C)CCO2 1838682327 BEPPPUDWWRFAAY-JOCHJYFZSA-N 487.469 0.935 50 20 JCGD CCCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1839012399 DOENCDFGJSSYKY-VWLOTQADSA-N 482.342 0.539 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)CCO2 1839083364 RGLPQUZXTLDTKA-QINHECLXSA-N 472.380 0.629 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1 1839489167 OSUXEECUAWWNLJ-HRAATJIYSA-N 461.906 0.758 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](N)c3ccccn3)C2)C1 1839963474 LFMNUWYTPYQPEG-ZSZQSSIHSA-N 455.353 0.711 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1840033590 KHEWEAVIYAVCLK-UGSOOPFHSA-N 457.325 0.519 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1 1840184882 BXEWCDKBDBRCEO-VWLOTQADSA-N 496.568 0.587 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1F 1840185541 TVGUXMMOOLUYFH-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)c(F)c(Cl)c1)CCO2 1840753783 MBQPIUNOJJZXSS-JOCHJYFZSA-N 494.687 0.682 50 20 JCGD O=C(c1ncn2c1CNS(=O)(=O)c1ccccc1-2)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841351929 MPORQKURFRDAKR-HNNXBMFYSA-N 479.946 0.081 50 20 JCGD COC(=O)C12CC(C(=O)N3CC4(CCCN4C(=O)CN(C)NC(=O)NCc4ccccc4)C3)(C1)C2 1845039453 QDSUKSZSUVENGO-UHFFFAOYSA-N 483.569 0.879 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1846202949 OJLVIFURSFFUTO-QXKUPLGCSA-N 457.955 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1(C)CN(C(=O)OC(C)(C)C)C1)C2 1846384940 BZBPHFZSYBTMBZ-UHFFFAOYSA-N 451.568 0.820 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=S)Nc2ccc(N(C)C)cc2)c1 729691107 BQNMFSVBXSNNTI-UHFFFAOYSA-N 480.616 0.963 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c1 744446649 HIXLLUBUVNGHBR-RYUDHWBXSA-N 460.940 0.424 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccc2c(c1)OCCO2 748465841 TUZIUNROJVNFLC-UHFFFAOYSA-N 454.487 0.536 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN1S(=O)(=O)c1cccs1)c1csc(N2CCOCC2)n1 749161299 KWXPZTXMFFHNPY-ZDUSSCGKSA-N 471.586 0.656 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 764418946 RVMQYJXCJMYZEX-LJQANCHMSA-N 491.522 0.861 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)cc(OC)c1OC 912920828 DUWZEXTWFHXJIV-ZIAGYGMSSA-N 452.508 0.089 50 20 JCGD Cc1ncc2c(n1)CC[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)C2 916316898 OUPGKGWIRVSCCG-KRWDZBQOSA-N 474.543 0.307 50 20 JCGD CCN(CC)C(=O)CNC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 920814046 KGEQMIRRRSZHNW-INIZCTEOSA-N 499.590 0.152 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@@H](C)OC[C@H]1CCCO1)N(S(C)(=O)=O)CC2 921074238 NGEOWSYWDQBQKK-KYJSFNMBSA-N 499.586 0.684 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2F)c2ccccc2c1=O 933473579 FOIVBWPUGRZNJT-UHFFFAOYSA-N 461.475 0.881 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C2)C1 1778169922 GROZCRIQUIDBQW-GBXCKJPGSA-N 478.509 0.646 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1778934177 UKLVQPIZNOGPHJ-DVECYGJZSA-N 465.315 0.073 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1c(F)ccc(O)c1F)CCO2 1779037333 WFUMRDOGJSVXFH-OAQYLSRUSA-N 461.425 0.426 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccn2nccc2c1 1779161765 ABTZCDRUJVXFQV-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc[nH]3)C2)C1)NC(=O)NCc1ccccc1 1779373548 ISWPPKRUKQWHDB-HSZRJFAPSA-N 454.531 0.804 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1nccn1)C2 1780055346 PSRIIZHUTZRXIA-DENIHFKCSA-N 486.485 0.939 50 20 JCGD C[C@@H](CN)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559547 QMOUGEABLYXXDS-MFSJNOQSSA-N 474.606 0.441 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)ccn1 1780967907 CHTVPIHYMDCQLO-VWLOTQADSA-N 496.568 0.880 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968223 CGSMHUBSQHSLPQ-XZOYJPPVSA-N 475.590 0.570 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781334111 VJSWAWURZKYNRO-IEBWSBKVSA-N 499.374 0.593 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1)n1ccnn1 1782751273 DQTOFAQQGXNSKJ-QEEYODRMSA-N 470.958 0.801 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1783352688 QWTBCPKXXXVMDM-DJJJIMSYSA-N 464.320 0.707 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCc4ccccc4O3)C2)C1 1783843454 NAVJYOGLAHSIAF-HYBUGGRVSA-N 465.510 0.522 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc(O)cn3)C2)C1)NC(=O)NCc1ccccc1 1784641700 DSZKXSRNHLVYSA-RUZDIDTESA-N 496.568 0.506 50 20 JCGD Cc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cn1 1785401504 JUHRCWHEMVVRHQ-VDGAXYAQSA-N 452.515 0.225 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1 1785514765 FXLUFSMTDOUZAH-QHRIQVFBSA-N 465.906 0.807 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(=O)oc3)[C@H]2C1 1786279044 YDNFBIFXCKELDQ-NGTHKXITSA-N 455.471 0.367 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(OC)c1 1786980972 HLKKFPAXXRYRTA-BUKVSMQUSA-N 468.315 0.291 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1787421790 QRUHOAIWIZLJDH-WOYTXXSLSA-N 475.970 0.202 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1 1788610817 VRPSYNJJEGDEOG-HSQYWUDLSA-N 481.553 0.920 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncoc4c3)C[C@@H]21 1788611030 GUVSDFNDPCHDGP-VHFSOBRXSA-N 464.482 0.733 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCNC(=O)C3)C[C@@H]21 1789221826 IUHRABBTPNOEBF-OFVDUGFESA-N 488.497 0.640 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]31)C2 1790686412 SBLFEQOYNYFSHK-RCMKLKEOSA-N 482.965 0.202 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NS(=O)(=O)CC)C[C@@H]21 1790958232 MTPPSVGHIHKMAF-YTFOTSKYSA-N 468.414 0.467 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cnn(C)c3)[C@H]2C1 1791667748 DTHAOOLUUWWLMK-ZPSROVLTSA-N 455.519 0.076 50 20 JCGD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(F)c1F 1791967131 VDVGOCMDGKUMND-SNRMKQJTSA-N 458.270 0.860 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792982361 AYBOGBIOPGBHJG-BPKGMFCQSA-N 459.971 0.965 50 20 JCGD 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Cn1nc(C(=O)NNC(=O)NCC(=O)N2CCN(c3ccc(Cl)cc3)CC2)c2ccccc2c1=O 750335998 WZRFHXMFPQFYLK-UHFFFAOYSA-N 497.943 0.880 50 20 JCGD O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1F 751264029 SQQBYZRMZSUTLT-UHFFFAOYSA-N 460.465 0.206 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)ccc1OC 912919622 QQMLQBMJMTXPLZ-IYBDPMFKSA-N 470.592 0.986 50 20 JCGD NC(=O)c1ncn2c(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc(-c3ccco3)nc12 913082076 KNAFICOEMGMANK-UHFFFAOYSA-N 482.482 0.456 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)CCN1CCN(c2ccccc2)CC1 913391990 RLNQURDIZCMZET-UHFFFAOYSA-N 495.552 0.993 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)Cn3cnc4ccccc43)c2)CC1 913495861 XXDPSTHKJWVHOA-UHFFFAOYSA-N 484.538 0.350 50 20 JCGD CCOC(=O)N[C@@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)C(C)C 915059768 UAMJYSGXSYAVPO-LJQANCHMSA-N 484.575 0.558 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCC[C@@](O)(c2nccn2C)C(F)(F)F)c2ccccc2c1=O 916377484 BZTRSEJRFXIKIN-LJQANCHMSA-N 481.435 0.934 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN(C)S(=O)(=O)CC)c1 916580312 LTBLXRWFAWFROE-UHFFFAOYSA-N 477.609 0.333 50 20 JCGD O=C(CCNC(=O)OCC(F)(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 919970270 XDEBUEVRQURCSG-UHFFFAOYSA-N 466.438 0.911 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ncccc3n2)C1 1778663518 KUTGZLDZNBNTMR-VFHFUPNESA-N 492.540 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CCOc3ccccc3)CCO2)C1 1779030621 DLZZHNCIXVQAGN-QHCPKHFHSA-N 453.499 0.598 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032754 UGBCPKQROQUMBA-IBGZPJMESA-N 481.435 0.195 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cnccn1)C2 1779375535 PIPOUQMNARBYMP-AUSIDOKSSA-N 467.530 0.235 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc(Cl)nc3Cl)C2)C1 1779418056 OYHBMRQDOYORCA-FQEVSTJZSA-N 464.114 0.826 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cncc(C(F)(F)F)c3)C2)C1 1779745846 ZPMKIYZMCNUIMY-HXUWFJFHSA-N 463.221 0.538 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780058209 QNOCCAVQJMIWMQ-YJYMSZOUSA-N 464.320 0.564 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2 1782170599 SHUUPPISMWOYFN-PEOGOYOCSA-N 491.029 0.996 50 20 JCGD COc1cc2c(O)cccc2cc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1782390520 OAZQBGRHKYIVTM-AREMUKBSSA-N 490.321 0.991 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](COC(C)=O)OC(C)=O)CCO2 1783349986 XRUCEDYGQHYPBK-RLFYNMQTSA-N 463.325 0.485 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@]3(CN(C(=O)CCBr)CCO3)C2)C1 1784016212 ZVASLYNNGLTPDZ-VQTJNVASSA-N 490.395 0.973 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786982722 FZBWFKIYDMUSTA-VJBMBRPKSA-N 494.353 0.379 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786985237 UHPRADVDJCAMJR-HARLFGEKSA-N 489.341 0.163 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](N)c3ccccn3)C[C@@H]21 1787508560 AQLYYEIUXCPEEO-JGTSNIRHSA-N 467.530 0.195 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1788091873 AKQYYCMEYVPYCJ-FRMKIJSPSA-N 489.997 0.184 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1n[nH]c2c(F)cccc12 1788394875 KGORVITWNLIKQG-FNHZYXHNSA-N 466.278 0.289 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788963711 GVXFYEYMXQAWJG-PJODQICGSA-N 495.462 0.345 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1789934320 SRBYVLGBQUIAJM-RGHULWKBSA-N 496.374 0.932 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn(C)nc3C(F)(F)F)C[C@@H]21 1791291235 QGRJBKFRXSVWTP-YDHLFZDLSA-N 474.484 0.405 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC(=O)NC1 1792580621 NZZWZUMBRHTIJU-CJXDPKRBSA-N 474.470 0.250 50 20 JCGD Cn1c(=O)n(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)c2ccccc21 1797170826 JORWSKVFFRNEBX-HBCWATKFSA-N 465.348 0.715 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)C2 1797748621 MXEUEGWMAGBFSX-TXCQNJFZSA-N 467.501 0.831 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(Br)n1)C2 1797750591 KWUPOCUBWQPXFH-WDAIWFPHSA-N 495.359 0.421 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cn[nH]c1)C2)NC(=O)NCc1ccccc1 1799095428 VGWSYNCTJOZXRI-JHDGKUDLSA-N 483.573 0.278 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C[C@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1800738895 SLKDHQKEHGYJEH-WHDKQWSOSA-N 471.982 0.823 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C 1800808009 NWOPCXYLMMVBKO-VJQRDGCPSA-N 490.395 0.730 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(OC)cc1[N+](=O)[O-])C2 1800977688 VMJXCFKANYPLMO-MVWRLGRASA-N 455.895 0.989 50 20 JCGD CC(C)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801012275 RXSOXSITDMEUSF-BMQTXXJKSA-N 497.637 0.888 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(CS(C)(=O)=O)nc1)C2 1802333252 QXDGUNCAMYZFAZ-BCDXTJNWSA-N 465.576 0.251 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CCC(=O)N1C(=O)OC(C)(C)C)C2 1802339775 LRZNIROBDUCRBT-YYIAUSFCSA-N 479.578 0.924 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(C)(C)C 1803383313 FRDOYTZIWSEYAT-CEMLEFRQSA-N 480.374 0.632 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)(C1)C2 1807368261 RIAMTVAPCNJMGB-REVQRJLHSA-N 477.326 0.424 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373761 FZZVUCVPOBMSCI-BVSLBCMMSA-N 466.347 0.386 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C#CC2(O)CCCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374304 GYVDBGKPNJQDCP-QPPBQGQZSA-N 475.354 0.780 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)ccc2O)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374540 ZZEMIHLDLBOLTO-HTAPYJJXSA-N 461.283 0.806 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375378 OOZRSOCFGUQYFF-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc2n(n1)CCCO2 1809858385 WHOVXIVQQBPPCV-GCJKJVERSA-N 475.314 0.374 50 20 JCGD CC(=O)NCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1812616859 BVQPLHXKIYPOOZ-LCSGYEPOSA-N 453.503 0.358 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813408043 UOOLGPRBKXKKPF-KPDCDPCYSA-N 474.326 0.944 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347632 HTRLNNXCTDMLPU-KSSFIOAISA-N 492.366 0.867 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC[C@@H]1c1cc(NC(=O)C(F)(F)C(F)(F)C(=O)O)n[nH]1 1815565248 HWKGESHSNQXFIL-CYBMUJFWSA-N 486.187 0.751 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819402964 PRYABGNMJTWNAU-YVEFUNNKSA-N 456.507 0.581 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793501 OQUDJGULCCTLRI-LBPRGKRZSA-N 473.559 0.530 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797814 LCAAGQNTPJHZNX-NWDGAFQWSA-N 473.559 0.672 50 20 JCGD COC(=O)C1(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CC1 1819799340 AXDMMPZBFIDOTR-JTQLQIEISA-N 458.500 0.321 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H]2CCCS2(=O)=O)n[nH]1 1821834434 LHMXSQLPEMVKGC-JKSUJKDBSA-N 475.531 0.291 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1 1824188536 SMQFJBGKLDZBFH-GVDBMIGSSA-N 489.013 0.975 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055718 IZOQDCVIRDEIJP-UZLBHIALSA-N 464.393 0.280 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)C(C)(C)C)CCO2)C1 1830620945 UGPQSYOLKZQYTF-DMPWYTOCSA-N 492.013 0.982 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832251510 SFCQAZJOJRDNIJ-OAHLLOKOSA-N 474.480 0.650 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4c(c3)CCC4)CCO2)C1 1832507332 USGGCDJTKXBDLQ-SANMLTNESA-N 493.564 0.487 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)cnn1C 1832549118 FMAPBHVIRWANNO-HTAPYJJXSA-N 499.996 0.931 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)ccc21 1833310614 VCSOOPMRJXEJKQ-HXUWFJFHSA-N 477.993 0.662 50 20 JCGD CN(C)c1cncc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1833931716 QYAPYWXFKZRCAN-UHFFFAOYSA-N 494.600 0.645 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834801516 RKSJZGIKEHWDPC-SFHVURJKSA-N 467.379 0.318 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801537 UWEROJWGULZJDX-UHFFFAOYSA-N 473.379 0.141 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)CCO2)C1 1836215744 MSLBQQPHTVJPQL-DVSDUFGPSA-N 489.997 0.831 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836717044 FYUYBIDBQBWUTJ-KBXCAEBGSA-N 467.954 0.193 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C3\C(=O)Nc4ccccc43)CCO2)C1 1837327445 RESACDODLIVAIA-FBZIKSMQSA-N 463.918 0.732 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccn1 1837456567 KLKYDWHYVJHGOY-VWLOTQADSA-N 496.568 0.761 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Cn1cncn1)CCO2 1837641104 YBPVCOARMRGHAM-RVKKMQEKSA-N 458.357 0.402 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1837677877 IERIPBNKMQMYKJ-ZMYBRWDISA-N 452.379 0.984 50 20 JCGD CNCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528257 MXYFBPVISYQKDP-QFIPXVFZSA-N 478.502 0.590 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CCN3CCCC3)CC2)CC1 1838789106 HUQFNKWMDNBLEZ-UHFFFAOYSA-N 451.612 0.844 50 20 JCGD O=C(c1nccc2nc[nH]c12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199449 OIUZELZSUYMDTH-RHSMWYFYSA-N 456.272 0.718 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1Cl)CCO2 1839323544 TYGJZSLHISNVEF-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1839784339 MIDAZGDEFUMLON-VBQJREDUSA-N 467.382 0.194 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1840031099 FPRNSAVMLXKJOB-KUHUBIRLSA-N 469.336 0.051 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840105517 OCDCOHPFKOZYML-RBUKOAKNSA-N 450.363 0.692 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnc4s3)C2)C1 1840184487 PXAGHBMVLOZGNF-JOCHJYFZSA-N 475.571 0.739 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840903233 XKCVUVHTYWASKD-NBQZKYEYSA-N 486.338 0.952 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1841437342 CTEGNRJBILIEEA-UHFFFAOYSA-N 465.510 0.922 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1841750091 ICLPOVQKXKJQAC-QAPCUYQASA-N 469.583 0.491 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843011472 HLORGUPRECDHOP-UHFFFAOYSA-N 457.336 0.440 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])cc3c2OCC3)C1 1844689529 FHPGHDZIKVGDKS-UHFFFAOYSA-N 451.244 0.340 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)COc1ccccc1F)c(=O)n2Cc1ccccc1 10161390 LXOFCEXGUPZRSD-UHFFFAOYSA-N 494.483 0.793 50 20 JCGD COC(=O)CCCNC(=S)NNC(=O)c1cc(S(=O)(=O)NCc2ccccc2)ccc1O 18139013 JBRBFZPGOMRERW-UHFFFAOYSA-N 480.568 0.933 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 21900897 MPSHHHRUFRHSDF-UHFFFAOYSA-N 456.480 0.949 50 20 JCGD COc1ccc(C(=O)N2CCC(NC(=O)NNC(=O)CNC(=O)c3ccco3)CC2)c(OC)c1 726098660 MDYZQDITGSJIIP-UHFFFAOYSA-N 473.486 0.662 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNS(=O)(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1C 726765028 SJXJHNUGQGBASP-UHFFFAOYSA-N 466.541 0.792 50 20 JCGD CCOc1ccc(OCC)c(NC(=S)NNC(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)c1 727496386 MILBWGQPAPVSFE-ZDUSSCGKSA-N 497.599 0.967 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc(S(C)(=O)=O)cc3)cc2)CC1 728213243 WAOLOZHZFQFHBR-UHFFFAOYSA-N 452.558 0.783 50 20 JCGD Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)CC2)c1C 729276764 LMKCUAVSFZEDJQ-INIZCTEOSA-N 488.632 0.406 50 20 JCGD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 729536977 QEOTUQAFAJBVNI-KRWDZBQOSA-N 450.507 0.129 50 20 JCGD O=C(CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21)NNC(=O)c1ccncc1 746022334 BCWFWXGEGQBXRH-UHFFFAOYSA-N 459.484 0.625 50 20 JCGD CCn1c(CCC(=O)NNC(=O)c2ccc[nH]2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 747663169 BRWIIDHOUKQJMZ-UHFFFAOYSA-N 474.543 0.799 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1n[nH]c2ccccc12 747700220 GVWNVLKKYKQBEI-UHFFFAOYSA-N 471.539 0.907 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)COc2cccc(C)c2)c1OC 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NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(C(F)F)c3)CCO2)C1 1779028080 BZEHIIZEAWGUOB-NRFANRHFSA-N 460.441 0.775 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780058208 QNOCCAVQJMIWMQ-ORAYPTAESA-N 464.320 0.564 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)Cc3cnccn3)CCO2)C1 1780095384 OEGDLMXXBNSPDO-QFIPXVFZSA-N 469.454 0.996 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1NC(C)=O 1780211092 PVDOBVQZGNBJKU-DEOSSOPVSA-N 481.314 0.091 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1ccnn1 1780967946 FKIHZBNKVYPBKJ-FDDCHVKYSA-N 484.561 0.015 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1N(C)C 1783935692 XLNDTTOYSPPJMZ-HSZRJFAPSA-N 461.563 0.578 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@]13C[C@H]1CCN3C(=O)OC(C)(C)C)CCO2 1783937616 WDFRBARZUZXDMU-CQLNOVPUSA-N 493.605 0.589 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc([N+](=O)[O-])cn3)[C@H]2C1 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462.315 0.929 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1 1810302505 LDOAWIKHBYTUEK-VFNWGFHPSA-N 485.508 0.985 50 20 JCGD CC(C)(NCCC#N)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1817315830 URHYFRUZICWEPL-GOSISDBHSA-N 452.324 0.677 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCCO3)CC2 1819796730 BFTNMHPKDGHRQJ-LLVKDONJSA-N 482.526 0.660 50 20 JCGD Cc1nnc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)s1 1819797219 RCEIBHDQOVHGHU-JTQLQIEISA-N 472.556 0.770 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2 1822478759 RCNVPBGGJCHQGK-ZYHUDNBSSA-N 469.976 0.560 50 20 JCGD COC(=O)C12CC(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3cccc(B(O)O)c3)CC4)(C1)C2 1825553068 CUJDCGDFDOALHE-XWIYTBAMSA-N 469.328 0.392 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccnc1C(N)=O)CC2 1826080751 WGQAQPBCXCYIPE-NSHDSACASA-N 459.532 0.236 50 20 JCGD COCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCN2C(=O)OCc1ccccc1 1829000020 BGMJGEFWQSTJOU-VWLOTQADSA-N 495.341 0.079 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(O)O)C2)C1 1829138286 WWFIFGPZHODGJY-QFIPXVFZSA-N 479.606 0.601 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2)N1CCN(C)CC1 1830543296 PESGKAXPRGYEGW-ZWOKBUDYSA-N 475.428 0.110 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731215 HYFIIAFKNVBOIW-JXFKEZNVSA-N 485.877 0.190 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830738735 SYCMYISCBXKQJF-AUSJPIAWSA-N 463.959 0.203 50 20 JCGD Cn1nncc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1833234881 PWFCUSXBJBWFAD-AGBQBWRISA-N 472.452 0.770 50 20 JCGD Cc1nnc(CCC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)s1 1833831794 UEQUBNGXNIQCPI-UHFFFAOYSA-N 479.651 0.724 50 20 JCGD CCc1noc(C)c1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798372 NBPJFSZURTWSGI-UHFFFAOYSA-N 468.363 0.724 50 20 JCGD COc1ccc(OCC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834800635 UIPOEPPDONBOGS-UHFFFAOYSA-N 495.385 0.639 50 20 JCGD Cc1ccc(O)c(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834801310 XMCVLNASCRPAIQ-UHFFFAOYSA-N 465.359 0.879 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)C(C)(C)C 1834819200 IIZXVPZRTARJCA-VQIMIIECSA-N 462.385 0.779 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835589241 OPPWXXUCIVVZGE-ACTFIFLWSA-N 491.029 0.948 50 20 JCGD Cc1cc(F)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835932161 QWEIMNZVYIKLSL-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD O=C(C[C@H]1OCCc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934061 LQYTYRXLQIHMCW-BVAGGSTKSA-N 494.353 0.141 50 20 JCGD CCSc1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934199 PIGJYSGQVNZZIY-QHCPKHFHSA-N 485.371 0.257 50 20 JCGD Cc1ccccc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939983 RMTJEUKMNNUWIP-VWLOTQADSA-N 466.343 0.378 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CSc3ncccn3)CCO2)C1 1836114412 LEMCTDHREPIDEQ-GUYCJALGSA-N 459.366 0.809 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)nc3)CC2)CC1 1836142710 OWFDIIPLEXBCLG-UHFFFAOYSA-N 467.530 0.285 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)CC1 1836717567 YGPGEOLAUABBTL-SFHVURJKSA-N 480.027 0.256 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)[C@H](Cl)COC)CC2)CC1 1836847730 ZRBOIUMFQGVNJS-WMLDXEAASA-N 468.016 0.567 50 20 JCGD C[C@](O)(C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(F)(F)F 1837020795 SPTKNOXJRKOWHO-FQEVSTJZSA-N 472.269 0.292 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1coc([Si](C)(C)C)c1)CCO2 1837425806 IJIZRQJPXNDYIC-QFIPXVFZSA-N 480.638 0.268 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461513 WYQTZLDBESOXNK-GKVSMKOHSA-N 492.536 0.696 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc(O)nc3)CC2)CC1 1837919124 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1840437372 JITWRNWTZRIGHC-ORAYPTAESA-N 457.369 0.819 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840867556 XJYUJNSBAJWGLI-HRAATJIYSA-N 475.970 0.300 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2cc([N+](=O)[O-])ccc2F)C1 1841877231 HLAVHDCKMGLXGN-UHFFFAOYSA-N 456.434 0.792 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2 1843415370 CNZDTTATFPKEFR-ZVHZXABRSA-N 472.527 0.436 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846484801 OCAQEUYRBJKNTL-INIZCTEOSA-N 486.529 0.428 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)COc1ccc(O)nn1 1848098798 ZPLCMYNCUDVCHN-IHRRRGAJSA-N 469.926 0.895 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@@H]1CCCN(C(C)=O)C1)N(S(C)(=O)=O)CC2 726101984 GYJCJXYWDJMMCH-SJLPKXTDSA-N 496.586 0.359 50 20 JCGD CC/C=C(\C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 728018297 JHHBEJXEVHUMIT-UDYBNVKDSA-N 454.574 0.956 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1nc(C)ccc1O)c(=O)n2Cc1ccccc1 728778904 IRTUDSGGERBLOD-UHFFFAOYSA-N 491.508 0.614 50 20 JCGD N#Cc1cccc(C(=O)NNC(=O)c2cc(O)nc3ccc(S(=O)(=O)N4CCOCC4)cc23)c1 728828288 QCYGGTVRIWFDGL-UHFFFAOYSA-N 481.490 0.908 50 20 JCGD CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@@H](C)C1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 729816579 OPGWPXCJHXRDNL-PMPSAXMXSA-N 488.632 0.998 50 20 JCGD O=C(CS[C@@H]1CCS(=O)(=O)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 747405701 JXULOQYQSBNKRO-CQSZACIVSA-N 461.587 0.152 50 20 JCGD Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)[C@H]2COc3ccccc3O2)cn1 750716681 NRIHZCDIGRSMLZ-CQSZACIVSA-N 463.497 0.883 50 20 JCGD COCCNS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1 913340180 FRQNHJZTINXSJC-UHFFFAOYSA-N 469.903 0.883 50 20 JCGD O=C(COC(=O)Cn1cc(Br)ccc1=O)NNC(=O)[C@H]1COc2ccccc2O1 914874680 SOHBCPNPEJVWDN-CQSZACIVSA-N 466.244 0.141 50 20 JCGD O=C(Cc1ccc(-n2cnnn2)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 915062927 JOMZQDMFRYLLRU-UHFFFAOYSA-N 469.527 0.841 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O)c1ccc2c(c1)OCCO2 918555542 QAEOKZQLAIXOLU-OAHLLOKOSA-N 487.490 0.856 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CNC(=O)CC(C)(C)C)N(S(C)(=O)=O)CC2 919744680 UIXXXXHLHMCZCW-MRXNPFEDSA-N 498.602 0.653 50 20 JCGD CCOc1cc(C#N)cc(Br)c1OCC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919886639 SYLNJAICAIEIIN-LLVKDONJSA-N 475.321 0.616 50 20 JCGD CC(C)(C)c1cnc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1779030306 NWRWNIDRDHSNKK-HSZRJFAPSA-N 467.530 0.530 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779037075 MMHDLUKTTYDQJN-QHCPKHFHSA-N 497.512 0.417 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)CCO2)C1 1779037122 OWABIZPEZUROCA-NRFANRHFSA-N 470.442 0.056 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(F)nc2)C1 1779635794 UTPOPEALTIDHNE-VGOFRKELSA-N 456.478 0.661 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)no3)C2)C1 1779671834 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CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21 1792272087 HEHCOEUZYHUKGF-CYDGBPFRSA-N 481.377 0.539 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ncc1F)C2)[C@H](O)CCl 1792978152 GPJZWKAHDWGDIO-XSPYEYLBSA-N 450.692 0.786 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1794142810 UBGCYXVXCFIGJW-MHORFTMASA-N 479.770 0.750 50 20 JCGD COCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1795355483 FPJXOEODWJXCCT-YVWYUNDQSA-N 465.459 0.386 50 20 JCGD CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1795486026 PARBDFHZHLLRMO-YRPNKDGESA-N 473.379 0.850 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)C2)c1ccc(B(O)O)cc1 1795732870 OIOIASNNUREKMK-MHRUYAEQSA-N 470.281 0.652 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ccc1O)C2)c1cccc(B(O)O)c1 1795739900 NZJLQOUZFUUHAL-HBCWATKFSA-N 489.131 0.352 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]cnc1-c1cccnc1)C2 1796441395 HCHMWYPGMMSXFQ-AIGIPFSKSA-N 490.524 0.809 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)(F)F)c[nH]1)C2 1797750544 GXFDVHDXWKQLMZ-CULMDFNYSA-N 466.420 0.549 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)c(F)c1 1799545838 YUMXBXFSOZLRMV-MGZYLUJXSA-N 457.462 0.869 50 20 JCGD CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCOCCOCCOC 1800847993 QYLCXIIKTQAKDC-AJYBTWMASA-N 464.987 0.680 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C)C2 1800971228 QRTMOEMWPIEVPX-PEHHYFEISA-N 473.954 0.408 50 20 JCGD COc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c(Cl)c1OC 1801009232 SYEGXFFYGUZAJZ-VTEUUUEMSA-N 482.965 0.933 50 20 JCGD C#CCO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803547984 GADAWXCINFJYNG-OXFYSEKESA-N 450.499 0.438 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)COc2cccnc2)[C@H]1c1cccnc1 1804338760 GDMILYCMNFYCIZ-WZONZLPQSA-N 454.531 0.934 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C[C@H](N)c2cccnc2)[C@@H]1c1cccnc1 1807267588 RZXBKVFKGQBBMP-NMMYMHLASA-N 467.574 0.946 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cc(O)n[nH]2)[C@H]1c1cccnc1 1807287141 VHPJZUIEMYWBQB-KIKGRTIKSA-N 464.486 0.964 50 20 JCGD COc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1807362144 DXUSOJVNBDVODO-LAUBAEHRSA-N 461.287 0.193 50 20 JCGD CN1CCC(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1807363798 FQXWDEPIDNLSDF-QPPBQGQZSA-N 464.375 0.813 50 20 JCGD Cn1c(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cccc1=O 1807369173 BZHZCSCXMQPHCP-PGRDOPGGSA-N 460.299 0.094 50 20 JCGD Cc1cnc2c(C(=O)N3CC[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)cnn2c1 1807373893 DGBYKKGNFXHNCB-UGKGYDQZSA-N 484.325 0.746 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 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CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830725042 CZASIROSAUXDSX-HTAPYJJXSA-N 487.981 0.610 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830725481 IZBNSBZEEUBSMG-TXXWUTRGSA-N 487.981 0.512 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737489 FFZXBBAMDGNXLQ-BXTJHSDWSA-N 463.959 0.346 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCCC(F)(F)F)CCO2)C1 1832260511 KTKKDDCTFTYVSS-IBGZPJMESA-N 473.452 0.488 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)c3ccco3)CC2)CC1 1833087665 DGLWDDAAHDTRFO-HXUWFJFHSA-N 470.530 0.197 50 20 JCGD CC(=O)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)n[nH]1 1833821395 UNGGEQSTJJNVGH-KPZWWZAWSA-N 457.325 0.713 50 20 JCGD CCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1833895293 SJQDOZLBKIOZSX-HSZRJFAPSA-N 468.514 0.026 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CNC(=O)c3cccs3)CC2)CC1)c1cccc(B(O)O)c1 1834800124 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1837457627 LFTCKDLATAYNHI-YKSBVNFPSA-N 484.557 0.598 50 20 JCGD CSCC[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921531 KWLICGCQWDTPLS-FQEVSTJZSA-N 464.393 0.093 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1838568651 JTBHYIKHYUYCBT-JXFKEZNVSA-N 458.870 0.440 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)n(C(F)F)n1 1838715705 BVFLLOYWFZENNI-HXUWFJFHSA-N 472.493 0.030 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1Cl)CCO2 1838865413 CGZBZQFSTYJXTI-QFIPXVFZSA-N 458.707 0.404 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)CCO2 1839083365 RGLPQUZXTLDTKA-YRNRMSPPSA-N 472.380 0.629 50 20 JCGD COCCn1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1 1839153393 YEDABGFKCLMUEL-RTBURBONSA-N 463.362 0.836 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1839387452 KGQRQRVQCSCJAQ-JXFKEZNVSA-N 475.615 0.137 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1 1839477134 YPVLJRIJPINULM-MAUKXSAKSA-N 466.890 0.834 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839996318 CRVUTEPOSWPPFO-RXVLNYDTSA-N 474.558 0.538 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1840033857 SMQIJGVIRGXMQX-ODXCJYRJSA-N 480.315 0.675 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1840034983 CEXGRZVOPNHZJA-AUSJPIAWSA-N 483.363 0.440 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)CC1 1840156353 NFHWSQHCLWCGSQ-DYESRHJHSA-N 475.970 0.565 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185171 GWDBJAWYWBLEAL-JOCHJYFZSA-N 497.980 0.577 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(C(=O)OC)cc3)CCO2)C1 1840279684 WOLHTEOMPUVDJA-XMSQKQJNSA-N 468.934 0.726 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(Cl)c1 1840736228 MRIXNZDBZKWEJP-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)CC2)CC1 1841351040 FIBKIQZBHHXAIE-LJQANCHMSA-N 454.999 0.512 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1F 1843011750 OTGDDOWMMXGFMP-UHFFFAOYSA-N 454.263 0.813 50 20 JCGD CC(C)(CC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)NC(=O)OC(C)(C)C 1843012695 GIHKBAYWDMQVTB-UHFFFAOYSA-N 459.352 0.877 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)C[C@H]2C1 1846104977 AKEQXVDZTREWSM-BVZFJXPGSA-N 483.374 0.831 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1847682691 LVIAGWSNDQSSQJ-YRPNKDGESA-N 471.363 0.875 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(C(N)=O)cc2)c1 16726274 LTHOMBFVPMPVCV-UHFFFAOYSA-N 454.530 0.439 50 20 JCGD CCOc1ccc(-n2ncc(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)c2C)nn1 23621222 UWRYLYVEJDCASX-UHFFFAOYSA-N 458.504 0.737 50 20 JCGD CCN1C(=O)c2ccc(C(=O)OCC(=O)NNC(=O)Cc3nc(C)cs3)cc2S1(=O)=O 728732742 MJYDEGXJRQRQHL-UHFFFAOYSA-N 466.497 0.163 50 20 JCGD COc1cccc(/C=C(\C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n2nnnc2C)c1 728847655 JOQSMQGWLPSEOK-XMHGGMMESA-N 463.502 0.842 50 20 JCGD CS(=O)(=O)Cc1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 743798052 FEXWQMDCWPNTLL-UHFFFAOYSA-N 481.552 0.327 50 20 JCGD O=C(COC(=O)CNC(=O)c1ccc(Br)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 793026089 HFLKEJPECFXUCC-INIZCTEOSA-N 492.282 0.710 50 20 JCGD CC[C@H](C)[C@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)N1CC[C@H](B(O)O)C1 864233719 JUTOZRKLKAKMTN-DCGLDWPTSA-N 473.788 0.810 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNS(=O)(=O)c1cccc(F)c1 913391817 FCYSVKFIDDRVHU-UHFFFAOYSA-N 463.535 0.464 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)ccc1Cl 915787698 OUOWZPIFYWFYEV-LUAWRHEFSA-N 486.959 0.729 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3nc4ccccc4n3C)nc2)CC1 915928046 CDWUXVAQCHSNRK-UHFFFAOYSA-N 458.548 0.731 50 20 JCGD Cn1ccnc1[C@](O)(CCNC(=O)NNC(=O)COc1ccccc1[N+](=O)[O-])C(F)(F)F 916378791 TWUAVXWNKRMOPI-MRXNPFEDSA-N 460.369 0.878 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NCCCNC(C)=O)c2)cc1 916519393 FKBJYTQEUYBHCX-UHFFFAOYSA-N 463.516 0.966 50 20 JCGD Cc1cnn(CC(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC(C)C)n(Cc3ccccc3)c2=O)c1 920444451 HMCYQQAZJDORCV-UHFFFAOYSA-N 492.540 0.417 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4nonc4c3)C2)C1 1777714342 OAUOIOMULCPGQS-YQNSVDCASA-N 465.470 0.800 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1783345119 XSUFQPUZSOZMJN-KZULUSFZSA-N 454.325 0.244 50 20 JCGD CN[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C[C@@H]21)C(=O)O 1786898396 JLURODGJGMMROJ-LXNCNOSVSA-N 476.480 0.914 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nccc4nc[nH]c34)C[C@@H]21 1787508810 JXUKUFWBGWRWCG-IINMSSOCSA-N 478.513 0.685 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C[C@@H]21 1791061099 RJBVYELXIRUTGY-HYFYGGESSA-N 464.357 0.593 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=CCCS1)NC(=O)NCc1ccccc1 1793414010 GPEVIXWYPFSJAB-RMFSNUHRSA-N 473.599 0.943 50 20 JCGD Cc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n1 1794685181 VMRNBZNNIDOQIY-JHDGKUDLSA-N 480.569 0.939 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1n[nH]c3cc(Cl)ccc13)C2)c1cccc(B(O)O)c1 1795739740 ICABIGDVKMPMKO-YEZVWNJWSA-N 482.733 0.342 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS(=O)(=O)N1CCCC1 1796441448 OZYJNWDHSMUVFH-YXPYIKCWSA-N 456.392 0.238 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3[nH]ncc3c1)C2 1796442113 RKHOBDOUQZOEIQ-AJIUELFLSA-N 464.486 0.295 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)CC(=O)N2 1797329319 VZYLKUDZKLXLNU-NEANFDDLSA-N 478.509 0.518 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)nc2sccn12)c1ccc(B(O)O)cc1 1799095267 KRNUYFKBEAXKQR-MUJYYYPQSA-N 452.301 0.001 50 20 JCGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cn2[nH]cnc(=O)c12 1799348809 PVTQUQSMSGCDLB-IQOUGMIPSA-N 456.272 0.225 50 20 JCGD O=Cc1ccccc1-c1cncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1800270045 MMVNLUHKTLCYAB-BRTYFSMRSA-N 499.332 0.758 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]12C[C@H]1CCN2C(=O)OC(C)(C)C 1800773078 AVXMDGDBOVMIQU-PSCDBPSGSA-N 493.605 0.349 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nc(Br)nn3c1)C2 1800975792 TXLUXGUVVUITNR-XFMPKHEZSA-N 486.754 0.949 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(Cl)c1 1801793926 GREPESJYOBVHDE-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H]2CCCCO2)[C@@H]1c1cccnc1 1802588475 MIIGAIAPTRPJPE-AHRSYUTCSA-N 452.515 0.969 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1804193402 ACKJWNIGUCWZHN-NQIIRXRSSA-N 482.679 0.669 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCc2cn[nH]c2)[C@H]1c1cccnc1 1804502856 ZNHCTQCQIIZRMY-DYESRHJHSA-N 462.514 0.756 50 20 JCGD COc1nccnc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1804976547 PTZDEKOBMLVQIT-BEFAXECRSA-N 476.497 0.512 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360045 GQVFNVHPXPUDTN-JXFKEZNVSA-N 463.259 0.631 50 20 JCGD O=C(CC(F)(F)C(=O)O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808286587 GEFXBVMIZYCDAP-YJBOKZPZSA-N 461.230 0.191 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc2cn[nH]c2cn1 1810085414 MRGXRPAUDKYHPZ-JTSKRJEESA-N 470.298 0.666 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CNC(=O)c2ccco2)[C@H]1c1cccnc1 1813071086 MSAJHFDVCNDSMY-JTSKRJEESA-N 470.530 0.483 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344034 CXDGMBUCEZUXOP-BDKZABQWSA-N 472.332 0.578 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCS(=O)(=O)CC2)n[nH]1 1815670626 DEXMXARRGHOFIH-MRXNPFEDSA-N 471.656 0.984 50 20 JCGD COc1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n(C)n1 1817470556 DDKPDPMTYAICTE-INIZCTEOSA-N 452.280 0.451 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817478808 HYVQODXUHPNZBD-PKOBYXMFSA-N 455.324 0.700 50 20 JCGD COc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cn1 1819795139 INAGYQFWVNGSGY-JTQLQIEISA-N 468.499 0.480 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2c[nH]c(=O)cn2)n[nH]1 1820246149 BITJRVHOVXZBCC-HNNXBMFYSA-N 451.447 0.111 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3CCc4nc[nH]c4C3)sc2C1)c1cccc(B(O)O)c1 1826616430 FZBHDGJNNQLOIR-HIFRSBDPSA-N 465.344 0.577 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Cn3cncn3)C2)C1 1830539531 ICXVWKRMCCYTGB-IIDMSEBBSA-N 458.357 0.402 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1830998872 QMSQJSPVROVMKH-GEYWLOKFSA-N 489.997 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C[C@@](C)(O)CC(=O)O)CC1 1831875495 WIZAIMQLTWKKMI-VGOFRKELSA-N 454.568 0.595 50 20 JCGD O=C(Cc1cccc([N+](=O)[O-])c1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833038909 WWDZHKGRPOQMRU-UHFFFAOYSA-N 494.357 0.703 50 20 JCGD O=C(CCc1ccccc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1834836894 HLMWXRAMPAFRFC-XMMPIXPASA-N 452.316 0.069 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1835071939 QDRQTNKTMJSILB-HSZRJFAPSA-N 462.547 0.067 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@](C)(Cl)CCl)CC2)CC1 1835645196 YBEYSDXTILGZRU-LPHOPBHVSA-N 467.394 0.859 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835933645 FFDZHQJCXQNZME-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD CCC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)n1cccc1 1835937422 VPDWIRVZXDNGEL-URXFXBBRSA-N 469.347 0.279 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(OC)c1 1836238789 KGGWKJRYONYPFJ-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnoc3)CCO2)C1 1836535207 ZSVSUQNHECUHGW-OAQYLSRUSA-N 474.426 0.892 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836713268 AVKHAYZGTSWPPE-MSOLQXFVSA-N 492.013 0.860 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836717149 KFTDSHNQPDFHRN-ZWKOTPCHSA-N 462.927 0.080 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836718049 PBSQACZUYJXAAF-QAPCUYQASA-N 492.013 0.860 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Nc1cnccn1)CCO2 1837486493 QEZXDJAICSURFJ-VCBZYWHSSA-N 470.368 0.907 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1837605840 FVAWJZCBIHKAHU-AUSJPIAWSA-N 498.378 0.082 50 20 JCGD CCN1CCC(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1837922194 WPHKHJMDYNTLQS-UHFFFAOYSA-N 471.407 0.711 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838418597 GEQKODBYRBTYDT-BFUOFWGJSA-N 454.936 0.843 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)c(NC(C)=O)c3)CCO2)C1 1838610866 HKLSEZIAXBPMGB-HTAPYJJXSA-N 483.949 0.977 50 20 JCGD Cc1ncc(C(=O)N2CCOC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)[nH]1 1839054350 VGFRTVRJRVEXPX-DEOSSOPVSA-N 499.572 0.134 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3sccc3c1O)CCO2 1839567292 MBLJSQBPLXBVLZ-XMMPIXPASA-N 496.350 0.671 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CS(C)(=O)=O)C2)C1 1839962660 NBBVSMHYAUZUCJ-ZQIUZPCESA-N 469.398 0.297 50 20 JCGD O=C([C@@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1840017149 AGGVGDOYUAVUDI-XQJRBRMLSA-N 451.882 0.887 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1840034325 HXBLBWTZPMCSRB-VFNWGFHPSA-N 499.358 0.689 50 20 JCGD COC(=O)N(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)Cc1ccccc1 1840083646 QKSAWZQJZDRRMV-PGRDOPGGSA-N 483.949 0.311 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1840154266 QVTUSOYANFTCNT-IERDGZPVSA-N 495.920 0.002 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1 1840184698 BJARDEBGIKPBQL-IRLDBZIGSA-N 482.965 0.203 50 20 JCGD O=C(c1ccc(Br)cc1O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014704 RLVDNRKVGLCTFY-UHFFFAOYSA-N 459.105 0.965 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1ccc(Br)cn1)C2 1846384191 ONSLHDAQPXUVIX-UHFFFAOYSA-N 452.353 0.963 50 20 JCGD C[C@@H]1[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CCN1C(=O)OC(C)(C)C 1847161488 WPOGXKHXWDKYHY-APWZRJJASA-N 471.363 0.829 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2ccco2)C1)c1ccc(S(=O)(=O)N2CCCC2)cc1 17457317 QIKGVALMAOCTBD-MRXNPFEDSA-N 460.512 0.874 50 20 JCGD Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)CNS(=O)(=O)c1cn(C)c(C)n1 726767335 PXROZCSNQYOHSV-GFCCVEGCSA-N 457.940 0.892 50 20 JCGD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728889324 CCLKEDGYQJJOAJ-UHFFFAOYSA-N 496.977 0.732 50 20 JCGD CN(CCS(=O)(=O)NNC(=O)COc1ccccc1O)S(=O)(=O)c1ccc(F)cc1 730812933 ZWOWTADFOICMDA-UHFFFAOYSA-N 461.493 0.181 50 20 JCGD O=C(NNC(=O)c1ccc2c(O)nc(S)nc2c1)c1cccc(S(=O)(=O)N2CCOCC2)c1 746231716 IYZJFRRHQXYZNJ-UHFFFAOYSA-N 489.535 0.720 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCNS(=O)(=O)c2cn(C)c(C)n2)cc1 750662215 BMFXPNDXFLRXDH-CYBMUJFWSA-N 453.521 0.411 50 20 JCGD C[C@H](O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)OCC(=O)NNC(=O)c1ccccc1 776971707 HCHRLFKVISUVHB-BTYIYWSLSA-N 485.518 0.872 50 20 JCGD Cn1cccc1C(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N3CCOCC3)ccc2n1C 787927387 CPUOLMZEUCVTNT-UHFFFAOYSA-N 474.543 0.327 50 20 JCGD O=C(COC(=O)C/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1ccc(Cl)cc1 821703496 RDSUBUDVEXLOGV-UHFFFAOYSA-N 450.860 0.383 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)c1 873993430 LPESMBXFOZJUSO-UHFFFAOYSA-N 484.538 0.545 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1OC 912764947 LBLFCJZFHRQVMP-UHFFFAOYSA-N 494.482 0.708 50 20 JCGD CC(C)(CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1CCOCC1 915894732 SHUOGZHIIKEMSS-UHFFFAOYSA-N 453.565 0.526 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccc4ccccc4c3)cc2)CCN1 917197854 PRCGJLICDVXOFA-UHFFFAOYSA-N 466.519 0.964 50 20 JCGD C[C@@H](CN1CCCC1=O)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 918099904 GSRAPBOYFCFWOM-HNNXBMFYSA-N 451.549 0.816 50 20 JCGD O=C(NNC(=O)c1cccc(CN2C(=O)c3ccccc3C2=O)c1)N[C@@H]1CCS(=O)(=O)C1 919885184 NIQUNWOKDHEDDJ-OAHLLOKOSA-N 456.480 0.614 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)N[C@@H]2CCCN(S(C)(=O)=O)C2)c2ccccc2c1=O 920239657 AFAXHTLZCNQDHU-CQSZACIVSA-N 464.548 0.565 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)n1 1778378401 OZKJMQDGEGAAGM-OPAMFIHVSA-N 492.533 0.499 50 20 JCGD N#Cc1cc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1F 1779036564 BASDHRWGBSLXQF-HSZRJFAPSA-N 466.473 0.382 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1 1779111944 HDFGSEGWCMEDFW-QHCPKHFHSA-N 462.271 0.174 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CCCCn3cccc3)C2)C1 1779194064 NAJIENIXTFWNPZ-QHCPKHFHSA-N 454.531 0.801 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)C(C)(C)C 1779371506 WLGDANVYJJGIGS-KHCICDEESA-N 488.589 0.363 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(O)no3)C2)C1)NC(=O)NCc1ccccc1 1779676506 FLUMWQFSFXGOOS-QFIPXVFZSA-N 472.502 0.170 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)nn1C(F)F 1780159621 DYEDZFPNTYWFIF-XMSQKQJNSA-N 476.289 0.708 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccnn1)C2)NC(=O)NCc1ccccc1 1780559239 FJULVEWULZOZNE-HYBUGGRVSA-N 498.588 0.138 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNCP(=O)(O)O)C2 1780712837 FTEUSQSVIZWEJM-DAXOMENPSA-N 460.295 0.461 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1780931376 NKGHJIFEYYTRDG-CBGDNZLLSA-N 491.894 0.581 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc[nH]1)CCO2)NC(=O)NCc1ccccc1 1780968979 RMPKNWQDHPXGDI-QHCPKHFHSA-N 454.531 0.804 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781234656 OWTUKOKYUXSFLY-PJSAGSTRSA-N 454.351 0.896 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334591 PZHZBCDIRWCVQL-BZIRYSOJSA-N 494.358 0.877 50 20 JCGD COc1cc(C)cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1781483199 VARCKUJDLLHBCN-HSZRJFAPSA-N 453.499 0.759 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CCc3cnc4[nH]ccc4c3)C2)C1 1783678656 UTFRGHGOUWLAJI-DEOSSOPVSA-N 477.525 0.638 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1783851460 FZHQEASQCGFYHB-IRFFPCCHSA-N 485.541 0.706 50 20 JCGD CCOC(CC(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2)OCC 1784164721 JKQBJICAKXOMTK-ZHNJOBQTSA-N 463.535 0.740 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)CN3CCOC3=O)cc2)CCC1 1786248891 ZZFSYFYNQCJNHS-UHFFFAOYSA-N 452.471 0.885 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccccc3)[C@H]2C1 1786417725 XKYXAWKUPKRJQL-YYWHXJBOSA-N 451.527 0.911 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(-c4cccnc4)n3)C[C@@H]21)c1cccc(B(O)O)c1 1786983380 QGUVDWWQHLCKFJ-CUWPLCDZSA-N 492.366 0.792 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4cc(Cl)ccc4n3)[C@H]2C1 1787859493 VLEBDUQWIICIAI-IXDGSTSKSA-N 497.943 0.893 50 20 JCGD CC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1790863458 VQTGGRPNOLUCTC-SRQBIAJPSA-N 474.986 0.623 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)C[C@@H]21 1791253381 AYWMYFNKHGTUHX-PCCRXHMLSA-N 489.997 0.448 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CSC(=N)N)C2 1793880782 GNTLJEMLIFKBSW-OPDFLTKYSA-N 463.988 0.335 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1C(=O)COc2ccc(Cl)cc21)c1cccc(B(O)O)c1 1794023911 UDNSKPHNJOHYEP-REPLKXPHSA-N 497.744 0.697 50 20 JCGD Cc1ccccc1OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797750523 JAABQHRMVDQYTH-VPTLXERWSA-N 453.499 0.276 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3ncccc3c1)C2 1797750790 QBRHRZADGFNXNT-UPHUGPLXSA-N 460.494 0.750 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799342864 KXUTZHKTDVKVDO-HZZBMVKVSA-N 492.342 0.845 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)CC2 1800102607 RSKCMCPEWILQGH-FAQVEIGNSA-N 457.531 0.148 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OC(C)(C)C)C2 1800982144 XEDSFTIXDDMVHP-YFUQURRKSA-N 499.996 0.689 50 20 JCGD CC(C)c1nc(CC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)no1 1804412745 HHBWQHSZMMZDAU-AVRDEDQJSA-N 477.330 0.830 50 20 JCGD CCc1[nH]nc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1805174890 DIHAWGAFRPUPCE-KKSFZXQISA-N 465.294 0.819 50 20 JCGD CCOC(=O)/C=C/C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1806293205 MJBPBMTZDBBLOS-HWOYEPTDSA-N 451.288 0.200 50 20 JCGD C[C@](O)(C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(F)(F)F 1807360756 CWOBKQIWROARBU-SYNHAJSKSA-N 465.237 0.394 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1)[C@H]1SC(=N)NC1=O 1808392739 IHYIQLIDQWFQLD-VNUKXSOBSA-N 453.952 0.490 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1 1809867982 NKZPHLWIKMXWOY-HTAPYJJXSA-N 469.546 0.753 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1 1810300136 XDSPPBBGJPUSHV-MGPUTAFESA-N 477.481 0.113 50 20 JCGD Cc1cnc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1810300369 XQYNYKIMFIXKJC-UZLBHIALSA-N 460.498 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2nc3ncccn3n2)[C@@H]1c1cccnc1 1810301668 BSRJLEOWAFEZJR-MAUKXSAKSA-N 486.496 0.151 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1nc2ccc(F)cn2n1 1812289639 WIYVWLOADUKTOZ-UTKZUKDTSA-N 488.288 0.577 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1 1813072199 BJPNAFRNDGATDQ-VGOFRKELSA-N 464.530 0.817 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813619415 CTLHIDDYTOBFFZ-ACIOBRDBSA-N 464.375 0.954 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)CC2)c1cccc(B(O)O)c1 1815350152 GRAFZABFQKUPQN-WBVHZDCISA-N 496.398 0.840 50 20 JCGD O=C(CCNC(=O)c1ccccc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361488 GXJVNHPGXCROHY-GOSISDBHSA-N 492.366 0.869 50 20 JCGD COc1nn(C)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1816311981 WKYSLFQBPXWWJW-MRXNPFEDSA-N 467.490 0.770 50 20 JCGD Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3ccc(B(O)O)cc3)CC4)c(C)n2n1 1818247448 IIASFAZARGADOU-OAHLLOKOSA-N 491.342 0.417 50 20 JCGD CC[S@](=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1819264361 WKYCMKWIYZNZCH-KNTRGWTASA-N 461.548 0.873 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2 1819695249 UDRWNORNKDMJBU-NWDGAFQWSA-N 453.569 0.136 50 20 JCGD Cn1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c2c1CCC2 1819797692 XVOHTGLOMZQPEU-NSHDSACASA-N 480.554 0.903 50 20 JCGD CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CC(=O)NC1=O)CC2 1825440827 GNAZOLDPMXHZQQ-RKDXNWHRSA-N 458.338 0.780 50 20 JCGD N#CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCN2C(=O)OCc1ccccc1 1829000828 LVJREAVDFIBFLS-RUZDIDTESA-N 490.325 0.346 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830357534 FQTFAFNBJCINOZ-BTYIYWSLSA-N 477.986 0.593 50 20 JCGD O=C(c1ncn(-c2cccc(F)c2)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725423 OJGIVHGFKUXFQV-UZLBHIALSA-N 467.885 0.076 50 20 JCGD O=C(c1cc(N2CCCC2)ccn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728751 XSQZKAPGXBCWEN-NQIIRXRSSA-N 452.939 0.352 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c[nH]1 1833380156 LJSMOMINCJGQLE-DEOSSOPVSA-N 484.557 0.695 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1833714097 XBPQPFSEAHWPIW-UHFFFAOYSA-N 488.727 0.140 50 20 JCGD CCc1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)co1 1834801196 QABTUAJDRVCLEY-UHFFFAOYSA-N 454.336 0.416 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cnc(O)nc1O 1835068875 ASCLIDVWQCEIBJ-UHFFFAOYSA-N 456.341 0.858 50 20 JCGD N[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)c1cccnc1 1835829137 UWQJOZQOQDFDOV-APWZRJJASA-N 455.353 0.713 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C=O)s1)CCO2 1835948169 XPQBQGYFKDHLDN-FQEVSTJZSA-N 452.533 0.004 50 20 JCGD Cc1nnc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)s1 1836081770 XOHVFYJXCYUTEG-ZFWWWQNUSA-N 451.318 0.536 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1837496965 SHACSHFITYLBLW-JXFKEZNVSA-N 462.927 0.203 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/O[C@H]3CCCCO3)C2)C1 1837715210 CDDWPUVTYWVWJR-NTUGGBQKSA-N 457.600 0.823 50 20 JCGD O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838480500 ASBLFBLJDSCELN-VGSWGCGISA-N 475.933 0.240 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN(CCO)CCO)CC2)CC1 1838760999 PNCWYXZYGRREOX-SFHVURJKSA-N 478.428 0.445 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1 1838767948 YIMFQBMBBMEHAQ-BMIGLBTASA-N 455.821 0.147 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C#N)cc1)CCO2 1838950764 CSRJHPQQWUVOCM-FXZATJRASA-N 478.509 0.762 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C\C(=O)NC3CC3)C2)C1 1839965103 NCPVZXMOYCOEND-VKRNSVOSSA-N 458.353 0.451 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1840153503 PYMZIIUFYKZEJV-VFNWGFHPSA-N 465.890 0.145 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)c1 1840786695 CMEVQCHVXVSZJD-XMMPIXPASA-N 490.557 0.225 50 20 JCGD O=C([C@@H]1[C@@H](O)CCN1C(=O)OCc1ccccc1)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841353797 QEIOJNQGSBTHSH-KSZLIROESA-N 465.934 0.562 50 20 JCGD C[C@H]1[C@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CCN1C(=O)OC(C)(C)C 1847161701 WPOGXKHXWDKYHY-QFBILLFUSA-N 471.363 0.829 50 20 JCGD CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1=O 17197653 BOKCNKHXUXTVSG-UHFFFAOYSA-N 476.493 0.935 50 20 JCGD O=C(Cn1ccc(=O)[nH]c1=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 17397294 DVKNPTCDFKPMAG-UHFFFAOYSA-N 477.886 0.452 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccnn2C)c1 727349475 DTAJJQSWNKOHOC-UHFFFAOYSA-N 465.513 0.853 50 20 JCGD N#Cc1cccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2N2CCOCC2)c1 728828091 JZMNDEZBFIOMTC-UHFFFAOYSA-N 499.549 0.491 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)NC(C)C)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C 744446758 MRHNCYSQOBCQNU-ZFWWWQNUSA-N 454.549 0.838 50 20 JCGD O=C(COC(=O)c1cccc(CN2CCS(=O)(=O)CC2)c1)NNC(=O)c1ccc([N+](=O)[O-])cc1 747292618 HVLGXOYADXCULI-UHFFFAOYSA-N 490.494 0.443 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1)C(=O)N1CCCC1 748246927 HSKJRERBNXEJFG-UHFFFAOYSA-N 493.405 0.681 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)CNC(=O)c2ccco2)cc1 751206470 HKLIOLBLPQAMDV-UHFFFAOYSA-N 464.500 0.460 50 20 JCGD O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 912642893 GFLKBMIQEPLQSX-UHFFFAOYSA-N 498.558 0.740 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CCN3C[C@H](C)O[C@@H](C)C3)CC2)cc1 912920728 AEOQPUHKIQQHMP-IRXDYDNUSA-N 494.614 0.937 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)[C@H]1COc2ccccc2O1 912979467 XDQREEWPSFCCSA-QGZVFWFLSA-N 453.498 0.277 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)NC[C@H]2CCCO2)c1)c1ccc(-n2cnnn2)cc1 913155916 DQZDUFCZHABBIX-QGZVFWFLSA-N 471.499 0.194 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)o1)c1csc(N2CCOCC2)n1 914749347 OLULFXIERKRYCN-UHFFFAOYSA-N 455.518 0.432 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CC[C@H]1CCCO1)c(=O)n2Cc1ccccc1 914755010 BRHCHNPZJWKOAA-QGZVFWFLSA-N 468.514 0.535 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 915884684 RKUYPZJFYAFKNN-UHFFFAOYSA-N 472.527 0.988 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCNC(=O)c2ccc(C)c(F)c2)cc1 916272513 ZHYFXCDODOEJMQ-UHFFFAOYSA-N 479.534 0.823 50 20 JCGD CN1CCN(Cc2cccc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2)CC1 1318320262 HCPRVOPFQCPGJN-UHFFFAOYSA-N 466.590 0.971 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779033859 FZCGAPDHRCBSTO-RUZDIDTESA-N 480.569 0.827 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3nc4ccccc4o3)CCO2)C1 1779037158 RGJQNELIGHLEKG-JOCHJYFZSA-N 450.455 0.584 50 20 JCGD COc1ccnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1 1779372352 FPSRTUQXVCZCLD-AUSIDOKSSA-N 468.514 0.530 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccc(F)cn3n1)C2 1779374537 NSLFEBZLUVNORQ-UZUQRXQVSA-N 496.503 0.308 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1780118048 YMQBEUJRHHGGJW-QHCPKHFHSA-N 482.302 0.098 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C2)C1 1780923725 OFGVOZHFPYAOSX-HSZRJFAPSA-N 470.281 0.820 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)NC(=O)NCc1ccccc1 1780968513 MEPUEGCKWRODAV-FQEVSTJZSA-N 472.373 0.966 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)CCO2)C1 1783533790 JFMPJWDGWYUXDU-FKIZINRSSA-N 489.330 0.798 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCN1C(=O)OC(C)(C)C)CCO2 1783933445 JODSHWTWQSOQQL-KSFYIVLOSA-N 467.567 0.199 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1=NO[C@H](c3ccccc3)C1)CCO2 1783935271 PMEOWDIFBSPGKB-CVDCTZTESA-N 457.531 0.707 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(-c3ccccn3)[nH]n1)CCO2 1783935411 RCWGXELSDCABCI-JOCHJYFZSA-N 455.519 0.288 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(OC)c1 1783937439 RPPFJEVBVDONRR-DEOSSOPVSA-N 476.574 0.839 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C[C@@H]21)[C@@H](O)CCl 1784094737 QDCPQEVQNWWLAG-PXQJOHHUSA-N 465.978 0.201 50 20 JCGD CC[C@@H](C)[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1784555434 VOJNNBLYXFEPHO-JJSQAQTOSA-N 489.617 0.719 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccc4sccc4c3=O)[C@H]2C1 1785259052 WOCGTSBEQZXIFD-SZMVWBNQSA-N 489.598 0.416 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cocn3)[C@H]2C1)NC(=O)NCc1ccccc1 1786229697 RCRBIXFJZSHKJR-BJLQDIEVSA-N 470.530 0.614 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)CC1 1786982188 QREPWYFFVRNNGC-WDSOQIARSA-N 487.362 0.017 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)n3ccccc3=O)C[C@@H]21 1787508720 PSBUUJFBBQILPL-DKAZWIMESA-N 482.541 0.523 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnncc3C(=O)O)[C@H]2C1 1788886083 NYUQYQXFYGFXKP-PKIAMQTDSA-N 455.309 0.799 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)N(C)C(C)=O)C[C@@H]21 1789222133 AFQTUIDCYDESFN-CCNVXBGZSA-N 490.513 0.980 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccncc3)[C@H]2C1 1789735983 SYBYJJMHKGIGFM-QARUKCAUSA-N 452.515 0.738 50 20 JCGD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)N1CCN(C)CC1 1790438101 JFRRQYQZUGECAV-SFHVURJKSA-N 464.375 0.750 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)O2)C1 1792972507 SCWXLFHSBRQXQV-QEOTZNIISA-N 487.981 0.344 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)C(=O)C1 1793117643 VBYNAOOIIFOJBB-FZKCQIBNSA-N 472.970 0.304 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1793299994 WVPPVWYTJUYRAB-PHXJMUFTSA-N 464.327 0.382 50 20 JCGD Cc1nc(-c2ccccn2)sc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795739152 YROMJQAKGIJWIB-XEMDLRDOSA-N 492.366 0.710 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1cnn(C)c1 1795768748 CATRZUVCSUIOGT-RUUUSXTRSA-N 455.519 0.076 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)C1 1796192748 QFBFLDAEBWWNBF-ACDBMABISA-N 471.363 0.875 50 20 JCGD Cc1cc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)c2[nH]1 1797750890 UKPYBBQZVUNMAF-CWPLJXCYSA-N 462.510 0.992 50 20 JCGD Cc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n[nH]1 1797852457 SRNIWKXCATVMMZ-KPEUIFRASA-N 469.970 0.982 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc(Br)ccc1O 1799252438 FYTZNWBMMOERFG-USGNIVHTSA-N 497.390 0.660 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOCCOCCOC)C2 1800644069 GVSUDTAXAMGDBD-KYHPRHEASA-N 465.385 0.819 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)c1 1803141452 OEFTWBBJZGOXDS-JLSDUUJJSA-N 466.947 0.799 50 20 JCGD Cc1[nH]nc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1805119709 WFKMSMMRIZTEDG-JXFKEZNVSA-N 451.267 0.565 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC2(CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)C1 1805383649 GVAWBNHVUSJKJI-GFCCVEGCSA-N 466.340 0.688 50 20 JCGD COc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1807371310 SDCFHGHWHIYDNX-UWJYYQICSA-N 461.287 0.193 50 20 JCGD O=C(CCc1cncnc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807499409 GJDULIBMUKFICK-NFBKMPQASA-N 459.315 0.504 50 20 JCGD COCCn1nccc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808635407 IMPSTKMDEAPUHO-DENIHFKCSA-N 477.330 0.238 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cc(O)nc(O)n3)C2)CC1 1810888017 NPLYNRBGEPXMEJ-VULFUBBASA-N 469.502 0.867 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@H]1c1cccnc1 1813072225 CFNVARACJNEKHS-BKKZXSNDSA-N 457.579 0.932 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCc3nc[nH]c3C2)[C@@H]1c1cccnc1 1813072349 ASDGWTGOGNLNEA-TXBYWVTISA-N 467.574 0.989 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@H]1CCc2nc[nH]c2C1 1813323449 FXQQYMKKUFVCKV-LTMIRXACSA-N 473.342 0.609 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814190890 CXOFTQLFZOARKV-QRWLVFNGSA-N 492.627 0.321 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)CC1 1825128164 CRBYNRAUUQLBKN-SFHVURJKSA-N 463.539 0.784 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)[C@H]1SC(=N)NC1=O 1827059364 NCTBNHBBBZHCAE-ZOCIIQOWSA-N 486.403 0.402 50 20 JCGD O=C(c1cnccc1C(F)(F)F)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726075 UAASVPYQJXONAI-RHSMWYFYSA-N 451.829 0.770 50 20 JCGD O=C(Cc1ccc(Br)nc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733526 OQVQBOXAVQPPAL-KBXCAEBGSA-N 476.755 0.443 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)CCO2 1831522429 ALUFIVXIPSPZHJ-DYESRHJHSA-N 465.934 0.461 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCN1C)CCO2 1832064689 BJJCNUNJZBHBQH-WMZHIEFXSA-N 490.513 0.684 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833499381 YOOAEJSWMVZRRD-YWZLYKJASA-N 460.579 0.277 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3snnc3C3CC3)CC2)CC1)c1cccc(B(O)O)c1 1834799867 ANQVGLDQWZJTFA-UHFFFAOYSA-N 483.403 0.594 50 20 JCGD Cc1cnc2c(C(=O)N3CCC(N4CCC(NC(=O)c5cccc(B(O)O)c5)CC4)CC3)cnn2c1 1834799967 JJXWUUJTRUUBJK-UHFFFAOYSA-N 490.373 0.217 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834800027 QJSOMQUQPFDRCO-UHFFFAOYSA-N 481.406 0.817 50 20 JCGD Cc1cnc2c(C(=O)N3CCOC[C@@]4(CN(C(=O)CCBr)CCO4)C3)cnn2c1 1834822966 AYAZLNFUJORHLZ-LJQANCHMSA-N 466.336 0.893 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc2ccccn2n1 1835302958 IEWNFYLGRIEXHW-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(CN(C(=O)CSC(=N)N)CCO2)C1 1835516068 LCRVGVVDSHHZMY-JMDQKNPTSA-N 479.509 0.955 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cccn4cncc34)CC2)CC1 1835615466 RBACVZVSVPEZAH-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD COc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835923538 HIBTUOXAWDYYEU-UHFFFAOYSA-N 481.557 0.588 50 20 JCGD CC(C)(Cc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835926290 KWNSHLUTYMAARX-SANMLTNESA-N 480.370 0.705 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1 1835928167 GRGQDKWZRXXALN-VWLOTQADSA-N 475.310 0.298 50 20 JCGD CCSc1cccnc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931002 BXWYJWPPXQEOBZ-HSZRJFAPSA-N 485.371 0.257 50 20 JCGD O=C(c1ccc(OCC2CC2)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933515 AZCPAYYUVYEQDF-AREMUKBSSA-N 494.353 0.539 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3OC(F)F)C2)C1 1835934541 XMTILQZYEXNBTD-QHCPKHFHSA-N 490.268 0.352 50 20 JCGD COc1nn(C)cc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837377266 XMEYLLPCNGVOJL-UHFFFAOYSA-N 470.335 0.035 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837921014 ROOMKPSVIHTBKQ-QGZVFWFLSA-N 468.363 0.745 50 20 JCGD Cn1nc2c(c1C(=O)N1CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC1)CCC2 1837921355 CKUOUGCNZWNQFN-UHFFFAOYSA-N 480.374 0.515 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921435 JLWMOJSBLCZGFM-LJQANCHMSA-N 473.423 0.957 50 20 JCGD Cc1ncc(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1837922185 UJTAGWIGZDWTKH-UHFFFAOYSA-N 471.388 0.986 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1 1838430130 UUEDPOOMEZMKEE-KXBFYZLASA-N 466.336 0.973 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1)N1CCN(C)CC1 1839105718 LUDGOGOVHBDGKQ-PWIZWCRZSA-N 465.422 0.315 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(F)c1 1839259603 DIRUCILGPPLYKC-QHCPKHFHSA-N 471.489 0.516 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1 1839514419 MURUYXNDYKLOJC-IIBYNOLFSA-N 464.906 0.659 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1839802244 POBIRWQULYJCNN-WVBUVRCRSA-N 496.402 0.974 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C34CC(C(=O)OC)(C3)C4)C2)C1 1839966664 MADDJRWLJSVNLZ-XHNVJUCFSA-N 473.364 0.960 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C2)C1 1840182441 JINFLZRGKMSING-RDPSFJRHSA-N 487.557 0.009 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1 1840185088 IKGGXWFGAUKVCA-OAQYLSRUSA-N 454.474 0.408 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c1 1840185558 RZZNPTHHNASIJW-UMESLIDUSA-N 474.558 0.538 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)cc3F)C2)C1 1840185992 VPCRHOPZMNYGMM-QFIPXVFZSA-N 468.501 0.337 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cnc(C)s3)CCO2)C1 1840399081 BQGYXJSSHBYBBU-IBUSPFOHSA-N 488.570 0.584 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccnc1 1841470307 KYVKVCSGZDADTP-FQEVSTJZSA-N 494.357 0.844 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CSCC(=O)O)C2)NC(=O)NCc1ccccc1 1845039526 YDIAUHQVKLCZPE-UHFFFAOYSA-N 463.560 0.354 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846124734 DYPXOSNFYSBNJO-XMMPIXPASA-N 489.353 0.923 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)[C@@H]2C1 1846133201 DNTBYHPTGKTGJD-REPLKXPHSA-N 469.347 0.296 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846189075 BZQDKLQJYZMRFT-BXKMTCNYSA-N 469.347 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@@H]3C[C@H](O)[C@H](C3)N2C(=O)OC(C)(C)C)C1 1846203691 CAVQCPGMVJOFHP-BOSXTWCSSA-N 493.605 0.322 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1846954506 KVTXSDOWUSKLRY-HNNXBMFYSA-N 471.624 0.819 50 20 JCGD Cn1ncc2c(=O)n(CC(=O)NNC(=O)c3ccccc3NS(=O)(=O)c3cccs3)cnc21 12741507 MFYRIZCMYXSGGT-UHFFFAOYSA-N 487.523 0.454 50 20 JCGD O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl 15795293 XMUQSTKSEAEGII-SFHVURJKSA-N 481.914 0.962 50 20 JCGD COc1ccc(CCC(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1 725873284 XHTAQPHULWIWEH-UHFFFAOYSA-N 457.487 0.536 50 20 JCGD COc1ccc(NC(=S)NNC(=O)C2=NN([C@H]3CCS(=O)(=O)C3)C(=O)CC2)cc1F 727499493 LBIJWVCFUHNYAH-NSHDSACASA-N 457.509 0.317 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCN(C(=O)CN(C)C)CC2)cc1 728203504 WSHDSDCWXXAULC-XMHGGMMESA-N 493.568 0.573 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NCCOC)c(C(=O)NNC(=O)N2CCOCC2)c1 745988220 VXQDJWVZWGNSJT-UHFFFAOYSA-N 457.553 0.462 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)[C@H]2CC(=O)N(CCN3CCOCC3)C2)c2ccccc2c1=O 746385700 JZXRBALHGRSUIX-SFHVURJKSA-N 498.584 0.528 50 20 JCGD CSCC[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 749160007 QIEOTIKLBCGKOX-PBHICJAKSA-N 464.569 0.668 50 20 JCGD O=C(CNS(=O)(=O)c1ccccc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 913151495 LSVMMVYVXOTWIW-UHFFFAOYSA-N 498.558 0.740 50 20 JCGD COc1ccccc1NC(=S)NNC(=O)Cn1c(=O)oc2cc(S(N)(=O)=O)ccc21 915598536 ZFGCTOLVEUPYHV-UHFFFAOYSA-N 451.486 0.268 50 20 JCGD C[C@H]1CN(C(C)(C)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C[C@@H](C)O1 916234416 DPZLJDQJNPAKEP-CALCHBBNSA-N 483.639 0.532 50 20 JCGD CNS(=O)(=O)c1ccc(C(C)=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 916257813 CFHNUCPDYBRYMO-UHFFFAOYSA-N 480.568 0.770 50 20 JCGD CCN1CCN(CCCCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1 916503974 NRYTZPABPSNZTK-UHFFFAOYSA-N 482.655 0.062 50 20 JCGD O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cccc([N+](=O)[O-])c1 916516010 BUYLBDGZZLTXMX-UHFFFAOYSA-N 477.503 0.086 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(C(C)=O)CC2)cc1 919822479 VVYCZXILBVKIIM-UHFFFAOYSA-N 474.539 0.552 50 20 JCGD Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c2cc(O)ccc2n1 1778425632 JJOWPSLDLOXJOW-RUZDIDTESA-N 475.310 0.686 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(F)(F)F)CCO2 1779028069 BSRKKWRHBSJOOQ-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD Cc1ncncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779798672 SLDIELPVNUXXEZ-XMSQKQJNSA-N 453.503 0.225 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCNC(=O)C1)CCO2 1780098069 AUXHFMDEVQVEDN-NYHFZMIOSA-N 474.470 0.490 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)N1CCN(C)CC1 1780774057 VMNGHACHGQRJAO-CYJAXWMASA-N 463.392 0.827 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)cc3Cl)C2)C1 1781487165 FRODHAQXXMVKGA-DEOSSOPVSA-N 494.744 0.963 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c([N+](=O)[O-])c1 1782085633 COPJDGSAOXWCCH-HNAYVOBHSA-N 455.851 0.425 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1 1782602184 RRLCGMQIBIITPG-XZGHYBNOSA-N 491.552 0.717 50 20 JCGD CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784094956 WJIYLGNTCCIRJD-YSMZAPSNSA-N 489.997 0.326 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)C[C@H]2C[C@H]21 1784096604 ITDJTIIATZFIOP-SCAKLKGDSA-N 471.982 0.964 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784096622 IVIZMQJJJBNRSV-UVPYHEFZSA-N 491.969 0.022 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785583613 QRGLNMPWSXTYGO-GAJHUEQPSA-N 483.610 0.883 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)CCN3CCCC3)C2)C1)NC(=O)NCc1ccccc1 1785675475 XCYFGBKLOTZANG-RUZDIDTESA-N 486.617 0.648 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cnccc4n3)C[C@@H]21)c1cccc(B(O)O)c1 1786982876 FZUFHHFFESSACY-JLMWRMLUSA-N 460.299 0.217 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCCn3cccc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984171 OCXKMUDOAOJVJG-BVSLBCMMSA-N 453.348 0.632 50 20 JCGD COc1c(C)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1C 1786985249 VTPMVFZLMYFTQA-NYVOZVTQSA-N 466.343 0.899 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ccccc4n(C)c3=O)[C@H]2C1 1787974107 HSONEWYPIKMXGO-XSWJXKHESA-N 462.934 0.781 50 20 JCGD O=C(COc1ccc(O)nn1)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788143850 YPLKOCDLVVKZTM-UHFFFAOYSA-N 462.271 0.689 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cc(C)[nH]n3)[C@H]2C1 1788692139 BLACPJLPSQNWEY-IIYRHJEWSA-N 455.519 0.374 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)[C@H]2C1 1789810480 WUFUVRGRZCIPPQ-QQCJEOGWSA-N 489.997 0.448 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(N4CCN(C)CC4)CC3)C[C@@H]21 1791060685 HZQFVMGNSDQBKM-QAETUUGQSA-N 457.413 0.530 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1792004300 LXBMPBVYJJHWTM-NYVOZVTQSA-N 465.315 0.232 50 20 JCGD CCOC(=O)N(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)Cc1ccco1 1792982855 SGOHAOUAJRGDKA-CXHZTBPHSA-N 457.911 0.427 50 20 JCGD Cn1nc2c(c1C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@H](O)CCl)CN(C(=O)OC(C)(C)C)C2 1792984052 RCLIPRXTDJQSJQ-DLTLXFJOSA-N 497.980 0.474 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=NN(C)C(=O)CC1)NC(=O)NCc1ccccc1 1794039978 ZAGFPOJVHCMFEQ-REPLKXPHSA-N 483.573 0.579 50 20 JCGD CCc1nc2ccc(Cl)cn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734163 GZKCBXHJDMJDBZ-VPTLXERWSA-N 496.760 0.747 50 20 JCGD COc1ccc([C@H]2C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795737633 DSNZHKNHBCDGMU-NQDIBGKZSA-N 464.327 0.382 50 20 JCGD C[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)Oc1ccccc1 1795741280 RTWDRSISSLQFIY-CVFMPKEZSA-N 452.316 0.427 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Oc1cccnc1)C2 1796446147 NICMEZTYLUEHOM-WYQRWVTPSA-N 468.514 0.573 50 20 JCGD O=C1Nc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)cccc2C1=O 1797539792 HXJYXNDZJUMRAB-KTBFAXTASA-N 454.252 0.715 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1797737609 CVTQZKSNEHFCHC-QEOTZNIISA-N 459.971 0.965 50 20 JCGD COc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)cn1 1799094693 FLOMWALIBIWEEF-OPMZPASUSA-N 497.556 0.035 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@](C)(Cl)CCl)[C@H]1SC(=N)NC1=O 1799275315 PKKCXCFUZROOGJ-XBEPSMQDSA-N 451.376 0.615 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cccc([N+](=O)[O-])c1=O 1800284035 NTPYZPQMOPQNIR-TYYYEBLRSA-N 461.302 0.582 50 20 JCGD COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(OC)c1 1800415929 MNRRIGOAMNNXJO-NHKMSHSESA-N 482.342 0.220 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)[C@H]2C1 1800740589 LONHXUAWLIUZPQ-GFNSITTLSA-N 487.981 0.058 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(N(C)C)cc1)C2 1801012186 MMBAYJNKNSVOAB-NHKMSHSESA-N 459.591 0.648 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CN2CCSCC2)[C@@H]1c1cccnc1 1802448020 GPASVLJVKATDFM-AVRDEDQJSA-N 462.620 0.509 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1803791584 PEULOSOLSCDJRG-SIKLNZKXSA-N 461.331 0.745 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1 1805269696 WWNQQDCOPXAFHS-LIRRHRJNSA-N 462.470 0.209 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)/C=C/c2cnccn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374567 LIKIYZVPTGERMR-MZQUXBKZSA-N 457.299 0.584 50 20 JCGD O=C(Cn1cc(Cl)cn1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807410642 RXZQFGPSKBPIEX-DYESRHJHSA-N 467.722 0.631 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)c2nc[nH]n2)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807455331 ZYMOCEZSJZOCTO-PZJWPPBQSA-N 491.556 0.866 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1 1810302574 LSVHDAFZSJEXAN-GUYCJALGSA-N 476.440 0.510 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CSCC(=O)O)[C@H]1c1cccnc1 1810305270 JVHOVHMCXNZQCS-KUHUBIRLSA-N 472.527 0.218 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc(=O)nc3sccn23)[C@@H]1c1cccnc1 1811266277 IOKANQLTUSZCDM-KKSFZXQISA-N 497.581 0.844 50 20 JCGD C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)n1ccccc1=O 1815344312 SUHPUTWFLGSMRC-BBRMVZONSA-N 466.328 0.472 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c1 1817473171 JNQHVVUPFFEKJQ-LJQANCHMSA-N 497.342 0.508 50 20 JCGD CC(C)n1cnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)n1 1817685909 WRXVVRKNKBSPCV-NSHDSACASA-N 469.531 0.854 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CSCC(=O)O)[nH]n1 1819404699 TYNWQZMFEJFMAF-AWEZNQCLSA-N 461.504 0.532 50 20 JCGD CC(=O)O[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2)C(C)C 1819486127 TXYYKMJQOKXNSD-SJCJKPOMSA-N 474.543 0.955 50 20 JCGD O=C(/C=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)NCc1ccco1 1820055188 PCYUYAIUXCXFOJ-FDMDGMSGSA-N 494.338 0.514 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc(=O)nc2cccnn12 1820145806 NQXJWPZRNUEZLT-QGZVFWFLSA-N 487.285 0.112 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1cnc2snnc2c1 1821276933 VZDULZZGFVIAMH-CYBMUJFWSA-N 480.340 0.762 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CNC(=O)C2)n[nH]1 1821961556 JBFQRCOFRXHZJD-OVGXNWBPSA-N 454.491 0.672 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825504441 PNEAFSFWGFMGRJ-AWEZNQCLSA-N 474.348 0.573 50 20 JCGD O=C(Cc1ccc(O)cn1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827054498 GOEHSZOWTSHIPE-JOCHJYFZSA-N 451.332 0.943 50 20 JCGD O=C(c1cnn2c1OCCC2)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060195 BUJBVAODUJXNCF-OAQYLSRUSA-N 466.347 0.893 50 20 JCGD N=C(N)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1828975007 SFSUSTJCHLXDOX-FQEVSTJZSA-N 485.372 0.725 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CCCC1)CCO2 1830319422 ZATOBWFTCPEELH-SANMLTNESA-N 492.381 0.948 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1830543589 VGTWSHPAQMVYFG-BLVKFPJESA-N 473.320 0.904 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3C(=O)c4ccccc4C3=O)CCO2)C1 1832534974 OSNHQTDXRFTBPQ-JPYJTQIMSA-N 493.944 0.383 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCc4nc(O)nc(O)c4C3)CC2)CC1 1833833565 QAIZAKNBDHXUKG-KBXCAEBGSA-N 496.008 0.818 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(N(C)C)o3)CCO2)C1 1833902526 QJGXEAHPGXWPBV-ACJLOTCBSA-N 459.341 0.984 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1)CCO2 1834003831 MAUNKGATZPLBAQ-LWROZRRASA-N 454.487 0.286 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)n1cccc1 1834801401 GFDBETGWLHKTEC-SFHVURJKSA-N 452.364 0.614 50 20 JCGD CCc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834955846 VMHLMUZCIRCXSG-UHFFFAOYSA-N 464.375 0.823 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3Cl)C2)C1 1835932016 KPCVBQAHHBNWRP-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cnccc34)C2)C1 1835937139 QESPNXLXQWIBBJ-VWLOTQADSA-N 475.310 0.298 50 20 JCGD CCC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)n1cccc1 1835937421 VPDWIRVZXDNGEL-QPPBQGQZSA-N 469.347 0.279 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)C3CC(O)C3)CC2)CC1 1836682428 DTNDJYBNUNVZNH-MFKUBSTISA-N 459.547 0.890 50 20 JCGD CC(C)(C)[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836693059 QSXGGLVKXFGKOI-LJQANCHMSA-N 461.563 0.704 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)[nH]1)CCO2 1837763293 CGOCXVNKXHABHV-HXUWFJFHSA-N 481.236 0.097 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncon3)C2)C1 1838528025 ALMIWNFJVPIHLA-HXUWFJFHSA-N 475.414 0.287 50 20 JCGD C[C@](O)(C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)C(F)(F)F 1839150630 RTHCYYXTXLPZTO-SOUVJXGZSA-N 451.269 0.992 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839203637 QOQMDVVALDGPCP-SJKOYZFVSA-N 453.305 0.723 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)ccc1Cl)CCO2 1839326028 DWBLOAGJWMRIES-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)c1 1839409258 QTZAPQLTUFDAOP-DEOSSOPVSA-N 476.574 0.755 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2 1839636329 MDTRRNLEMDUXMW-JLMWRMLUSA-N 464.950 0.463 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2 1839636612 RMTNHMNFZLZEHO-XERREHJYSA-N 479.375 0.992 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1 1839926565 ZOJHOFIMBLGISK-DRGXBFSJSA-N 460.531 0.235 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1840150349 JCSYNAWBLSHEHP-QEEYODRMSA-N 498.404 0.829 50 20 JCGD C[C@H](S)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1840163149 NDNKGHNRAPBFBZ-HTAPYJJXSA-N 479.603 0.107 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4ccccc34)C2)C1 1840184281 GQRNZFRBEPMTNQ-DEOSSOPVSA-N 469.542 0.678 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185130 LNOOFINGWBPJQV-NTKDMRAZSA-N 460.575 0.695 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2 1841924414 JFFHBILBSUAOIO-ZDUSSCGKSA-N 479.925 0.367 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1844385552 ASIRNUQRLLSIQA-QGZVFWFLSA-N 462.459 0.488 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1847647538 ZEQIAACLNCYDQH-SFTDATJTSA-N 450.300 0.601 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)cc1OC 1847973397 RNLYFFPDHVKTQL-PMACEKPBSA-N 452.316 0.832 50 20 JCGD C[C@@H](CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NC(=O)C1CCCC1 727096079 ICAZQJSWQRKYIY-HNNXBMFYSA-N 466.560 0.554 50 20 JCGD C#Cc1cccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)c1 727500759 DSZKWZIWULYMJT-UHFFFAOYSA-N 457.537 0.420 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(COCC(F)(F)C(F)F)c1)[C@H]1CCS(=O)(=O)C1 727795649 RWDAQXBECYSTFB-NSHDSACASA-N 462.443 0.848 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728329808 IEKFTPHNFHLTSW-RHSMWYFYSA-N 469.516 0.111 50 20 JCGD COC(=O)c1sc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C(=O)OC)c1C 728853784 AYKDBLCSFDITEZ-UHFFFAOYSA-N 497.555 0.646 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@H]2CN3CCC[C@H]3CO2)c1 729618291 IZMAXFBPHXEJCH-IRXDYDNUSA-N 453.565 0.524 50 20 JCGD CC(C)N1CCC[C@@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 729619928 ZKJSLKQQAKYSPW-KRWDZBQOSA-N 467.592 0.772 50 20 JCGD COc1ccc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1S(=O)(=O)NC(C)C 761771371 DVTCSJFBYBAKDV-UHFFFAOYSA-N 484.556 0.694 50 20 JCGD COC(=O)c1c(S(=O)(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)n[nH]c1C 912522499 WIKKYJRPOHLYHG-UHFFFAOYSA-N 496.509 0.830 50 20 JCGD CC(C)C[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)[C@H]2CC=CC[C@H]2C1=O 913155891 AGOLZPKVYKTFCR-FGTMMUONSA-N 451.487 0.789 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNS(=O)(=O)c1ccccc1F 913391891 MLFDNGVJOKTEPJ-UHFFFAOYSA-N 463.535 0.464 50 20 JCGD COc1ccc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1OC 913632498 XAOOITRNHIPWHA-UHFFFAOYSA-N 478.527 0.869 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)C2CCN(S(=O)(=O)c3cccnc3)CC2)cc1 914944171 FQJPRHJDQYMEKV-UHFFFAOYSA-N 460.512 0.795 50 20 JCGD CCN(CC)C(=O)N1CCC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 915635264 DAKKCJZQCYGSLQ-UHFFFAOYSA-N 495.602 0.642 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCOc3ccccc3F)nc2)CC1 915889758 MVPUAMDOQQKVNY-UHFFFAOYSA-N 452.512 0.862 50 20 JCGD CC(=O)NCCNC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 915893962 FQPMLLIKQHVPCG-UHFFFAOYSA-N 461.544 0.896 50 20 JCGD CN(CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1)S(=O)(=O)c1ccc(Cl)cc1 916112602 LXLIPPYKQGHLGV-UHFFFAOYSA-N 466.951 0.815 50 20 JCGD O=C(Cc1ccc(Cl)cc1)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916517257 ZJPVBFHXLRPVDA-UHFFFAOYSA-N 480.978 0.760 50 20 JCGD CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 917721026 OCSCIATWSUHLEM-UHFFFAOYSA-N 482.584 0.304 50 20 JCGD CN(CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc(Cl)cn1 919694133 WMYWULDVKWRZTN-UHFFFAOYSA-N 495.989 0.972 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)CCCC3)C[C@H](C)O1 920738589 SYTWEWFKWLTKFU-IRXDYDNUSA-N 466.604 0.881 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(n2)OCCO3)C1 1777956061 DXMZVLWQMACCLO-WZONZLPQSA-N 475.546 0.353 50 20 JCGD C[C@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)Oc1ccccc1 1779036917 IPGXBBMUJMSAEJ-OSPHWJPCSA-N 467.526 0.986 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)N2C[C@@H]3C[C@H]3C2)C1 1779254877 ZUELDJDXRGINKJ-VSUJKPFRSA-N 484.601 0.975 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1780200668 HBFPLUZPUWKBHY-NRFANRHFSA-N 475.578 0.974 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2)C(=O)C1 1780794375 VDLKSQHZFVQMIE-RUZDIDTESA-N 490.325 0.236 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(F)F)CCO2)NC(=O)NCc1ccccc1 1780968556 BLJCZMONAGEOHO-OAQYLSRUSA-N 453.490 0.818 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1783176737 AQMISSWTCJYINB-LRTDBIEQSA-N 462.459 0.488 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(NC(=O)C3CC3)cc1)CCO2 1783935670 WSFPMBWISHDURR-XMMPIXPASA-N 471.558 0.852 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCCO4)C[C@@H]21)c1cccc(B(O)O)c1 1786983321 NMNTXAGNGUXTBQ-SSPYTLHUSA-N 478.354 0.527 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]3C2)C1 1787450196 WRBVJSKGICZZKF-ZSORPBTDSA-N 463.934 0.872 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cccnc3)C[C@@H]21 1791057022 LLRUUSVQCUOYQX-TUUVXOQKSA-N 453.337 0.575 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4CN3C)C[C@@H]21 1791288106 YMWJLJCLKMMKKX-CMOCDZPBSA-N 471.602 0.396 50 20 JCGD Cc1ccn2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]4C3)c2c1 1791291004 IBACPYSRJSUWJJ-QRFRQXIXSA-N 456.547 0.609 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCC(C)CC1 1793201382 TVMFDLHLKXFDPT-JBUXMVGSSA-N 458.563 0.442 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1793836510 DDKPGIZHOKIVKM-QSWMPLQWSA-N 489.378 0.546 50 20 JCGD Cc1c(F)ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1N 1795701833 YZFZHUSKARSAKJ-DBWKPXFBSA-N 456.478 0.232 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1Cl)C2)c1cccc(B(O)O)c1 1795737198 CCCOYELOUWRHFW-VPTLXERWSA-N 460.698 0.605 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)[C@@H]1SC(=N)NC1=O 1796429988 RUJAJKXGPTZYBD-QXMWZZNTSA-N 461.382 0.552 50 20 JCGD CCOc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)nn1 1796441722 VSLSVJUBDLIMRY-IHHIPJHASA-N 469.502 0.213 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1797232163 BEKBFVNNWHTYDP-FAQVEIGNSA-N 480.525 0.089 50 20 JCGD Cn1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)ccc1C(F)(F)F 1797750552 HZHRNCKGJCTKLS-DPIQGUFMSA-N 480.447 0.559 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@]1(F)Cl)C2)NC(=O)NCc1ccccc1 1799097566 PLIFSRWARPJBQF-FWPOJJEQSA-N 481.956 0.847 50 20 JCGD CN(C)C(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800433417 KAMUNJCQUHRPSB-ZMMAXQRCSA-N 481.391 0.853 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1803009681 BVXITBDGGKOBGJ-HACGYAERSA-N 466.336 0.670 50 20 JCGD CNC(=O)CC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1803476827 QHIJSZRHHPFYPF-RVGDNOHSSA-N 453.503 0.358 50 20 JCGD Cc1[nH]nc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1F 1805116244 GALDFPHTJQTYIT-LIRRHRJNSA-N 466.477 0.884 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2ncnn2C)[C@H]1c1cccnc1 1805276591 IKDLARRWVMKUDM-GYPFKPTKSA-N 463.502 0.664 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCN2CCOCC2)[C@H]1c1cccnc1 1806957710 YVTWGUIZXOEVTP-AUSIDOKSSA-N 460.579 0.183 50 20 JCGD CCC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1807943995 LHQZTUPTBCBCSP-JKIFEVAISA-N 458.910 0.935 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cnc(O)nc2O)[C@H]1c1cccnc1 1808278386 KGXFFZUIFQIAKL-KTEJBYEXSA-N 492.496 0.736 50 20 JCGD COCCn1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1808657579 MHCPJTOYRZZDMK-DYESRHJHSA-N 492.540 0.556 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1 1810084297 NOPKOHNOZHIAJJ-BTYIYWSLSA-N 485.508 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1 1810303579 VZQGFQOEHKAXIK-IIBYNOLFSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)COc2cccnn2)[C@@H]1c1cccnc1 1810308170 JWTJRUYWNOXBQN-IIBYNOLFSA-N 476.497 0.269 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810357620 SFWCRYMMAKDXLU-FUOKNXTFSA-N 480.330 0.610 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1 1813072159 ASZWIPUAEIDSMA-UZLBHIALSA-N 468.514 0.898 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1 1813326899 VPXZKPLOIKQKEK-ZDPZECHZSA-N 488.552 0.928 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2cnnn2)[C@H]1c1cccnc1 1813468705 JFGABGIMCDCFQZ-RTKZXQSTSA-N 478.517 0.469 50 20 JCGD O=C(CSc1ncccn1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1817592970 WXGVBQBYIGFZKC-KRWDZBQOSA-N 466.332 0.978 50 20 JCGD CC(C)n1cnc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)n1 1817685908 WRXVVRKNKBSPCV-LLVKDONJSA-N 469.531 0.854 50 20 JCGD CC(=O)O[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)C(C)C 1819481221 YIMPQLNMWPFGPR-CRAIPNDOSA-N 459.333 0.636 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827049650 ZPVWKXYTCLBZIY-KUFMOJEASA-N 453.348 0.458 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)COCCO)CC1)NC(=O)NCc1ccccc1 1830165453 HGKVCTSTGUZAMV-QFIPXVFZSA-N 489.617 0.961 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1830543115 KEBFNNHUKDNOBG-YJYMSZOUSA-N 470.320 0.911 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732855 BWKUZLQEKYDTCL-UZLBHIALSA-N 471.341 0.815 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)C1 1831646533 MLHZZEFGOBTBCM-IFXJQAMLSA-N 474.967 0.316 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833393396 RRHJAUGAUYYADX-IERDGZPVSA-N 469.922 0.317 50 20 JCGD CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1834328727 KADRUVPFDRGALA-INIZCTEOSA-N 450.971 0.829 50 20 JCGD Cc1nc(N)sc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834754645 LRYYZFDLTITZGR-UHFFFAOYSA-N 486.602 0.531 50 20 JCGD CC(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)on1 1834801152 NWNBAEXERFHKKQ-UHFFFAOYSA-N 468.363 0.977 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836121419 FYUSLSYGEJARLF-LIRRHRJNSA-N 472.336 0.497 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(CS(C)(=O)=O)nc3)C2)C1 1837711837 SLRUMCWBSXOSOS-NRFANRHFSA-N 499.662 0.548 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838490909 LEKBOSOLYNAOOB-MGPUTAFESA-N 465.894 0.110 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839152843 MDGZNGXGJCXARB-OALUTQOASA-N 463.362 0.836 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1 1839203071 YUGPBQYIMGIDTA-BFQNTYOBSA-N 455.277 0.695 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(OC(F)F)cc1)CCO2 1839331721 PXVAIDJLVQRLEQ-JOCHJYFZSA-N 484.500 0.731 50 20 JCGD O=C(c1cc2cccnc2nc1O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839513070 VWLFOGCOKYQFNA-YWZLYKJASA-N 450.879 0.005 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccnc3OC)C2)C1 1840150340 IYOLUVUHKPWSIG-LAUBAEHRSA-N 455.939 0.733 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n(C(F)F)n3)C2)C1 1840153893 FFUNBPNQTRPIDZ-ACJLOTCBSA-N 450.870 0.910 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1840184656 ZZCWOHPAHVRJBP-QHCPKHFHSA-N 475.521 0.750 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844263501 LBWARZBKPKWGTC-UHFFFAOYSA-N 470.530 0.679 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@]21C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1846190936 LGJOSLXMJIYKOO-OYLFLEFRSA-N 484.557 0.902 50 20 JCGD CN1C(=O)Cc2cc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc21 12968379 FMMKITILZPSLIY-UHFFFAOYSA-N 478.552 0.613 50 20 JCGD CCc1ccc(C(=O)NNC(=O)c2n[nH]c3c2CCCC3)cc1S(=O)(=O)N1CCOCC1 23110832 UMROOAMUFCNQHY-UHFFFAOYSA-N 461.544 0.947 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2c(C)c3c(C)nn(C)c3[nH]c2=O)cc1 105959808 GUDPECXCZWKWRF-UHFFFAOYSA-N 488.570 0.588 50 20 JCGD C#Cc1cccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)c1 727498143 RXKUGQWUXAILFT-UHFFFAOYSA-N 457.537 0.420 50 20 JCGD C[C@@]1(c2ccc3ccccc3c2)NC(=O)N(CC(=O)NNC(=O)CNC(=O)c2ccco2)C1=O 751207117 RZGBKDATRFEFSW-QHCPKHFHSA-N 463.450 0.777 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1cc(C(N)=O)n(C)c1)c(=O)n2Cc1ccccc1 767111200 LBQARBKYIMZPCA-UHFFFAOYSA-N 490.524 0.406 50 20 JCGD O=C(COC(=O)c1cccc(NC(=O)[C@H]2CCCO2)c1)NNC(=O)[C@H]1COc2ccccc2O1 907762018 VHPHGHBKPNYLPZ-RTBURBONSA-N 469.450 0.948 50 20 JCGD NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1 913151419 INYHUVCJSZOBNT-UHFFFAOYSA-N 484.531 0.723 50 20 JCGD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1 913573097 VNBXAMMPAJFZDI-UHFFFAOYSA-N 493.929 0.586 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc1 914715119 OVHOJRLMXPPPOV-CQSZACIVSA-N 467.500 0.928 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)Cn2cc(Br)ccc2=O)cc1OC 915034214 IWWQJQNDEACDQX-UHFFFAOYSA-N 468.260 0.632 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCc2ccc(S(N)(=O)=O)cc2)c1 915883754 HPJZACHTEJGSGR-UHFFFAOYSA-N 497.599 0.551 50 20 JCGD O=C(NC[C@@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1csc(N2CCOCC2)n1 915893739 ADYXHKGJTYCCHB-QGZVFWFLSA-N 460.560 0.825 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@@H]1CCN2CCCC[C@H]12 916639690 WYWCEECMGASDJH-WOJBJXKFSA-N 479.603 0.597 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)NCCCn1nc2n(c1=O)CCCC2 916649388 AVCIQRHVJXDGKI-UHFFFAOYSA-N 467.324 0.943 50 20 JCGD C[C@H](C(=O)N(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)n1cccn1 917496338 BNLHFSTWJJKXKE-QGZVFWFLSA-N 498.565 0.842 50 20 JCGD CCCC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 917515438 KAMKAIULBYMKEX-LJQANCHMSA-N 494.614 0.826 50 20 JCGD CC(C)CNS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1 918208147 AYEAZRIFFXBNDE-NSHDSACASA-N 496.405 0.579 50 20 JCGD C[C@@]1(NNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)CCS(=O)(=O)C1 918218507 UTWMYGWCBNNDLZ-OXJNMPFZSA-N 454.549 0.242 50 20 JCGD O=C(NNC(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O)N[C@H]1CCS(=O)(=O)C1 919886535 SHAAANJFXCFONN-WCQYABFASA-N 459.322 0.320 50 20 JCGD CC(=O)N[C@@H](CC(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1)c1ccc(Br)cc1 919886700 YWKGCDLISCYWMV-KBPBESRZSA-N 461.338 0.534 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1 1779068257 ICDGSXUECSTCAI-HNJNHCNJSA-N 463.325 0.342 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2cncn2c1 1779136154 MLEOJMMQZMAKCO-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1779177159 RIXXPTRHYXNTPB-SCLBCKFNSA-N 454.325 0.210 50 20 JCGD COc1cc(C#N)cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1780088782 CGZWBUGEBHBIBF-RCZVLFRGSA-N 477.326 0.688 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCNC3=O)C2 1780713407 SEAFHDSFGAEKAU-CDHQVMDDSA-N 472.373 0.990 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1781229552 ISYVWQIAIDDFAW-IAGOWNOFSA-N 456.392 0.478 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1781291098 KBYPNZGPGXCYMV-AQOAWAETSA-N 467.950 0.979 50 20 JCGD CO[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1782242320 BRCXQGIBKCCPOP-MFSJNOQSSA-N 475.590 0.881 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1782921399 FPECLDBGCIQCIY-XDHUDOTRSA-N 454.307 0.828 50 20 JCGD CC(C)(C)c1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cn1 1783406712 CNVJHDXJPPMKCD-JBACZVJFSA-N 465.359 0.966 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCCCNC(=O)OC(C)(C)C)CCO2)C1 1783933642 SYIWQCQLQNUZCY-QHCPKHFHSA-N 483.610 0.884 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1)n1cccn1 1784524013 JOQUEIYWRZZOST-NTKDMRAZSA-N 483.573 0.620 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1785609036 LFOMCHCDMZXRQV-BBATYDOGSA-N 467.350 0.389 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc4c3CCCO4)C[C@@H]21)c1ccc(B(O)O)cc1 1786979919 OUOKONDGRVTCJP-QSFXBCCZSA-N 470.356 0.660 50 20 JCGD CC(=O)N1CCN(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)CBr)C[C@@H]32)CC1 1788244988 VHCRJTJJVOMEMD-UBDQQSCGSA-N 473.412 0.161 50 20 JCGD O=C(CS[C@@H]1CCCCO1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788645314 GNGFGQYBOYUEJG-MCNSAMFCSA-N 462.377 0.220 50 20 JCGD C[C@H]1Oc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]43)cc2NC1=O 1789264881 XAHSAAMSNWBVBS-FKKBTLCVSA-N 487.557 0.372 50 20 JCGD O=C(CC(=O)Nc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1789680987 YTCUECRSMAPUPP-NDXORKPFSA-N 483.305 0.128 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1 1789867544 FSPVCAHOLSDIGU-GGOFEBJYSA-N 458.408 0.530 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)c1 1790311143 VHZIENURJYIYDD-WPUCRFQZSA-N 462.927 0.422 50 20 JCGD Cc1cnn([C@H](C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1791600528 UYCQRTQAQBGDJQ-PDWMJMLSSA-N 455.519 0.045 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)c2c1 1795737395 YOZGQPNLGPBYTN-NHKMSHSESA-N 461.327 0.602 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc3c1CCCC3)C2)c1cccc(B(O)O)c1 1795738704 BULYXDPHTXHGBC-VPTLXERWSA-N 454.357 0.824 50 20 JCGD CCc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c1Br 1795959687 XMWLHHODNZTDIH-QPPBUOOMSA-N 463.760 0.548 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)OC(=O)NC(C)C)C2 1796441336 AEDCIFHIGYHFQS-OZPPHJKRSA-N 490.561 0.623 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)[S@@](=O)c1ccccc1)C2 1796443728 FDMFBACOLSZONQ-LNTPBIQESA-N 499.593 0.906 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)n(C)c(=O)n2C 1796983099 SYBZIEBJDFLNAC-BASYENTBSA-N 450.923 0.334 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3cccc(F)c3)CC1)C2 1797748566 IRXHDZRMGJWDLS-YVWYUNDQSA-N 467.501 0.759 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2cccnn12 1798498184 HKTBMHQNFJGVSZ-JZGBQWHFSA-N 454.314 0.529 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COCCNC(=O)OC(C)(C)C 1800057898 VHPNJSIWAFHZKP-BJWYYQGGSA-N 469.583 0.539 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)C(O)O)[C@@H]1c1cccnc1 1802923411 OYKFVUYMVJIWEV-KDOFPFPSSA-N 458.427 0.545 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCn1ccnn1)NC(=O)NCc1ccccc1 1803022610 ZQRAAMWJYJCKSC-ACDBMABISA-N 468.562 0.653 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1CCC(CO)CC1 1804217607 RJJSKPLQYMNJQF-OVFRKTKQSA-N 465.359 0.880 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362017 KGVGZXSKDHIQKV-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD Cc1nc(N)sc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807364188 PICKBGUPQRRROP-SJLPKXTDSA-N 465.344 0.742 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807369663 RKJCTKDZTDXBSW-NZQKXSOJSA-N 461.331 0.595 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1n[nH]c2c1CCCC2 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N[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)c1ccccn1 1815354438 BJFMNIHZBZZDJU-KDOFPFPSSA-N 451.317 0.144 50 20 JCGD COc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1 1815354681 ANISQKPDXAIOOQ-ZDUSSCGKSA-N 453.289 0.161 50 20 JCGD Cc1nc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c(=O)[nH]c1C 1816112329 BYYGGCIMRVWNNT-KRWDZBQOSA-N 464.291 0.409 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc2ncccn2n1 1819031593 BNOPMPGUFYURSZ-GOSISDBHSA-N 459.275 0.752 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819400191 COMXTWKPQNEAPC-TUYSUELWSA-N 466.502 0.573 50 20 JCGD C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNCP(=O)(O)O)CC2 1825641379 HEQBCAUFVHPINO-SFYZADRCSA-N 455.271 0.563 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ncccn3n1)CC2 1826086321 RQYLWNMAVJPKBI-LLVKDONJSA-N 457.520 0.180 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CNC(=O)c2ccco2)CC1 1828926195 BGTLNMIDIFGVAW-IBGZPJMESA-N 482.541 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O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4cccc(Cl)c43)C2)C1 1835939852 KYRRKCDGNIHVAA-NLFFAJNJSA-N 498.772 0.820 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)nn3-c3cccc(=O)n3C)CCO2)C1 1836259831 LYSBXLXTVSIBJK-GAJHUEQPSA-N 491.976 0.967 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2 1836626334 JRWWQOGNYHIDTF-LEWJYISDSA-N 499.490 0.673 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)COC(=O)C(F)(F)F)CCO2 1837315249 PZJZIGVKMBAULY-AWEZNQCLSA-N 461.231 0.333 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccc4o3)C2)C1 1837460277 ZBBIUNRRXXIXJW-HSZRJFAPSA-N 480.481 0.210 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)ccc(F)c1F 1837461376 VGONDFFFJBJBJO-HSZRJFAPSA-N 489.479 0.656 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(-c3cccs3)on1)CCO2 1837984066 KEBLBZWHERKOCJ-HSZRJFAPSA-N 497.338 0.467 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3[nH]nc4ccncc34)CC2)CC1 1838049182 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CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3cccc4cccnc34)n[nH]c2n1 747424055 GPURDGAPQBEXNQ-UHFFFAOYSA-N 466.531 0.906 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1)[C@H]1COc2ccccc2O1 751266813 KHMFURWTDHODND-OAHLLOKOSA-N 495.457 0.677 50 20 JCGD CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(S(=O)(=O)C2CCCC2)cc1 914695507 YHKUJPKZLHTNCE-UHFFFAOYSA-N 479.584 0.828 50 20 JCGD CC(C)CCOc1ccc(C(=O)NNC(=O)[C@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)cc1 914881968 YSUMAPSWLPMFQW-DLBZAZTESA-N 451.545 0.908 50 20 JCGD Cn1ncc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1C(F)(F)F 916156880 DQMXOYHUWUCVSE-UHFFFAOYSA-N 489.476 0.854 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)c2ccccc2c1=O 917914620 KABWMOLHWKXFHI-GFCCVEGCSA-N 463.541 0.996 50 20 JCGD CC(C)(C)CC(=O)NCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 919693659 HHLYFACLZUEXSR-UHFFFAOYSA-N 468.576 0.340 50 20 JCGD CC[S@@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778090870 FIMINVFTCVZDGO-MCZSLHIKSA-N 479.603 0.793 50 20 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CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@H](N)c2ccccn2)[C@H]1c1cccnc1 1807166796 GCGWWISJJOVBEV-ZPMCFJSWSA-N 453.547 0.555 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1nccc2nc[nH]c12 1808132043 NVUROQSFJBJKBI-VGOFRKELSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnn2ncccc12 1808174497 SDTNBETXKXRGKR-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1 1808722865 WFJKWKNUFQXXMT-PXNSSMCTSA-N 456.551 0.947 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3c(O)cc(O)cc3O)CC2)C1 1809969773 RTKZMQRVUAZJCN-UHFFFAOYSA-N 454.288 0.642 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1 1812327631 GPIPLRNZBCKPDR-SBUREZEXSA-N 469.546 0.589 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)Cn2ccncc2=O)[C@@H]1c1cccnc1 1812341155 AZDWISBQYOCRIW-IYXSTTPGSA-N 490.524 0.478 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CNC(=O)C2)[C@@H]1c1cccnc1 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Cn1c(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc2ccccc21 1830433347 QDPSXALUQSZIAQ-SANMLTNESA-N 491.353 0.171 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1832004574 HFRVPVJWDAZDEP-QEEYODRMSA-N 479.933 0.613 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)F)C2)C1 1832549211 HJCBKGFIGXMBOR-SGTLLEGYSA-N 455.886 0.840 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)cnc2c1 1833309954 FXDKLCUPHVRIES-IBGZPJMESA-N 475.977 0.788 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833599096 CRDBRJKVXSFFRZ-KXBFYZLASA-N 459.952 0.573 50 20 JCGD CCOc1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1833950733 JLZXBRRPNIUDOO-UHFFFAOYSA-N 481.362 0.054 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCNC4=O)CCO2)C1 1834560587 MRKJZYOCUXJECY-JLTOFOAXSA-N 453.927 0.104 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc4snnc4c3)CC2)CC1)c1cccc(B(O)O)c1 1834801050 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CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839152107 ODBFDLZBKBGCRH-VHKYSDTDSA-N 498.404 0.565 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1839173548 XXAQYLQFLNKLBL-BEFAXECRSA-N 461.353 0.983 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)ccc1Cl)CCO2 1839326102 IZVRFWFLUNYRTJ-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840017893 KLVIZHJXKLXVRX-YGRDSASPSA-N 487.981 0.155 50 20 JCGD C=CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1840174676 RLQYUTQZFJGMLB-QHCPKHFHSA-N 459.547 0.365 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C(C)(C)C)cn3)C2)C1 1840184477 PHFAGYKUWWRQDC-HSZRJFAPSA-N 476.578 0.217 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccoc4cn3)C2)C1 1840185536 SYQILZILINCPBD-QFIPXVFZSA-N 459.503 0.271 50 20 JCGD O=C1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)CN1Cc1cccs1 1848145746 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474.591 0.531 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccc(C(N)=O)s1)N(S(C)(=O)=O)CC2 749718982 AGQPPUUATVPPAX-CYBMUJFWSA-N 496.567 0.574 50 20 JCGD COc1ccc(C(=O)NNC(=O)CNc2ccc(C)cc2)cc1S(=O)(=O)N1CCOCC1 913432052 DDHQUIGXAUFLSB-UHFFFAOYSA-N 462.528 0.898 50 20 JCGD Cc1cccc([C@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)N2CCOCC2)c1 916436041 UHKHOTYQRXAMBI-FQEVSTJZSA-N 450.503 0.988 50 20 JCGD O=C(CCNC(=O)NNC(=O)c1ccc(COc2ccccc2)o1)N[C@@H]1CCS(=O)(=O)C1 916635988 LDOOVXJKILVEAU-CQSZACIVSA-N 464.500 0.496 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2c[nH]n3c2nc(=O)c2ccccc23)c1 919689081 VSUGSSSCRGFRHG-UHFFFAOYSA-N 454.468 0.501 50 20 JCGD CCCn1c(CCC(=O)NNC(=O)NC2CC2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 920766424 LWWSYQLGRSSYBG-UHFFFAOYSA-N 478.575 0.893 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)c1 1115824758 UOSHGDBGRSHTQY-UHFFFAOYSA-N 480.587 0.897 50 20 JCGD COCC(=O)NCCC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 1317864061 NHGFESSAMQQDDN-UHFFFAOYSA-N 476.555 0.729 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)[C@]3(F)CCCCC3(F)F)C2)C1 1778221389 SILLGPILHNOVRE-WOJBJXKFSA-N 454.254 0.728 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1csc3c1CCCO3)CCO2 1779029991 CVQCXULFXSSEPG-JOCHJYFZSA-N 471.539 0.829 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3c1OCCO3)CCO2 1779030946 ZSVNBCYNUKHRMA-HSZRJFAPSA-N 467.482 0.214 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c([N+](=O)[O-])c1 1779036894 IFIWGNZYUQEKAE-QHCPKHFHSA-N 498.496 0.288 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779295111 YMDYZUQFPOJETC-IERDGZPVSA-N 473.643 0.944 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1779349998 BUPMZRNINCRHLM-IBGZPJMESA-N 466.420 0.789 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)nc1 1779370974 ACKLPYVMCSJXBF-AUSIDOKSSA-N 452.515 0.830 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CSc1ccncc1)C2 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CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)CN1CCc3sccc3C1)CCO2 1783933649 TYKMTJFLRYLNNB-QFIPXVFZSA-N 463.604 0.309 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1cccc(Cl)c1 1783934765 MCGCDECFVQXFPA-FYYLOGMGSA-N 493.992 0.720 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2c1 1783936246 SQHWMFBYRVECJI-HSZRJFAPSA-N 457.531 0.993 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783943386 HZBLBQHEZYNPJG-QGZVFWFLSA-N 450.344 0.873 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)ccc12 1784090266 WEBAKQOTOGVDFA-ONIAQPFYSA-N 478.933 0.704 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1785272174 FJSZEUUCNBIMGT-HSZRJFAPSA-N 485.733 0.736 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1nccn(Cc2ccc(F)cc2)c1=O 1785685498 PERIQJRMTYSVCW-WNHJNPCNSA-N 492.935 0.624 50 20 JCGD Cc1ccn2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)c2c1 1786979823 KJWYJEWZYCYHGH-XJABCFGWSA-N 462.315 0.230 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CC(N)=O)C[C@@H]21 1789220736 IVOZEPBIRJTAPY-DTPILHQWSA-N 476.486 0.625 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(N4CCN(C)CC4)CC3)[C@H]2C1 1789807891 QEUMWROLIJRWFO-FJIDUMEYSA-N 471.440 0.920 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(S(C)(=O)=O)c3)C[C@@H]21 1791252880 VHRUMRRICPCEEW-STECZYCISA-N 459.952 0.332 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1791984646 KLUHXYFAAWXKAW-AAEGSUEWSA-N 461.327 0.901 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3ccc(C)cc3)[C@H]2C1 1792253441 ZLRQUGYMUPRFQJ-OKYOBFRVSA-N 451.951 0.958 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(C#N)cc1 1792556473 HOUREKOLVBGJNS-RHZSSNLCSA-N 462.510 0.824 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cccnc1)C2 1796440571 RWZPKOHBDGJHGX-MQRYTSQFSA-N 452.515 0.738 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1csc(-c2cccnc2)n1 1796483124 NMPNIHZXBQLSJZ-XEMDLRDOSA-N 478.339 0.402 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)c2c1 1797751542 FMEHNSWQCCEVKK-GFENJXEQSA-N 478.509 0.692 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797954716 BOHCFJHDNMNKPM-OREBXVKISA-N 485.654 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nc1Cl 1798030479 WPJXGTNPTOZFRI-CULMDFNYSA-N 479.324 0.904 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2c(nc1=O)SCC2 1799074425 LCHAGJLQYHQYBQ-DNVSUFBTSA-N 471.377 0.265 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnc(O)[nH]1)C2)NC(=O)NCc1ccccc1 1799869236 DJBQAYRKYQKVOM-BJWYYQGGSA-N 455.519 0.713 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cn2cccc([N+](=O)[O-])c2=O)[C@H]1c1cccnc1)[C@@H](O)CCl 1803148559 TUGBWFKJJYISBY-ZVZYQTTQSA-N 463.878 0.457 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1 1809531170 COOUGKXJBSMTGF-UWJYYQICSA-N 460.535 0.303 50 20 JCGD Cn1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1=O 1810293961 HIUJZOVTVYPSGW-JXFKEZNVSA-N 475.509 0.412 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1812939035 JPEZIJPNXDHPLB-IRFCIJBXSA-N 487.981 0.383 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CNC(=O)c2cccnc2)[C@H]1c1cccnc1 1813070725 LLWPEULWAOIMBF-MBSDFSHPSA-N 481.557 0.285 50 20 JCGD CC(=O)Nc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)ccn1 1815341243 TYKJHJRLMRCXGB-INIZCTEOSA-N 479.327 0.716 50 20 JCGD NC(=O)c1ccccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815343612 DLUNCDRONYKCPG-AWEZNQCLSA-N 464.312 0.461 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)[nH]n1)c1ccc(B(O)O)cc1 1817471987 ALUOUZFPGLVOMX-QGZVFWFLSA-N 487.285 0.112 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1)c1cccc(B(O)O)c1 1817476196 JWDFBYWXQWXXEY-CQSZACIVSA-N 468.197 0.501 50 20 JCGD CC(=O)O[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)C(C)C 1819480204 HGNKIHBMXVHCFH-MAUKXSAKSA-N 459.333 0.636 50 20 JCGD Cc1nnc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)o1 1819796702 ARGLVSWCYOTVGL-JTQLQIEISA-N 456.488 0.302 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nn[nH]c3c1)CC2 1819800321 MZTDCRMGWJHMID-NSHDSACASA-N 477.510 0.953 50 20 JCGD C=C(CC(=O)OCC)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1820894552 NZNUACPUUVZNCA-GOSISDBHSA-N 454.292 0.905 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CN2CCSCC2)CC1 1823720198 FHDARZRIWABDMQ-OAQYLSRUSA-N 459.421 0.649 50 20 JCGD Cn1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)c1=O 1824714854 BQRRKULUBPGVLR-OAQYLSRUSA-N 451.332 0.612 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3ncccn3n1)CC2 1826085760 BPBQCSSPOUDNKT-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD O=C(Cn1cncn1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551364 OGNSWIUWJCFVTK-GCJKJVERSA-N 490.948 0.330 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)CCO2 1830419584 XEYMBRIFSFCWNM-FBLLAGFSSA-N 482.317 0.379 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cnc4ccccn34)CCO2)C1 1830666886 MYQZGQSPASABFI-LAUBAEHRSA-N 450.923 0.587 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830719308 BUHPHRRFZSTQCL-QEEYODRMSA-N 463.959 0.203 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CCOC[C@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)CC2=O)c1 1830719807 LEVHAGAZCMICQL-ZDWFVDTJSA-N 495.960 0.104 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830735670 LKGQVMNHSYYBMO-QFBILLFUSA-N 457.867 0.279 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc([N+](=O)[O-])c1OC 1830736413 SKMQLXOWTJTPIZ-FOIQADDNSA-N 487.893 0.282 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccoc3C1)CCO2 1830929751 AIPQDGYGFWCZLZ-ZGDTYUEESA-N 497.552 0.975 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1831192753 HTIYTWMOEVJNCR-DNVCBOLYSA-N 462.385 0.780 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1831329307 LLXUIVDJTZHASP-XOKHGSTOSA-N 474.407 0.007 50 20 JCGD CCc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1833515845 WCQHSQOUUBJKFM-VNSNFZHPSA-N 482.541 0.848 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1 1833566417 CKQZJUOVZVXKSR-FZKQIMNGSA-N 475.315 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc4c(n3)NC(=O)CC4)CC2)CC1 1834972245 VJAMKAMOXNEWSK-UHFFFAOYSA-N 499.616 0.525 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccnc3C)CC2)CC1 1835117821 NRTPSUYXYRDVJR-OGLMXYFKSA-N 482.589 0.897 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)nc1 1835255878 TVWIAOIDHLACPQ-UHFFFAOYSA-N 460.579 0.648 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)COC(=O)C(F)(F)F)CC2)CC1 1835688007 XGVHFXNNAFMLEA-AWEZNQCLSA-N 457.877 0.917 50 20 JCGD CC[C@@H](NC)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835907791 TZKBYNUHRSRMLO-VWKPWSFCSA-N 477.002 0.573 50 20 JCGD CC(C)COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)ccn1 1835928425 OTJWVOJTXUPVLE-RUZDIDTESA-N 497.357 0.180 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930747 YHGXSRJJCCMCLJ-VTUIFRMYSA-N 468.315 0.441 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C34CC(C(F)(F)F)(C3)C4)C2)C1 1835933964 IHGSPXDSHJZRNM-CBNMVNINSA-N 482.264 0.169 50 20 JCGD CN(CC(=O)NC1CCN(C2CCN(C(=O)c3ncc[nH]3)CC2)CC1)NC(=O)NCc1ccccc1 1836343522 HRJQPRHBORRHMM-UHFFFAOYSA-N 496.616 0.941 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@@H]1CC[C@@H]2CCC(=O)N2C1 1836362117 MUWGUSDYWCBQLK-ATZDWAIDSA-N 454.999 0.559 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1csc3c1CCCO3)CCO2 1836387655 SFRGXGYRNOXJQA-QHCPKHFHSA-N 486.355 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)o3)C2)C1 1837460013 ZFGYHMXZHIIDGS-HXUWFJFHSA-N 463.878 0.315 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1 1837715467 RLZOZRFMQHICFN-JOCHJYFZSA-N 480.638 0.595 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1sccc1Cl)CCO2 1838224325 LWWABVAATNIUMA-HXUWFJFHSA-N 479.946 0.784 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C#N)c[nH]1)CCO2 1838736326 YEPAGLFRPQSSPW-QVGKIPNLSA-N 467.486 0.090 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839150300 IPAYCQCZQIOHAP-COXVUDFISA-N 459.392 0.360 50 20 JCGD Cc1cc(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1839283948 LAGFQWSJEGRBJD-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2 1839737650 VDIKQTCNLHULKX-YRILPIOLSA-N 480.871 0.199 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1840034507 NXPLMVLAZURCLP-AUUYWEPGSA-N 466.336 0.512 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840037354 YPTCOFVIQILQRQ-BFUOFWGJSA-N 457.369 0.819 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ccccc3)C2)C1 1840183773 ZCAVGMSNZDJKIO-QFIPXVFZSA-N 464.588 0.608 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCN1C(C)C)CCO2 1840582921 KUWALHPDMDIQIK-NUSMQRMGSA-N 488.589 0.450 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1841924429 LULBEQWLTNLIKI-INIZCTEOSA-N 465.743 0.316 50 20 JCGD CC(C)(C)OC(=O)NCCCCC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010461 SOQQAHDMXWUNBO-UHFFFAOYSA-N 459.352 0.878 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCN2C(=O)[C@@H](C)Oc3ccccc32)cc1 17407123 BYIJCOVINLDYEA-MRXNPFEDSA-N 474.539 0.967 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)C(=O)NC(C)C 744446961 QIOUWBLSSBEMJH-QGZVFWFLSA-N 466.585 0.912 50 20 JCGD CCN(CC)Cc1ccc(C(=O)NNC(=O)Cc2cc(F)c(OC)c(S(N)(=O)=O)c2)o1 746397184 NVONMGOWDHYXID-UHFFFAOYSA-N 456.496 0.920 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)C[C@@H]1C(=O)Nc2ccccc21 748605184 QRCFACCNYISMNA-IBGZPJMESA-N 486.550 0.914 50 20 JCGD O=C1NC(=O)c2ccccc2/C1=C/NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 783679938 PCBCZXQKCZVECT-AQTBWJFISA-N 456.480 0.253 50 20 JCGD Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)C2=O)cc1 789364473 AKNSOCQFCUYNMV-FQEVSTJZSA-N 493.929 0.524 50 20 JCGD CS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 810466016 MFPUQWYGXKNFCZ-INIZCTEOSA-N 458.562 0.046 50 20 JCGD C[C@@H]1Oc2ccccc2N(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1=O 811957012 SKBWHSVGGMYNIN-JTQLQIEISA-N 452.876 0.563 50 20 JCGD CCCn1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCCOC)c2)c2ccccc2c1=O 913055080 DLZZHNWWZASYIS-UHFFFAOYSA-N 487.538 0.806 50 20 JCGD C[C@H]1CCC2=S=C(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCNC(=O)C4)cc3)C=C2C1 914463068 LPGQMOSODQDKMW-ZDUSSCGKSA-N 476.580 0.406 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H](C)Oc2ccccc2F)cc1 915788982 ABNWRAXXCIKERW-CYBMUJFWSA-N 467.475 0.896 50 20 JCGD COc1cc(C(=O)NNS(=O)(=O)c2ccc(F)c(S(C)(=O)=O)c2)cc(OC)c1OC 920308544 YZXKXNMQDAAOCN-UHFFFAOYSA-N 462.477 0.878 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032763 UJAXOVOBVSSIBK-XMMPIXPASA-N 489.573 0.887 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034967 YOQXJMPBTZQGGQ-IVZQSRNASA-N 470.555 0.704 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cn[nH]c1)C2 1779371347 RDCAUFXBZIOFEM-XMSQKQJNSA-N 455.519 0.169 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2C[C@H](O)CN2)C1 1780601810 WDJYSMNTDWLUHE-VSCJKUSUSA-N 490.513 0.370 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1781237329 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O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc(N2CCOCC2)cn1 1785721224 BQDUNXLOMUEGAO-WQCNXYOZSA-N 452.939 0.111 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C[C@@H]21 1791254441 MLVHARYAIVGQQG-MPTYRVRUSA-N 450.923 0.813 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1791984654 KLUHXYFAAWXKAW-NQCBNZPSSA-N 461.327 0.901 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2 1792873661 GDRYJGWGGHEOCX-ZHZXCYKASA-N 464.357 0.450 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CNC(=O)OC(C)(C)C 1792889721 VWXXBBOWLOFAOX-XLWJZTARSA-N 478.384 0.635 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1 1795735914 JKTMKXCHRZIYEN-XEMDLRDOSA-N 467.287 0.062 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796187906 KYYAWQYBEWWRLL-ACDBMABISA-N 489.378 0.550 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188540 SADNYXYOTQGJNR-BCDXTJNWSA-N 481.270 0.766 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)C2 1797751510 BRNVLMYZDVALBL-XQLXGXOBSA-N 479.562 0.776 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncnc1)C2 1798522750 UOGMMDZIWSVESE-CCWDJLKJSA-N 455.427 0.827 50 20 JCGD CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOCCOCCOCCOC 1799382666 DWHJNZAIEWHDPI-AJYBTWMASA-N 464.987 0.680 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@H](Cl)COC)C2 1800979471 JKZOUSDWDLJPSI-XLKGFZLASA-N 482.965 0.466 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807366104 SDXCUNZQUSWOOE-FPOVZHCZSA-N 466.347 0.243 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)CCC(N)=O)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807452513 IIFOWIWPLZBPDJ-YKSBVNFPSA-N 495.584 0.699 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2nc(CO)[nH]c2c1 1809112239 LXWQRVUAANERFO-YADARESESA-N 499.336 0.763 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2nncn2c1 1809910592 JKGWODCFVNOKBB-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3c(O)cc(O)cc3O)CC2)C1 1809980166 MLUIZOBNBJWHNU-UHFFFAOYSA-N 454.288 0.642 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@H](C)NC(=O)c2cnccn2)[C@@H]1c1cccnc1 1810441685 SFQYKYMDQBZDPN-XPYUAMARSA-N 474.949 0.950 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1 1811315121 GLNXJZNRDCEBMX-HNAYVOBHSA-N 489.492 0.837 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1812812372 TUTPZQDWKPCVRB-UZLBHIALSA-N 497.556 0.924 50 20 JCGD Cn1cccc1C(=O)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813476032 MUBCOPSWMCPXGK-NQIIRXRSSA-N 460.299 0.302 50 20 JCGD Cc1nnc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC3)s1 1815583938 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CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822416082 NESAFVBCTZHYJS-SJORKVTESA-N 480.522 0.270 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1 1823008060 QMDBCFHJSYETQU-AKGNYGMASA-N 453.290 0.810 50 20 JCGD O=C(c1nc[nH]c1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053015 SNTJUQNVKHFHIL-QGZVFWFLSA-N 455.280 0.545 50 20 JCGD COc1nn(C)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827056204 QUJBZRRSKHCEQL-FQEVSTJZSA-N 454.336 0.656 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)[C@H]1SC(=N)NC1=O 1827669982 XKCCORIPJDUPSC-ZOCIIQOWSA-N 486.403 0.402 50 20 JCGD CN(C)CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548249 HAIFTBOOXYZUSR-AVRDEDQJSA-N 466.966 0.600 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnncc2C(=O)O)CC1 1829254553 HCAASNWBSSZGJC-GOSISDBHSA-N 460.535 0.781 50 20 JCGD O=C(c1cc(-c2cc[nH]n2)n2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732424 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CC[S@@](=O)CCC(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835117646 HNOXSKHOZOWVCQ-OIGAYQAOSA-N 492.646 0.851 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCSC(=N)N)CCO2)C1 1835656263 HSNRBLBJDKQNSY-BLLLJJGKSA-N 451.387 0.633 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)[C@H]1CC[C@H]2CCC(=O)N2C1 1836362120 MUWGUSDYWCBQLK-ZYSHUDEJSA-N 454.999 0.559 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1836670626 SBOGRKXOSUJNCG-IUODEOHRSA-N 473.368 0.614 50 20 JCGD O=C(Cc1cnccn1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836774045 ZJIDADXEZUCJGN-UHFFFAOYSA-N 452.320 0.011 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CO4)CCO2)C1 1836994598 RBIFCJWCYKFQDV-XCLFUZPHSA-N 482.331 0.871 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1 1837655695 TWHNHDWNWBOHCJ-DNVCBOLYSA-N 462.330 0.824 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)nn1C 1838831887 KXNZTOQBYKWRIK-UGSOOPFHSA-N 459.341 0.530 50 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CC(C)(C)OC(=O)NCC[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2 1823015067 JMGJYAFTYWHGLV-WXHSDQCUSA-N 476.983 0.931 50 20 JCGD Cn1nc2c(c1C(=O)Nc1nc3c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC3)CCC2 1824238412 XRXAQJIUXSLYPN-AWEZNQCLSA-N 465.344 0.585 50 20 JCGD COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1828865967 QBAJEGRCSXTRDO-DEOSSOPVSA-N 489.573 0.458 50 20 JCGD O=C(Cc1ccc(Cl)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830295183 ZYNGNLKKHMWOML-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)N1CCN(C)CC1 1831873858 AZMSQMKIHWFSPE-TZIWHRDSSA-N 464.655 0.615 50 20 JCGD Cc1noc(C)c1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1833068712 PAVFULKARBPESD-JOCHJYFZSA-N 465.551 0.053 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Cn1cccn1)CCO2 1833197327 YMAWCMNBMJBFDH-VPDCDGNCSA-N 485.545 0.110 50 20 JCGD Cn1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n1 1833877606 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O=C([C@@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1)CCO2 1836485041 MUVGDIPVMRJNRB-SQGPQFPESA-N 470.339 0.848 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836775709 ARNNHKINBWZBOO-JLTOFOAXSA-N 498.378 0.118 50 20 JCGD O=C1CC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)=NN1 1837366397 UKYRPGCMMMQYGO-HRAATJIYSA-N 493.358 0.325 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCCC#C[Si](C)(C)C)CCO2 1837432783 NYSXGZVJAFWZOB-QHCPKHFHSA-N 480.682 0.867 50 20 JCGD C[C@@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC=CCC1 1837460460 GJABFEHIKCMPFH-DHIUTWEWSA-N 457.531 0.502 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)ccn1 1837713093 HDPKJOVPLPJWAN-OAQYLSRUSA-N 464.595 0.962 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)CC2)CC1 1837921621 SDIKRXFSATXFPX-VSKRKVRLSA-N 456.348 0.546 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cn2[nH]cnc(=O)c12 1838469536 NCQXXRAVJCZWTK-LJQANCHMSA-N 482.335 0.186 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1c[nH]c3ccccc13)CCO2 1839071958 SADYERUJDGMBKZ-XMMPIXPASA-N 471.558 0.540 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)CCO2 1839109781 UNTCFFXBYMSSBY-TXXWUTRGSA-N 489.997 0.688 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1OC 1839374529 QMUGPNUDAVPMBD-VLIAUNLRSA-N 460.886 0.513 50 20 JCGD CCOc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)cnc2c1cnn2C 1840151549 FRZIBENRMSVQRV-HTAPYJJXSA-N 495.964 0.691 50 20 JCGD Cc1cc(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC(C)C)n(Cc3ccccc3)c2=O)on1 10161583 XXJFWQAGMZNDNO-UHFFFAOYSA-N 479.497 0.822 50 20 JCGD Cc1nnc(NNC(=O)c2cccc(S(=O)(=O)N3CCN(c4ccc(F)cc4)CC3)c2)[nH]c1=O 11548129 OPKJZHMGPWLFRF-UHFFFAOYSA-N 487.517 0.880 50 20 JCGD Cn1c(=O)c2c(ncn2CCC(=O)NNC(=O)c2ccc(COc3ccccc3)o2)n(C)c1=O 16224529 VOAOMUMNERUHGP-UHFFFAOYSA-N 466.454 0.457 50 20 JCGD COCCn1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccc1=O 29490246 YJDGTCZPNKPNAQ-UHFFFAOYSA-N 463.516 0.139 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2nc(-c3ccncc3)no2)c1 110845698 MZMPNRWVIMQKRH-UHFFFAOYSA-N 473.515 0.975 50 20 JCGD C[C@H]1CN(c2ccc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cn2)CCO1 728948287 ZIEIVKDIYKDYGE-INIZCTEOSA-N 454.535 0.844 50 20 JCGD CC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)=NN1c1ccccc1 750865913 PAHWFDGMYQINLR-NRFANRHFSA-N 499.549 0.692 50 20 JCGD NC(=O)CC[C@H](NC(=O)OCc1ccccc1)C(=O)NNC(=O)c1ccc2c(c1)OCCO2 794413928 PJGKGHJFSGXELP-INIZCTEOSA-N 456.455 0.779 50 20 JCGD O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc(S(=O)(=O)NC[C@H]2CCCO2)cc1 913416502 GIMSJTSJGMSSJE-DNVCBOLYSA-N 461.496 0.745 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NC1CCN(C)CC1)N(S(C)(=O)=O)CC2 915898578 DJEMTBXQCYDVND-QGZVFWFLSA-N 483.591 0.377 50 20 JCGD O=C(NCCCN1CCN(c2cccc(C(F)(F)F)c2)CC1)NNC(=O)C(=O)NC1CC1 916485778 ZSZAYVFCNDCNMQ-UHFFFAOYSA-N 456.469 0.827 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCn1cc(Cl)cn1)c(=O)n2Cc1ccccc1 918016055 CKSOBOOHKLKNEY-UHFFFAOYSA-N 498.931 0.516 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2ccc(OCC(=O)NC)c(OC)c2)c2ccccc2c1=O 919692326 OTSLFERISKHNDW-UHFFFAOYSA-N 453.455 0.625 50 20 JCGD CCCN1CC[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 919792770 DXKDRVUZVDWOHO-MRXNPFEDSA-N 453.565 0.383 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(N2NC(=O)CCC2=O)cc1 920287991 LBKHTZOLHDJLRY-UHFFFAOYSA-N 458.500 0.521 50 20 JCGD CC(C)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(=O)n3[nH]nnc3n2)C1 1777820803 VUOYMWVTFQZIGD-BFUOFWGJSA-N 451.915 0.205 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](F)Cl)CCO3)C2)C1 1778087952 SRHXMQNUKKKSRM-XGKMFUNXSA-N 463.934 0.969 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028731 OKXSVORIKWVKTK-XMMPIXPASA-N 496.524 0.403 50 20 JCGD COc1ccccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029789 YWPVLIWRWBKLPY-DEOSSOPVSA-N 467.526 0.770 50 20 JCGD COc1cc(C)cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779036821 GOSGKSPCKVDWPJ-QHCPKHFHSA-N 453.499 0.759 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)N3CCOCC3)C2)C1 1779094551 DCCAZPROUPEKKD-QMLVJWNSSA-N 476.480 0.352 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC[C@@H]1CCOC1)C2 1779374856 FQULBWZSRIPREW-ZDWFVDTJSA-N 459.547 0.629 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780098037 ZBHWJZMLVGYNPO-JLCFBVMHSA-N 474.470 0.654 50 20 JCGD C[C@H]1Oc2ccc(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2NC1=O 1780181636 XUVPTGJJEVESAQ-IQMFZBJNSA-N 473.530 0.223 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCN2C(=O)OC(C)(C)C)C1 1780583790 USFWMMRFERGBNA-QZTZHPFYSA-N 495.621 0.883 50 20 JCGD COc1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969897 LRTCUBULYOEJLW-RUZDIDTESA-N 496.568 0.880 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nn[nH]c3c2)C1 1781440290 NXLBXKFETITCFA-AUSIDOKSSA-N 478.513 0.398 50 20 JCGD CC(=O)NCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1781761379 CYHULCSXOMAITQ-GCKMJXCFSA-N 474.986 0.769 50 20 JCGD COC(=O)C12CC(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C4)(C1)C2 1781962426 PCOTYJLZKUQFPJ-IRVXSINZSA-N 464.563 0.217 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)NC(=O)CC4)C2)C1 1782515508 RHVAKNJKMDBCMP-QHCPKHFHSA-N 457.531 0.388 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(CO)c(F)c1 1783074336 CMENREFIVJUCCV-ZJSXRUAMSA-N 470.306 0.439 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccc(C#N)c3)[C@H]2C1 1783917704 VEZNTBMKBTVQIG-ACRUOGEOSA-N 455.559 0.844 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1CCN(c3ccccn3)CC1)CCO2 1783935258 SAGBQZYLVQDNBF-DEOSSOPVSA-N 472.590 0.501 50 20 JCGD CCOC(=O)N(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)Cc1ccco1 1784302415 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CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCCOC2=O)cc1 1799817221 RUCSPRLRUUDJME-OPMZPASUSA-N 487.557 0.610 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2ccnn12 1799902780 YFJINGATJDOQLZ-IHBLFXCCSA-N 463.498 0.672 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c2c(nn1C)CCC2 1800047126 DBEAVIWBYCISJR-DHMDNZFNSA-N 467.530 0.246 50 20 JCGD CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1802053443 ZNFWQMAAVRGJFG-TZZQQRSASA-N 459.971 0.985 50 20 JCGD CC(=O)Nc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1804829051 WTPFHWOIMPWAMB-CVDCTZTESA-N 487.325 0.748 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnn(-c2cccnc2)c1 1805073304 GMFZCYSTSIADCF-YKSBVNFPSA-N 496.336 0.976 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@@H]1c1cccnc1 1806342369 HDWYPAYECLRVIB-CWRNSKLLSA-N 457.325 0.937 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1 1807284983 PDNNAPRVXWVVIK-UGSOOPFHSA-N 450.459 0.142 50 20 JCGD Cn1cccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1=O 1807363764 QIIJVELQEJZRNF-WIYYLYMNSA-N 460.299 0.094 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cn2ccccc2=O)[C@H]1c1cccnc1 1807441089 VJBLWMQZSVQFDW-HTAPYJJXSA-N 475.509 0.262 50 20 JCGD CCOc1cnc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cn1 1807515534 BJKMGWYILCELHP-UHFFFAOYSA-N 452.320 0.714 50 20 JCGD Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)s1 1807534793 VTYABJZXYXXUDH-FOIQADDNSA-N 480.554 0.802 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1nc2ccccn2n1 1807934960 PCFUFQKRBRBCSY-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ncon2)[C@H]1c1cccnc1 1808417812 QPZBNTGTHRFRQZ-QWRGLFMHSA-N 450.459 0.918 50 20 JCGD COCCn1nccc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808635409 IMPSTKMDEAPUHO-SIKLNZKXSA-N 477.330 0.238 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc2nncn2c1 1809909970 IEBWUPNGBFWUQA-GCJKJVERSA-N 470.298 0.438 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1cccn1 1810306807 ARTHXMBPCOUWRM-OXFYSEKESA-N 462.514 0.857 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(=O)c2cccn2C)[C@@H]1c1cccnc1 1813072432 CDDGNAMPSUYLQB-DYESRHJHSA-N 454.531 0.682 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cn[nH]c3cn2)[nH]n1)c1ccc(B(O)O)cc1 1817472361 RRATYGOJPRZSJK-LJQANCHMSA-N 459.275 0.981 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1SC(=N)NC1=O 1818098616 XCJFDSIAECOJCA-KCTSRDHCSA-N 484.347 0.198 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3nn(C)c4c3CCC4)sc2C1 1818476241 IYVCGYDTZGIWOK-LBPRGKRZSA-N 459.576 0.964 50 20 JCGD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)N1C[C@H]2C[C@H]2C1 1819290625 YPDANBCUYREUTJ-DFYYWFRZSA-N 451.336 0.736 50 20 JCGD CCOC(=O)c1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)ccn1 1821583444 NXJKJFCWBIRFNU-INIZCTEOSA-N 494.338 0.934 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCSCC2)CC1 1823720628 BTFXXWYZSISROQ-HXUWFJFHSA-N 474.631 0.967 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc3n(n1)CCCNC3=O)CC2 1826085971 IBQHCVHIJZXWDN-GFCCVEGCSA-N 488.574 0.072 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CC[C@H](O)CC3)sc2C1 1826341271 RWSLVOCHQXKTLF-JHJVBQTASA-N 458.544 0.919 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cc3n(n2)CCCO3)CC1 1828611196 MYTCJTMUTADVCB-OAQYLSRUSA-N 466.347 0.893 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CCCC1)CCO2 1830319184 SSMCZQLWTIBKBJ-SANMLTNESA-N 492.381 0.948 50 20 JCGD O=C(c1ccnc(C(F)(F)F)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724590 IJZHIVPSPDYPNA-GUYCJALGSA-N 451.829 0.770 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)s1 1830733404 LFXXSLXJFJBKFZ-KUHUBIRLSA-N 460.936 0.133 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1831645683 CZVLXCWUIXNMJW-MGPUTAFESA-N 451.911 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H]2CCNC(=O)C2)CC1 1831941914 ZXZSBLVYUKQNPU-LPHOPBHVSA-N 456.547 0.445 50 20 JCGD Cn1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)n1 1832549665 WJSPUNIZTYFPNR-XOBRGWDASA-N 486.957 0.017 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cncnc3)CCO2)C1 1833121808 WCUAMKHZQZNWPL-QHCPKHFHSA-N 499.480 0.623 50 20 JCGD CCc1[nH]nc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1F 1834038285 GMKBALRWDQFWLN-UHFFFAOYSA-N 471.342 0.290 50 20 JCGD CC[S@](=O)CCC(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835117645 HNOXSKHOZOWVCQ-BDZTZUHNSA-N 492.646 0.851 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccc2c1OCC2 1835286369 PFTXZIPQCKLETN-UHFFFAOYSA-N 477.370 0.800 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1 1835934217 QDCSUNGCGGGPAI-OFNKIYASSA-N 456.279 0.147 50 20 JCGD Cc1ccc(SCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835937387 SOFZQFPTFKMCAF-XMMPIXPASA-N 484.383 0.537 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)CCO2)C1 1836215745 MSLBQQPHTVJPQL-GEYWLOKFSA-N 489.997 0.831 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1836297376 RNUIXZPFFUPSGL-UHFFFAOYSA-N 465.359 0.874 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1 1836962102 HPGCPRJWJDTLPM-FOIQADDNSA-N 454.886 0.797 50 20 JCGD O=C(Cc1ncccn1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837210274 ABVDJIRBSRKXAQ-UHFFFAOYSA-N 452.320 0.011 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncsc4[nH]3)C2)C1 1837458803 DEPANFFNVGDHTK-NRFANRHFSA-N 485.526 0.007 50 20 JCGD Cc1cnc2c(C(=O)N3CCC(OC4CCN(C(=O)c5ccc(B(O)O)cc5)CC4)CC3)cnn2c1 1837919195 PMUQLKMYSWLOFO-UHFFFAOYSA-N 491.357 0.644 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922101 LEXFTGYNBNTKQB-QHCPKHFHSA-N 471.407 0.851 50 20 JCGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1 1838023088 NEGXSTKIWNXWLJ-UHFFFAOYSA-N 458.306 0.229 50 20 JCGD CN(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cn1 1838196520 MSQRNYFKEJPZRR-YJBOKZPZSA-N 459.316 0.908 50 20 JCGD O=C(c1cc(Cl)ncn1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1838259196 SUILBDFYBWEWBA-SWLSCSKDSA-N 451.680 0.891 50 20 JCGD O=C(c1c(O)cc(O)cc1O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201530 AGVDEQXHKPEXLH-PBHICJAKSA-N 463.256 0.564 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1839210464 PZSDOIKFGOVYKY-XFQAVAEZSA-N 477.986 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C#N)ccc1F)CCO2 1839422500 XOQNKLPJQGGJQN-JOCHJYFZSA-N 461.494 0.140 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839518611 UTXHZYFEXQLMRE-RTBURBONSA-N 461.346 0.972 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1840031205 ISLLMEQFYYXILX-BLLLJJGKSA-N 460.285 0.031 50 20 JCGD CCc1nn(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1Cl 1840183785 ZYZBPKFYUKMESK-OAQYLSRUSA-N 484.985 0.079 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1 1840185836 YEHBBSROSNIUCV-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD CN1CC(C(=O)N2CCO[C@]3(COCCN(C(=O)/C(C#N)=C/c4ccc(F)cc4F)C3)C2)C1 1840572269 PXDSFASOVCXQPY-KUCZMUFWSA-N 460.481 0.890 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840652483 PGTLWDGLWHNVMC-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840895270 NHTDJLCEZBCMBZ-YVEFUNNKSA-N 494.433 0.334 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840898425 HKKOTUTWGYWGFU-VFUOJUBFSA-N 495.297 0.058 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2 1840951153 HHMRGIDJWWQTES-RTWAWAEBSA-N 458.506 0.561 50 20 JCGD COC1(CC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)CN(C(=O)OC(C)(C)C)C1 1843014053 SMFWBNORFPICPF-UHFFFAOYSA-N 487.362 0.209 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265432 BIRAESHNHSLBAS-FQEVSTJZSA-N 482.516 0.389 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)Cn1ccccc1=O)C2)NC(=O)NCc1ccccc1 1845038747 NSKCMRYCLLFYSH-UHFFFAOYSA-N 466.542 0.398 50 20 JCGD COCc1oncc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038883 CVZPDLCLGBCQAP-UHFFFAOYSA-N 470.530 0.984 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1 16231267 LEHHZJLJTCYITA-CQSZACIVSA-N 488.526 0.400 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)s1 725873759 PZWOFSLQQPVPFU-UHFFFAOYSA-N 487.585 0.091 50 20 JCGD O=C(CCOc1ccccc1)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 747102385 WVCBJAFDWLGTSA-UHFFFAOYSA-N 451.461 0.673 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)c1 788881356 GKZRNFRJIBULLQ-UHFFFAOYSA-N 493.567 0.292 50 20 JCGD O=C(COC(=O)CN1C(=O)COc2ccc(Cl)cc21)NNC(=O)c1ccc([N+](=O)[O-])cc1 818125395 CVKMQDFOSVEJQN-UHFFFAOYSA-N 462.802 0.978 50 20 JCGD O=C(COC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)NNC(=O)c1cccc([N+](=O)[O-])c1 848978788 UJTUDJYRLNLOIM-AWEZNQCLSA-N 484.421 0.723 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1 856531753 DVWSPPBXNXCOTN-FHQLIMNDSA-N 451.527 0.153 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1 913455066 HQWXIIYGIHNXIK-UHFFFAOYSA-N 453.274 0.808 50 20 JCGD Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)cn1 915057895 KDNYHLDGWFJZIE-UHFFFAOYSA-N 480.510 0.407 50 20 JCGD CN(C)CCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1 916383007 WLYNLVQJXYWPDV-UHFFFAOYSA-N 466.608 0.441 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Cl)nc1 917251160 SUCIHWJWLMUDJH-AWEZNQCLSA-N 468.919 0.738 50 20 JCGD COc1c(Br)cc(Cl)cc1S(=O)(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 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CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ncccc3Br)C2)C1 1779655040 XHABIJIXKUIQBZ-IBGZPJMESA-N 468.352 0.661 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)nc1 1780967144 REMCZGRFOYIAJD-DEOSSOPVSA-N 482.541 0.690 50 20 JCGD COC(=O)C1(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)CC1 1780969401 ZTJLUKPGKNLMAI-HSZRJFAPSA-N 487.557 0.116 50 20 JCGD COc1cc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1[N+](=O)[O-] 1781190651 UZNNSOMUWMEMRR-QHCPKHFHSA-N 498.496 0.288 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1C(=O)C=CC1=O)C2 1781997512 ZCPUNUONSHKNBU-IQUTYRLHSA-N 456.337 0.599 50 20 JCGD CSc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1O 1783934996 MLGNTFRBXFUUKW-NRFANRHFSA-N 450.561 0.931 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)CCO2 1783936933 LRCFOBPVCJFQIZ-SBUREZEXSA-N 481.594 0.589 50 20 JCGD COCC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)CC1 1784471200 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1834736381 OKACMGCJKGOGBJ-HZPDHXFCSA-N 460.417 0.324 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834800469 HRSZVFIOLHZTMI-SFHVURJKSA-N 480.374 0.414 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835767863 WFBCLBPUJBWHJY-NWJFTTBMSA-N 486.378 0.081 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(Cl)c1 1835941831 RBBOFHGJRXMBCR-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD Cc1cccc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)[nH]c12 1836853894 IHMGPRSJDNSBCF-VWLOTQADSA-N 477.326 0.540 50 20 JCGD CC#CC[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1837612868 OGQFDDUCJOBLSA-SQHAQQRYSA-N 490.365 0.634 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc(Cl)c(Cl)c1)CCO2 1837916257 YQJHZBHMIZQORQ-OAQYLSRUSA-N 494.140 0.452 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ncccc1C(F)(F)F)CCO2 1838144555 HVTXXODHNNSXKP-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD CN(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cn1 1838196518 MSQRNYFKEJPZRR-MAUKXSAKSA-N 459.316 0.908 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C(C)C)[nH]n1)CCO2 1838697128 YAEVXIMLRMXDFW-AJPHYDNBSA-N 485.545 0.737 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1839079719 KBUJNIWBUPUEFH-WEMPKCCASA-N 496.402 0.172 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1 1839197828 JIQNOFRFPDNRKQ-CRAIPNDOSA-N 473.299 0.801 50 20 JCGD O=C(c1ccnc(Cl)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200063 CPYHKCLGRUACDP-ABAIWWIYSA-N 451.680 0.891 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(N4CCOCC4)c3)CCO2)C1 1839344849 BUIKPFNTCQXGPH-NFBKMPQASA-N 481.977 0.847 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622388 BLMSDSQTLKUMLB-MGPUTAFESA-N 484.395 0.572 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839744240 WGGDDDFYZRNRDS-KPCRFSNUSA-N 476.480 0.853 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnn(C)c3)C2)C1 1839964125 HJSWCBGFYYOLCF-APWZRJJASA-N 457.369 0.983 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1 1840035504 UKVHHLFNQJVWRH-RRMPHLOHSA-N 479.375 0.992 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(OC)cc3[N+](=O)[O-])C2)C1 1840155035 NOOJSRUQADSQJA-DYESRHJHSA-N 485.921 0.856 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185102 IQXRGFRWRKSYPO-DEOSSOPVSA-N 489.573 0.071 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840714594 ZUTWWCGVCKQSRW-CJAUYULYSA-N 477.326 0.377 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1 1840957149 LYBRYYYZNDKXAQ-HTAPYJJXSA-N 489.997 0.690 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C[C@@H]2C[C@@H]21 1843010427 OJPNEARZXACSIA-WDSOQIARSA-N 469.347 0.581 50 20 JCGD O=C(Cn1ccc2sccc2c1=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010627 MIFWTOMGPAOKNM-UHFFFAOYSA-N 451.313 0.260 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccccc1F 1843014579 BBXDOWPAXSVVNM-HSZRJFAPSA-N 467.306 0.374 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2COCCN2C(=O)OC(C)(C)C)C1 1843347550 JOWVPFLHEXCDTI-INIZCTEOSA-N 467.567 0.199 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1)C(=O)C(=O)O 1845942817 ZLIXAMPZRXDNKG-OAHLLOKOSA-N 466.332 0.739 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CNC(=O)c1cccnc1)NC(=O)NCc1ccccc1 1848138062 GCCCIDGTTBDIKA-SFTDATJTSA-N 493.568 0.359 50 20 JCGD COCCCNC(=S)N(C)NC(=O)Cc1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1 726076321 YWISKYFZTCPPHF-UHFFFAOYSA-N 474.605 0.133 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(S(=O)(=O)N(C)C)c1 727609538 LCXIBBUVQYFCEH-ZDUSSCGKSA-N 472.527 0.889 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)cc1OC 730620196 NRBHIDWQWCFVRB-INIZCTEOSA-N 499.476 0.832 50 20 JCGD Cc1cccc(N2C(=O)N[C@H](CCC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)C2=O)c1 730868093 YUFZWNBLUHBJDU-VQIMIIECSA-N 496.476 0.731 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CCNC(=O)NNC(=O)c2nnc(O)c3ccccc23)CC1 744896140 LVFXTQIKEQLZAB-UHFFFAOYSA-N 459.507 0.832 50 20 JCGD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NNC(=O)N2CCOCC2)CC1 745992988 QWUBKUJHUPBFRX-UHFFFAOYSA-N 455.493 0.377 50 20 JCGD COC(=O)c1c(C)cccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 747408188 ACPYKJZQZDFZAY-UHFFFAOYSA-N 455.514 0.655 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)C[C@H](C)O1 751210149 ATTZEJNJWLQJHM-KBPBESRZSA-N 480.568 0.737 50 20 JCGD O=C(CN1CCC(NS(=O)(=O)c2cccs2)CC1)NNC(=O)c1ccc([N+](=O)[O-])cc1 809931128 FARNXXNLUNVQOT-UHFFFAOYSA-N 467.529 0.860 50 20 JCGD O=C(c1cc(S(=O)(=O)NC[C@@H]2CCCO2)ccc1Br)N1CC[C@@H](B(O)O)C1 864232667 AXSNEWPFZQTQCK-NEPJUHHUSA-N 461.143 0.595 50 20 JCGD Cc1cc(N2C[C@H](C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)CC2=O)ccc1Br 914445371 XHBRCHPVMTYDAU-VXGBXAGGSA-N 458.334 0.693 50 20 JCGD O=C(NNC(=O)C1CCCC1)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1 914842759 MMOSJOCSSUOKFV-UHFFFAOYSA-N 466.560 0.495 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)N2CCOCC2)o1)NNC(=O)c1ccc(Cl)cc1 914980482 BQDRLNKNTFJWJZ-UHFFFAOYSA-N 471.875 0.572 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 915357458 LMPLFAGVWGICLX-UHFFFAOYSA-N 472.570 0.040 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 916649355 LBJJRQBPCRYULH-GOSISDBHSA-N 464.500 0.282 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc(C)cc3O)cc2)CC1 918341205 ORBBVZPFBJZETF-UHFFFAOYSA-N 460.512 0.628 50 20 JCGD Cc1cc(CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)no1 920235063 GFCJJNQNQVJKLC-UHFFFAOYSA-N 451.505 0.467 50 20 JCGD O=C(NCCc1cccs1)NNS(=O)(=O)c1ccc(N2C[C@@H](C(=O)O)CC2=O)cc1 920833107 YYFJYUKFSKLDBH-LBPRGKRZSA-N 452.514 0.921 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1778551335 DGWNCJPFHXAFRZ-NMWDDECMSA-N 469.502 0.243 50 20 JCGD Cc1ccn2ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c2c1 1779030263 NBESZWKXTUEMDK-HSZRJFAPSA-N 463.498 0.399 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030714 VIAISEWVWJHSTE-HSZRJFAPSA-N 467.482 0.427 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1F 1779033997 HNAZHJBXFGOBAJ-HSZRJFAPSA-N 471.489 0.519 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)C/N=C/c3ccco3)C2)C1)NC(=O)NCc1ccccc1 1779139969 PFIZPPSZMPMDLV-IAWFGPOKSA-N 496.568 0.875 50 20 JCGD CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)n(C)n1 1779764272 YAIHIJOSKQSJBR-AUSIDOKSSA-N 469.546 0.422 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc[n+]([O-])cc3)C2)C1 1779879965 JNVRMTIDNAAGBU-KKSFZXQISA-N 468.938 0.896 50 20 JCGD Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)n[nH]1 1780266404 VTRLUSHWPVQAQL-HSZRJFAPSA-N 469.546 0.508 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1F 1782108552 AEWYPHBDEGHIDR-HSZRJFAPSA-N 473.285 0.468 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(Cl)cn1)C2 1782208961 DDXWRFMCKLXUQT-FOIQADDNSA-N 452.943 0.631 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(Br)cnn1C)C2 1782212114 VLKHFFZRGDRIDN-FOIQADDNSA-N 499.410 0.683 50 20 JCGD N#Cc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1783913492 QQQKNLZDZMVIBE-NYVOZVTQSA-N 476.537 0.783 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1F 1783933856 JOFLWQKWMAWCJY-QFIPXVFZSA-N 484.500 0.799 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1c(Cl)ccc3c1OCO3)CCO2 1783934518 GMNPJEOQZUSNIN-OAQYLSRUSA-N 466.922 0.885 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)cn1 1783946224 YSUXAXQJZKHONZ-QGZVFWFLSA-N 450.344 0.873 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)CSc3nc[nH]n3)C2)C1 1784393912 WTIUJWZQNLEEDB-FQEVSTJZSA-N 490.498 0.874 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1784429220 DMLGXSBKGTYORD-NHKCCNDQSA-N 478.354 0.772 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1784441266 JTKHLEZTPMIHDT-RFGFWPKPSA-N 454.387 0.079 50 20 JCGD CN(CCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)C(=O)OC(C)(C)C 1785586226 PTLFERGIJKGPMM-DEOSSOPVSA-N 489.378 0.457 50 20 JCGD Cc1c(F)ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1N 1786947849 WEMNAHMAEOQITD-QSFXBCCZSA-N 455.295 0.303 50 20 JCGD C=CCCc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(O)n1 1786980227 XTEJVCFBSKLVNR-HSQYWUDLSA-N 479.342 0.493 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)c(F)c3)[C@H]2C1 1789650998 NBKLQRDZZKLQCM-AXHNFQJDSA-N 459.453 0.870 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)c[nH]3)C[C@@H]21 1791291070 KLAKEYSTKIHFRO-NOLJZWGESA-N 459.469 1.000 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@@H]1CCCN1Cc1ccccc1 1791466279 HXRRZFFEXFCVDJ-LFBFJMOVSA-N 491.397 0.624 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1ccc(F)nc1 1794020057 SGNOCIVSDBMTMO-YVWYUNDQSA-N 456.478 0.055 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)nc1F)C2)c1ccc(B(O)O)cc1 1795732520 PVOADPKBHADDAA-FVCICTRLSA-N 492.110 0.180 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc3ccccc13)C2)c1ccc(B(O)O)cc1 1795732851 NDEMOHMIKNCBBP-NXKWYNOOSA-N 474.322 0.802 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796189769 YERVJZUNZNOFIK-FZDIXFNVSA-N 459.352 0.779 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(C2CCN(C(C)=O)CC2)CC1 1797280376 ZQWXPSHEKJPJLE-MXNKGDRCSA-N 499.052 0.553 50 20 JCGD O=C1CC(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)=NN1 1797683719 OIGHNTSBADQXEI-KRXQYRFLSA-N 463.332 0.458 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(Cl)cccc3n1)C2 1797750765 PMNGFEVPSFMPBQ-DBWKPXFBSA-N 483.916 0.503 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1797972311 WAAJLLHGEFCLJK-GPFWXFEWSA-N 476.480 0.612 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOCCOCCOCCOC)C2 1799268126 LFDFQULQJHZMBK-DMUMMCEESA-N 464.987 0.680 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cc2ccc3ncnn3c2)[C@H]1c1cccnc1 1807408352 KQXCDFLETCVLQG-FDDCHVKYSA-N 499.535 0.685 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808430018 HBMCNROLNZWNNM-CFLQYTFWSA-N 467.530 0.267 50 20 JCGD C[C@@H]1CC[C@H](C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)O1 1810301946 DZNWHHDANIHYSA-BGRCLHOASA-N 452.515 0.967 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303250 RIOKBZNITSHPAQ-QLVMHMETSA-N 481.557 0.705 50 20 JCGD Cc1nccnc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1811086568 NUULAGKDIXVTEF-OXQOHEQNSA-N 460.498 0.812 50 20 JCGD COC(=O)C12CC(C(=O)NC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)(C1)C2 1812839540 ZKCGAAGNJJLMTJ-SAWFIPJVSA-N 471.558 0.804 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@](C)(O)C(F)(F)F)[C@@H]1c1cccnc1 1813067790 DNRMHFIJVCXPGW-POZUXBRTSA-N 459.469 0.774 50 20 JCGD COC(=O)NCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1813267042 MPJGPLBGSRSWDQ-VQMZYRHSSA-N 469.502 0.577 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362046 ZUQHMGYNXQMXQS-OAHLLOKOSA-N 488.375 0.964 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817477270 QJTKBENVTFBQHL-YWZLYKJASA-N 490.329 0.609 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1819355077 IWGABOPRNHUQQG-UKRRQHHQSA-N 450.544 0.482 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1n[nH]cc1[N+](=O)[O-] 1819656533 HDZIDSVOFADFMQ-AWEZNQCLSA-N 453.224 0.341 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](O)Cc3ccccc3)sc2C1)c1cccc(B(O)O)c1 1825429476 USVHNDWYNSVXTL-IEBWSBKVSA-N 465.340 0.652 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825504777 YVGLLXRAJLLJHH-CQSZACIVSA-N 474.348 0.573 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057503 GLBHFHBEUICJIM-UWJYYQICSA-N 457.380 0.905 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060213 SJSHTHHRUORUFY-VXKWHMMOSA-N 457.380 0.905 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829049848 HRWWXQHYXVIIFN-DYESRHJHSA-N 453.352 0.528 50 20 JCGD NC[C@H](N)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc2ccccc2)C1 1829055918 DYPMYGUMYYWHQU-RZQQEMMASA-N 455.918 0.259 50 20 JCGD O=C1C[C@@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CN1Cc1ccccc1 1830726847 UORYBZPKHUUYLJ-DNVFCKCGSA-N 479.961 0.091 50 20 JCGD O=C(c1ccc(Br)cc1O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733541 OZQUKQUTPYUZMS-YJBOKZPZSA-N 477.739 0.824 50 20 JCGD O=C(c1cnc(-c2ccccn2)nc1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833289767 ZPPVCBBEGPPRSB-DYESRHJHSA-N 461.906 0.208 50 20 JCGD CC[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1ccccc1 1834749543 YHRMHNVPRHLJFX-RDGATRHJSA-N 466.343 0.630 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cn2ccccc2n1 1835298773 AOWWFIXJLKLQIF-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccccn3)CC2)CC1 1835736947 BHWVAOSWCJKMIC-UHFFFAOYSA-N 451.531 0.579 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)/C=N/N3CCCCC3)CC2)CC1 1835738124 URXUKSHAHMDDJD-WPWMEQJKSA-N 484.605 0.342 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)N3CCOCC3)CC2)CC1 1835765095 JCJNDVPXTWIMSS-PXNSSMCTSA-N 475.428 0.382 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C)c1 1835931348 NKWLQMPRSNAUNT-XMMPIXPASA-N 452.316 0.367 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc(C)c1C(=O)O 1835932125 OWXAKIWQQZEOKV-VWLOTQADSA-N 496.325 0.065 50 20 JCGD O=C(CCc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935501 HZJHSWQFTLCGQK-DEOSSOPVSA-N 452.316 0.069 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCCC1(F)F)CCO2 1836626344 JRWWQOGNYHIDTF-RTWAWAEBSA-N 499.490 0.673 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1 1836866975 TZOFVBHUOIISMD-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD COc1cc(C)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459533 IODMCAHXFLEDKO-DEOSSOPVSA-N 483.525 0.386 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc[nH]1)CCO2)NC(=O)NCc1ccccc1 1837787454 PSVBLEWIWHVAGS-XMMPIXPASA-N 484.557 0.431 50 20 JCGD COc1ccnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1OC 1838841694 IVQOEUTYACQULY-YJYMSZOUSA-N 472.336 0.952 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)ccc3Cl)CCO2)C1 1839327174 UAFFHTHJEWYFGM-JOCHJYFZSA-N 491.907 0.861 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)CCO2 1839397402 RFDBJMUDOHZZPB-XMMPIXPASA-N 484.557 0.520 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1840153141 FWENKEJMBUYMMY-DQLDELGASA-N 467.906 0.431 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C(/C)C(=O)O)CCO2)C1 1840838179 RLCWVBUHMBUXHG-VKVQTHCXSA-N 491.453 0.621 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)C(C)(C)O 1840916502 MJBMPAXTDUUHEK-JZKQVHKSSA-N 481.949 0.641 50 20 JCGD CCn1nnc2c1[C@H](C(=O)N1CC3(CCCN3C(=O)[C@@H](O)CCl)C1)CN(C(=O)OC(C)(C)C)C2 1841350134 JJOLYALXZJBHSX-ZBFHGGJFSA-N 496.996 0.935 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCCC23CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)n1 1842163651 LRHXCEZPAVIKAT-VULFUBBASA-N 451.487 0.991 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2ccc(S(C)(=O)=O)cn2)C1 1842255083 MLGCTNYAUZZXPB-ZVHZXABRSA-N 472.527 0.436 50 20 JCGD C[C@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)N1C[C@H]2C[C@H]2C1 1844192478 RRZMNKCAKCJWDR-NRSPTQNISA-N 468.602 0.876 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265570 PPIKOWBHYFCGEA-OYLFLEFRSA-N 484.557 0.972 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)C1 1847726056 GCSULMKXQFRXJK-OALUTQOASA-N 455.320 0.359 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@H]1CCCOC1)N(S(C)(=O)=O)CC2 727849317 XLJYKHJDNHEDKR-HOCLYGCPSA-N 455.533 0.527 50 20 JCGD O=C(COC(=O)CCc1nc(-c2ccccn2)no1)NNC(=O)[C@@H]1COc2ccccc2O1 728323363 DNMWRXICEWFWBX-INIZCTEOSA-N 453.411 0.595 50 20 JCGD Cn1c(CCC(=O)NNC(=O)c2cccc(C#N)c2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 728827406 NXXCTDUOPUOLQO-UHFFFAOYSA-N 496.549 0.860 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccnc(F)c1)N(S(C)(=O)=O)CC2 748833857 DKXAWUJXWPEKLG-OAHLLOKOSA-N 466.491 0.948 50 20 JCGD NC(=O)CC[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCO2)C(=O)NNC(=O)c1ccc(Cl)cc1 767041396 IEUUPMQVCVBFJY-OAHLLOKOSA-N 496.929 0.485 50 20 JCGD CCCCn1c(N)c(N(CC(C)C)C(=O)CCC(=O)N2CC[C@@H](B(O)O)C2)c(O)nc1=O 864234799 WHCFXXJOCRONFA-CQSZACIVSA-N 451.333 0.176 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)[C@H](C)NC(=O)C(C)(C)C)N(S(C)(=O)=O)CC2 875695144 XZRYMNNVJNMPEU-XJKSGUPXSA-N 498.602 0.651 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1)C(=O)NC1CC1 891873989 IZBHXICFOYBPQA-UHFFFAOYSA-N 478.449 0.412 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1 913156149 WDKJDZKSKVMFMB-UHFFFAOYSA-N 494.331 0.554 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)NCCC(=O)N2CCOCC2)c2ccccc2c1=O 916251409 MTZMDCAWHINGHJ-UHFFFAOYSA-N 458.519 0.780 50 20 JCGD O=C(NCCCNc1ccccn1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916576581 SHQCEZCCFRHYKS-UHFFFAOYSA-N 462.532 0.549 50 20 JCGD CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)s1 918399164 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CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CN(C(=O)OC(C)(C)C)C2)C1 1778760073 CNWTWOHABOIRIR-HOYKHHGWSA-N 495.621 0.740 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1779029645 WNKYROOSTMLHPF-CKNGIIGNSA-N 473.530 0.108 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779033777 DTTHPYGLYAWRRC-HSZRJFAPSA-N 471.489 0.519 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn3ccnc3c2)C1 1779045707 ZHOYEZWZJUMQOP-WZONZLPQSA-N 456.547 0.835 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3[nH]cnc(=O)c3c2C)C1 1780020255 WZZFKNLPKMXJOJ-GCKMJXCFSA-N 465.938 0.712 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)C1 1781113004 XWLJSNPOKRTRIZ-QEEYODRMSA-N 490.395 0.829 50 20 JCGD Cc1nc(N)sc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782210881 VSXNXDJBBGXFQD-JLTOFOAXSA-N 452.581 0.534 50 20 JCGD C[C@@H](Cc1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782593233 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JPNNIGCVXBAUES-IRXDYDNUSA-N 455.408 0.163 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1839965488 ZQENIWLQALUZNS-KXBFYZLASA-N 466.336 0.973 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c4c(nn3C)CCC4)C2)C1 1840035220 KDYSSMYDWVPFQF-DJJJIMSYSA-N 455.353 0.762 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(=O)Nc3cc(C)on3)C2)C1 1840152854 WXGSYXKZMVDAAT-IFXJQAMLSA-N 458.899 0.022 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)CCCO3)CCO2 1840659709 HIZKWPHRBJKSOH-RUZDIDTESA-N 480.326 0.075 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1843886025 GNOHHOMQLGVTCD-HKUYNNGSSA-N 489.353 0.779 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)/C=C\C(=O)NC1CC1)C2)NC(=O)NCc1ccccc1 1845038968 ORDPTMCCBQPRJV-KHPPLWFESA-N 468.558 0.371 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1CCC(=O)N1C)C2)NC(=O)NCc1ccccc1 1845039082 AVUUKZRUDCJWJG-SFHVURJKSA-N 456.547 0.157 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)CO2)C1 1847564210 VCXIAAZUHVAIRK-UGUYLWEFSA-N 457.955 0.814 50 20 JCGD CN(C)c1cccc(C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1 14849638 FUIWBNQAUVHFFH-GOSISDBHSA-N 482.584 0.295 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)cc1OC 16230098 HZTFWBAPHVWZIW-UHFFFAOYSA-N 452.489 0.138 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](NC(=O)c2cc(Cl)ccc2F)[C@H](C)O)n1 728729998 YDHOCFPTSNQRLP-DYZYQPBXSA-N 486.909 0.657 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 730490471 ZQOBCPRADCETJQ-MRXNPFEDSA-N 464.569 0.867 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl 744447037 SEEMWQBOQUPMKQ-UHFFFAOYSA-N 467.331 0.300 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccc(C(N)=O)s1)N(S(C)(=O)=O)CC2 749718985 AGQPPUUATVPPAX-ZDUSSCGKSA-N 496.567 0.574 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccccc1F)C(=O)NNC(=O)CCN1C[C@H](C)O[C@H](C)C1 912920237 ZQRPYRQRFHHCEF-HLLBOEOZSA-N 490.623 0.872 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc(OC)c1OC 912920826 DUWZEXTWFHXJIV-KBPBESRZSA-N 452.508 0.089 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)C1CCCC1 914849385 ZFYKODTWOAHCAM-OAHLLOKOSA-N 465.981 0.759 50 20 JCGD COc1cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc(C(=O)O)c1OC 917728944 YAXGOXHEVVWPDE-UHFFFAOYSA-N 451.457 0.967 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O 918539497 IIXKOGSDBRPWLK-UHFFFAOYSA-N 497.577 0.967 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccccc1Cl 1317716387 FAHOYMIBVHKFME-INIZCTEOSA-N 473.960 0.883 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)[C@H]2SC(=N)NC2=O)C1 1778083247 PWPMONYZFBVMAW-QEAYJNAZSA-N 460.984 0.557 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cn[nH]c1)C2 1778091492 HQYUBWPRBHLICK-VJDWAPLVSA-N 469.546 0.990 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)ccn1C)C2 1778092512 DOMUWBLBOXBHLW-DTCCYRCBSA-N 482.541 0.647 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)C1 1778239796 VVLJQWIOYNFRIQ-GAJHUEQPSA-N 481.594 0.446 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1778898944 HILYDDLMZLKQCO-AMAFCZHPSA-N 473.408 0.056 50 20 JCGD Cc1ccc2oc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cc2n1 1779030416 QJEQKSOIZKAHEY-HSZRJFAPSA-N 464.482 0.892 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(C(N)=O)cc1)C2 1779374872 FUZPYHFKCVOEPE-NTKDMRAZSA-N 480.525 0.225 50 20 JCGD CCOc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)nn1 1780239093 ARGYGYBXFPJZNW-WZONZLPQSA-N 483.529 0.315 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780939369 YUTGXKUYNZDXAO-IFXJQAMLSA-N 485.404 0.895 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccccc3-n3nccn3)C2)C1 1781839369 JAOCMTIEGSGGMN-HSZRJFAPSA-N 476.497 0.023 50 20 JCGD O=C1C[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)CN1 1783022317 KABDWNFYTFHHDR-FVJLSDCUSA-N 464.360 0.959 50 20 JCGD CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)CC1 1784085758 OQYQEDAKMGXMQG-QAETUUGQSA-N 489.997 0.328 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1784243374 DCFQOEJMZHUUJI-VWLOTQADSA-N 465.359 0.509 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(N)s3)[C@H]2C1 1786933562 ANDZZAUBBGNRMR-RJSLJBRQSA-N 459.532 0.453 50 20 JCGD CCC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)n1cccc1 1786982893 GPLFWFKYTBWQME-UVUJQTEASA-N 453.348 0.803 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)NC(=O)CO4)[C@H]2C1 1788364151 UZFLWMWOOVINCD-AFIMGQEJSA-N 451.907 0.865 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1 1789867545 FSPVCAHOLSDIGU-PYXYIPKBSA-N 458.408 0.530 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1789929159 JCBNDDUZFZHKFJ-YTFOTSKYSA-N 496.374 0.932 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](O)CCl)C[C@@H]2C1 1792983776 NLVCSCHAWUCJQC-HAOOACFXSA-N 471.982 0.823 50 20 JCGD COc1ccc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)ccc2c1 1795738805 GSELQHGIVWFMAS-FEJSZKPUSA-N 475.310 0.440 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@H](F)Cl)C2 1796370594 NDLHHCOZSXJTQG-FVFNWAJOSA-N 456.902 0.746 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nccn2c1 1797078374 KPPRDJSZZWPWCQ-KEMUROEHSA-N 463.498 0.672 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)nc2ccc(Cl)cn12 1800089407 VUFOTFGSZOGKLI-USGNIVHTSA-N 476.965 0.872 50 20 JCGD COCCOCCOCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Cl)COC)C2 1800206401 HCTMZLXQESYGEI-FCGDIQPGSA-N 464.987 0.965 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(CNC(=O)OC(C)(C)C)CC1)C2 1801009267 XSMUUXWFAIEVNT-HGKCTWBKSA-N 481.594 0.254 50 20 JCGD Cc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)no1 1801277424 MCZWQNMJWJVQEF-BBIADKPPSA-N 484.557 0.461 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C2 1802329090 HJLCSILRRQNEPN-ZRSRNVLSSA-N 495.621 0.616 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803143193 WOCYTLUZRJFBQB-OWSLCNJRSA-N 455.895 0.182 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1803162137 ZUMUAVSJRXDINQ-CEMLEFRQSA-N 450.348 0.565 50 20 JCGD CC(=O)N(C)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1804070325 STKFOBNTOQFAMS-LAUBAEHRSA-N 467.530 0.268 50 20 JCGD COc1cccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1805208880 QVJRONBGOUTYCA-GCJKJVERSA-N 460.299 0.798 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N3CC[C@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)c21 1807362601 VZEYHJSJRDENEY-XMSQKQJNSA-N 499.336 0.987 50 20 JCGD CCOC(CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)OCC 1807363695 BDPQNOAKRFVDBJ-AUSIDOKSSA-N 469.347 0.870 50 20 JCGD CN(C)c1ncc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1 1807369675 RNPAUDWIBZSEPF-PXNSSMCTSA-N 463.303 0.449 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1 1809333191 HQYHQWYXWZLZOH-UTKZUKDTSA-N 464.530 0.817 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809973218 ARUWVVVRYGYQOD-RTWAWAEBSA-N 468.359 0.967 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(C)C 1810099656 FNOFOFZFTYTDLG-BVSLBCMMSA-N 467.331 0.669 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1 1810293735 GMMYZYOHEYXVGI-YWZLYKJASA-N 493.484 0.205 50 20 JCGD CNc1nsnc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810295189 RUWSGMZBLHBGEY-CXAGYDPISA-N 481.542 0.607 50 20 JCGD O=C(C#CC1(O)CCCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810326806 IZDYKDUXJRFLOM-ZJSXRUAMSA-N 475.354 0.780 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810474894 FKLRUVQFIAXYJY-OZOXKJRCSA-N 462.319 0.009 50 20 JCGD Cc1cc(C)n(CCC(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1813304838 FWYIDCFTYACLHE-XUZZJYLKSA-N 475.358 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cc2ccc(O)cn2)[C@H]1c1cccnc1 1813497168 SMYILFMLNMRRIM-KSFYIVLOSA-N 475.509 0.743 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1 1814767728 HLYUKNKOWFYRFF-JTQLQIEISA-N 450.530 0.631 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@@H](O)CCl)n[nH]2)CC1 1814871364 ODEIKQRUFQLERA-CABCVRRESA-N 461.972 0.673 50 20 JCGD Cn1c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cccc1=O 1815337975 YGNZNFCUYOVULL-CQSZACIVSA-N 452.301 0.061 50 20 JCGD Nc1c(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)sc2nccnc12 1815354937 XWSXDEHDCGLSHE-LBPRGKRZSA-N 494.367 0.949 50 20 JCGD C[C@](O)(C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(F)(F)F 1815528377 UMIHQZZWVNPFLN-KSSFIOAISA-N 454.214 0.709 50 20 JCGD Cc1c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn2[nH]cnc(=O)c12 1817472053 DYNUEHAXXJOIAJ-SFHVURJKSA-N 489.301 0.354 50 20 JCGD CN1CCN(CCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)CC1 1817475198 MOHUHNGOHQCAEN-HXUWFJFHSA-N 468.367 0.033 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817475362 OEEIMOMBVYRBOA-HXUWFJFHSA-N 464.335 0.988 50 20 JCGD C[C@@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822519010 ZVSQRZCNLHLRGJ-UKRRQHHQSA-N 460.560 0.782 50 20 JCGD C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)CC2 1825640564 BAFSPALEDXPSHX-JGVFFNPUSA-N 466.321 0.883 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826806132 MJZQSHFKWHUTJX-BBRMVZONSA-N 466.328 0.911 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)CCO2 1830568747 JYDNGLASFDFKNZ-MRUHUIDDSA-N 477.986 0.736 50 20 JCGD O=C(c1ccnc(Br)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731485 LUNZJHVXMNFJNX-GUYCJALGSA-N 462.728 0.514 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C[C@@H]2C[C@@H]21 1830747473 FZSYNBASZHZHRU-LOKZHVLNSA-N 487.981 0.440 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1 1830911918 MZJVAGBBPDRSTE-FHOSRQNYSA-N 479.490 0.030 50 20 JCGD CC(C)[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549958 YZPWOKICZZGQJR-CKJXQJPGSA-N 477.986 0.592 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ncccc3OC)CCO2)C1 1832869632 CRSROXVSHLJKPA-IIBYNOLFSA-N 455.939 0.733 50 20 JCGD Cc1nc(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c(C)s1 1833871071 HZZZCOBFYJRFPF-UHFFFAOYSA-N 484.431 0.868 50 20 JCGD N[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccc(Cl)c1 1834731323 UDMWPMGIVFYXME-QHCPKHFHSA-N 498.820 0.905 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737061 UZTJEPLAICLSGZ-MGPUTAFESA-N 459.595 0.244 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cn4ccsc4n3)CC2)CC1 1835737838 GKDNVSMRQILRAR-UHFFFAOYSA-N 496.597 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1csc3c1CCCO3)CCO2 1836391783 ZZIUWSJLDQCEHD-QFIPXVFZSA-N 480.587 0.516 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)c2c1 1836923798 VCSXNKMCUMLLKK-VWLOTQADSA-N 493.325 0.240 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836990144 VKCJBRCXXVWVMZ-UHFFFAOYSA-N 474.363 0.710 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1 1837047115 HXVIELKIPMLVOW-LBPRGKRZSA-N 459.341 0.320 50 20 JCGD CN(C)c1cncc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1837260029 GWMDVSYLLABARU-UHFFFAOYSA-N 480.374 0.753 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3coc(Cl)n3)CC2)CC1 1837303047 VOZDYTGARLRDPU-UHFFFAOYSA-N 461.711 0.934 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnnc4ccccc34)C2)C1 1837459454 PODRYURDVMUUFG-XMMPIXPASA-N 491.508 0.012 50 20 JCGD CSc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837461362 VGDGKVPCTHOUMI-DEOSSOPVSA-N 499.593 0.720 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cccc(O)n3)CC2)CC1 1837471839 ADZWMMYYOUALDT-UHFFFAOYSA-N 453.304 0.393 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1837882030 DZCDUPYUTAZZKX-BEFAXECRSA-N 451.395 0.814 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839152173 PUAISTNFLRXKDW-KXWSDFAKSA-N 488.372 0.813 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)c(F)cc1F)CCO2 1839263012 NWLZXFCZZMTFOV-QFIPXVFZSA-N 494.687 0.682 50 20 JCGD COc1ccc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839359604 MUFWCHWOBZPFAW-XMMPIXPASA-N 483.525 0.386 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1839478018 XMJCMJLFAQQAMR-WIYYLYMNSA-N 463.922 0.245 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3nc4ccccc4o3)CCO2)C1 1839502215 ISAVJUBLDJQHHH-HSZRJFAPSA-N 480.481 0.210 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3noc4ccccc34)C2)C1 1840183874 GCDIMWTWPJPNKA-HSZRJFAPSA-N 473.530 0.200 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cc2cn3c(nc2=O)SCC3)C1 1845022031 IEMVRNTURUKIEW-AFUMVMLFSA-N 483.554 0.229 50 20 JCGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1 1845941361 VFLXLSCUHIZMLM-CQSZACIVSA-N 486.330 0.636 50 20 JCGD O=C(Cc1ccc(F)cc1)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 10580135 OYFITRYWSDDXQY-UHFFFAOYSA-N 450.492 0.920 50 20 JCGD CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)c2ccccc2c1=O 24259057 KZBWAXUOYJKFPH-UHFFFAOYSA-N 457.468 0.932 50 20 JCGD CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CNC(=O)c1ccco1 725739301 BONBRNCEUBGWPZ-CQSZACIVSA-N 461.500 0.310 50 20 JCGD O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1ccc(S(=O)(=O)N2CCOCC2)o1 728210132 UMMSSVZAAOFRDH-UHFFFAOYSA-N 470.529 0.498 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(Br)cc1[N+](=O)[O-])N[C@@H]1CCS(=O)(=O)C1 728505511 KBVVSQAPZGHMCR-MRVPVSSYSA-N 457.284 0.037 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)n1 728724429 YQSPTGDGOYKZET-UHFFFAOYSA-N 484.531 0.922 50 20 JCGD CC(=NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(S(=O)(=O)N2CCNCC2)cc1 728783237 FSIOZJVXWVGZLA-UHFFFAOYSA-N 471.587 0.827 50 20 JCGD Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728943761 DTCQKXRDYJXASP-UHFFFAOYSA-N 461.548 0.310 50 20 JCGD O=C(COCC(=O)NNC(=O)Cn1ccc2ccccc21)NNC(=O)Cn1ccc2ccccc21 729662859 YWAOZNPEMXUHIT-UHFFFAOYSA-N 476.493 0.608 50 20 JCGD COc1cc2c(cc1OC)CN(C(=O)CCCNC(=O)NN[C@]1(C)CCS(=O)(=O)C1)CC2 731118949 JZWGMDLPSRFMTD-OAQYLSRUSA-N 468.576 0.750 50 20 JCGD O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)[C@H]1CCS(=O)(=O)C1 745838353 LQLSRGWXIDMORU-OXJNMPFZSA-N 484.534 0.082 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)COc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 749715023 GYZCZSPUOFZENZ-UHFFFAOYSA-N 459.484 0.465 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cc(N(C)C)ccn1)N(S(C)(=O)=O)CC2 749721106 UYKQGPDYBKWUDC-SFHVURJKSA-N 491.570 0.875 50 20 JCGD COc1ccc(C(=O)NNC(=O)CNC(=O)c2ccco2)cc1S(=O)(=O)N1CCCC1 751211410 HLRQQEAOQSEZCF-UHFFFAOYSA-N 450.473 0.264 50 20 JCGD COc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc(Cl)c1OCC(N)=O 839214664 ZAQRXUVDWNBSFX-INIZCTEOSA-N 493.856 0.357 50 20 JCGD C[C@@H]1CN(CCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C[C@@H](C)O1 912924884 XDRLYOQXPFXCEV-QZTJIDSGSA-N 482.603 0.287 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1ccc(COc2ccccc2)o1 912952915 HHHVQUPKTYZHKH-HUUCEWRRSA-N 461.496 0.655 50 20 JCGD COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)c1 913055096 FUNKQTADKPDXHM-UHFFFAOYSA-N 467.500 0.712 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O)NNC(=O)c1ccc([N+](=O)[O-])cc1 915427959 HRTZCNIKIYNZEZ-INIZCTEOSA-N 456.411 0.909 50 20 JCGD O=C(Cn1cnc2ccc(Br)cc2c1=O)NNC(=O)c1csc(N2CCOCC2)n1 915597300 NOIWNMJLCSMTAK-UHFFFAOYSA-N 493.343 0.913 50 20 JCGD Cc1cc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc(S(N)(=O)=O)c1C 916828276 JSWNELDXUWAJNP-UHFFFAOYSA-N 459.572 0.924 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCSc3nnnn3C)c2)cc1 917899290 CONMOJLBTVGQQF-UHFFFAOYSA-N 491.555 0.963 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc3ncc(Br)cn3n2)c1 919807273 BVIKAEAGAFWAPF-UHFFFAOYSA-N 496.347 0.992 50 20 JCGD Cc1ccc(SCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1778088986 NFKNQEOEALNESH-HSZRJFAPSA-N 454.357 0.911 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)n1 1778376836 JWZVYCYUERQSQH-WZONZLPQSA-N 498.301 0.120 50 20 JCGD Cc1ccc(NCCC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c(C)c1 1779115543 CFNTZFDUJSJRJV-VWLOTQADSA-N 465.359 0.929 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2 1779407677 PSNAYPVPZIGHPU-BMHLXIAXSA-N 477.352 0.779 50 20 JCGD O=C([C@@H](F)Br)N1CC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1781325955 KDHUUENWGBIIHX-RDDDGLTNSA-N 453.158 0.862 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)[S@@](=O)c1ccccc1 1782682461 XMKHENBHZANUIY-CXBRMTMQSA-N 470.356 0.006 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1782975598 SZFUZTFALJYMGY-QHCPKHFHSA-N 472.734 0.715 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1783687094 PWCBDNUTHDEEPQ-APWZRJJASA-N 481.384 0.296 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1CCCCC1(F)F 1784653859 UKIDRVDHVUYFEQ-KANFNMMFSA-N 450.291 0.785 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785074485 OHKLGSBSOSQDPW-OXLFWHROSA-N 499.008 0.957 50 20 JCGD CO[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccccc1 1786465561 VMEOJJGOYDOBBQ-JKLQHZFJSA-N 452.316 0.347 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnc(-c4ccccc4)o3)C[C@@H]21)c1cccc(B(O)O)c1 1786983990 JJOQNDJYMZGZSJ-IHPCNDPISA-N 476.298 0.324 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CO)NC(=O)OC(C)(C)C)[C@H]2C1 1787392602 NOXOJHHVWBEDEJ-QXKUPLGCSA-N 492.411 0.883 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508233 BGFCOJAKWYPVET-LUTWIPFYSA-N 474.562 0.405 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)Nc3cccnc3)[C@H]2C1 1788715350 USWJOYVMTCQVRC-VOVAKLSQSA-N 481.513 0.134 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC=O)[C@H]2C1 1789878393 MNIJRFYLHYVHNT-YWKPPDPDSA-N 462.459 0.248 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C[C@@H]21)[C@H](F)Br 1789924583 NGTXSDZSVIUKRY-MXAVVETBSA-N 498.309 0.962 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc(F)c1[N+](=O)[O-] 1790134576 FGVUUBPRQDZOBD-FNHZYXHNSA-N 471.250 0.321 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]31)C2 1790686413 SBLFEQOYNYFSHK-WBOSRHFRSA-N 482.965 0.202 50 20 JCGD CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792978166 IJXPYOUZWNBGKS-QRJUGERDSA-N 480.027 0.822 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCBr)cn1 1795113067 WZNBFOPLMKUFQL-XOIINTDNSA-N 474.377 0.614 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1F 1795492638 VUVVTNADJGZSPK-NGVSDPCNSA-N 484.500 0.558 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)c1cccc(B(O)O)c1)CC2 1795741305 SWUUJRJHPRHGNY-MTXNFPGFSA-N 478.354 0.383 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc([N+](=O)[O-])c2c1OCO2 1796191848 FVVNJZIVEMDGAV-MUJYYYPQSA-N 467.243 0.569 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cc1 1796439878 MBBIREJNEHRZCI-UPGWYZPTSA-N 483.525 0.452 50 20 JCGD CCc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc(C)n1 1797750784 PYCNLYPYUPBXJT-CWPLJXCYSA-N 452.515 0.468 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ncccc1Br 1798185086 BWPFLYPIMYZYGF-XOIINTDNSA-N 474.120 0.041 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1C(F)(F)F 1798845030 GHIYAAHZKHBKIJ-CCWDJLKJSA-N 462.233 0.902 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799348195 CUYHXOSMFDFOTB-XVIXHAIJSA-N 482.347 0.542 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cc(C(F)(F)F)ccn13)C2 1801013207 XBEDUZHHTMKVJJ-VTEUUUEMSA-N 496.490 0.929 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnc(Cl)nc1 1802295212 AFYUBCXDWNJSAK-APWZRJJASA-N 465.706 0.838 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)CN2C(=O)CNC2=O)[C@@H]1c1cccnc1 1804094276 NURPOKPYDGRPJX-AZOIQLNYSA-N 456.330 0.876 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807373919 DJKOICXNENKTCG-SIKLNZKXSA-N 477.330 0.238 50 20 JCGD C[C@@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)N1CCN(C)CC1 1807897799 FZWNBLJDDXTAPA-KPLVRAHFSA-N 494.600 0.036 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302793 NBFGXYOBNZIDDT-PPKSZUAGSA-N 472.571 0.558 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnc(N)s2)[C@@H]1c1cccnc1 1810303396 RMHPNFHTMLFJKT-CXAGYDPISA-N 466.527 0.752 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc(=O)nc3sccn23)[C@H]1c1cccnc1 1811266276 IOKANQLTUSZCDM-IIBYNOLFSA-N 497.581 0.844 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cccc(-n2cncn2)c1 1811822259 CLQOHRVCCVVPRG-QPPBQGQZSA-N 496.336 0.976 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)c2ccccn2)[C@@H]1c1cccnc1 1813070852 LQLBPYAZBNJKSA-BULFRSBZSA-N 453.547 0.555 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1814122717 DIQGGRQSEAAPMW-ILWGZMRPSA-N 466.347 0.386 50 20 JCGD O=C(CCc1ccc(O)nn1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348418 MVQRJBDHCWXBPV-OAHLLOKOSA-N 467.316 0.177 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(O)ncn2)n[nH]1 1815358862 ZDAOMGORWOTTDH-HNNXBMFYSA-N 451.447 0.524 50 20 JCGD O=C1Nc2c(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)[nH]n3)cccc2C1=O 1819194657 QEHSSHSJJNUHFQ-SFHVURJKSA-N 487.281 0.844 50 20 JCGD CN1CCC(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)CC1 1819789984 BPEBPKFWPDQXLM-CYBMUJFWSA-N 457.560 0.709 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc(=O)nc2sccn12 1820081997 NNSLQVIOHLUZFN-INIZCTEOSA-N 492.326 0.779 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(=O)Nc2cccnc2)CC1 1828924488 UVJGPGDUGQAYFA-HXUWFJFHSA-N 479.541 0.952 50 20 JCGD O=C(COCCO)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829055767 BJZVNEPHZVUVKN-RXVVDRJESA-N 471.913 0.982 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1 1830534497 AORANWNPDSMWLE-IFXJQAMLSA-N 462.385 0.636 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1830539124 BODPJLNCRYUVMI-IFXJQAMLSA-N 471.352 0.767 50 20 JCGD O=C(c1nc2ccc(C(F)(F)F)cn2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830723248 MQBUFNFMKZHQCZ-UGSOOPFHSA-N 491.854 0.418 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1831202155 NSRVTOAEAKFRMI-RTBURBONSA-N 452.379 0.986 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NS(=O)(=O)CC)C2)C1 1831640948 TXKYJKJLIIRMPN-RLFYNMQTSA-N 453.989 0.178 50 20 JCGD O=C(CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)N1CCCC1 1832424896 SHWYWGDDCCLVOV-FUHWJXTLSA-N 464.332 0.536 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)nc3)C2)C1 1832549535 UAFDVQCUJWWHDT-AOMKIAJQSA-N 498.964 0.989 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832730054 VAGZLTIVJKEAEC-JXFKEZNVSA-N 483.363 0.441 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cncc(OC)c3)CCO2)C1 1832918694 BJPHRPPZCVDYJW-GHTZIAJQSA-N 455.939 0.733 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1 1833306728 ZZLNQWGJXVOHCE-UXHICEINSA-N 453.967 0.900 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1833307892 MDHBDVOEOWKBLU-SFHVURJKSA-N 455.309 0.036 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1833765375 VQGDZIAEBMLIKR-LSDHHAIUSA-N 472.384 0.330 50 20 JCGD Cn1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1834078076 XOYQONQWROQFSR-UHFFFAOYSA-N 453.547 0.523 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4ncsc4[nH]3)CC2)CC1)c1cccc(B(O)O)c1 1834801156 NWUVMJJLBFGMEQ-UHFFFAOYSA-N 481.387 0.803 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CCSC(=N)N)CC2)CC1 1835118395 XSJGQWGASWWRGC-JFLMPSFJSA-N 490.634 0.709 50 20 JCGD O=C(CCc1cccs1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927022 BQZVEXPINKJKRN-JOCHJYFZSA-N 458.345 0.131 50 20 JCGD COc1c(C)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1C 1835932222 UUSQIFASVRUTOD-RUZDIDTESA-N 482.342 0.376 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4cccc(Cl)c43)C2)C1 1835932270 XEIMKGARNBEQEQ-NBGIEHNGSA-N 498.772 0.820 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(=O)C#CC(=O)O)CC2)CC1 1836107624 ZKCLOEVNIMTQFE-UHFFFAOYSA-N 486.481 0.793 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1836670629 SBOGRKXOSUJNCG-SWLSCSKDSA-N 473.368 0.614 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1837079063 DPQPFIQYZBGMRC-GOSISDBHSA-N 464.028 0.733 50 20 JCGD COc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837459609 LOVXBJBLIZLOHA-QHCPKHFHSA-N 469.498 0.078 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)ncc1[N+](=O)[O-] 1837920345 NPFGBOZAMIMYFK-UHFFFAOYSA-N 496.329 0.904 50 20 JCGD CSCC[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838395326 CTUALHNYLNYKQU-IBGZPJMESA-N 479.603 0.411 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1839144488 BQAQCVILMDUOJN-AOMKIAJQSA-N 464.950 0.814 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)n1 1839200131 FZHNYALKTQYFDY-KXBFYZLASA-N 489.342 0.434 50 20 JCGD O=C([C@H]1CC[C@H]2CCC(=O)N2C1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202172 WJHIOPIEVWNZFU-PWDMQXDWSA-N 476.343 0.534 50 20 JCGD O=C1CCCCN1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202564 JQYFJYJOCHJGDI-WBVHZDCISA-N 450.305 0.146 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(O)cc(O)cc3O)CCO2)C1 1839371878 TXHYYAZKPXSPPN-CWTRNNRKSA-N 473.320 0.904 50 20 JCGD COc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc(F)c1F 1839383851 GIOSVDOMIVCFOG-JOCHJYFZSA-N 484.500 0.416 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839659504 MWHJRPGVLIOYSY-XDHUDOTRSA-N 482.541 0.029 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1840031202 ISEHXCTXOBCCBH-FZKQIMNGSA-N 474.377 0.718 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)s1 1840183423 DKCLGDFSEHOOTJ-HXUWFJFHSA-N 454.549 0.200 50 20 JCGD CSCC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1840194777 FEJXCKAESYVVRS-GRDNDAEWSA-N 453.399 0.588 50 20 JCGD CCN1CCC(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)CC1 1840929369 RKDPOPUJVGAVMM-YJBOKZPZSA-N 450.349 0.865 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)O2)C1 1841079557 LXAMKDLOTKWXIN-HUUCEWRRSA-N 457.955 0.958 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCc2ccc3c(c2)OCO3)C1 1842756155 OSCSQMZAUPOZHG-UHFFFAOYSA-N 451.483 0.864 50 20 JCGD C[C@@H](S)C(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C1 1843428567 AZPMLSLRQFVURU-QAPCUYQASA-N 491.419 0.324 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CNC(=O)c2cc(C)on2)C1 1844309003 KZIMUCRYGVRLNC-ZVHZXABRSA-N 455.475 0.050 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1844669428 WPOWNYHWFGUKOV-UHFFFAOYSA-N 462.470 0.569 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1 16786305 YBRZBFXKFSLDIL-LBPRGKRZSA-N 481.955 0.462 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 22193221 XMVPKYAOLKLSFH-HXUWFJFHSA-N 497.537 0.869 50 20 JCGD COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 23744031 NPHOCXFJRUAENM-UHFFFAOYSA-N 485.540 0.348 50 20 JCGD C[C@@H]1CC(C)(C)C[C@]2(C1)NC(=O)N(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C2=O 25416518 HNYQZFNECJWRLE-PEBXRYMYSA-N 493.586 0.835 50 20 JCGD COc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cn1 726894166 YQKXPXWZWRBJOE-UHFFFAOYSA-N 451.530 0.743 50 20 JCGD CS(=O)(=O)NCCNC(=S)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 727064361 DJYBAIYZJDIZAK-UHFFFAOYSA-N 474.572 0.047 50 20 JCGD Cc1cc(=O)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nn1-c1ccccc1C(F)(F)F 728385130 KXMFAZRPOLVHSG-NSHDSACASA-N 458.418 0.755 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCN(c2ccc3c(c2)OCCO3)C1=O 730515687 XGTXUJQPIFUAHF-OAHLLOKOSA-N 487.538 0.873 50 20 JCGD CCS(=O)(=O)c1ccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 745835280 AQWFTXDTZMMLEI-UHFFFAOYSA-N 453.542 0.870 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1 751212093 ZXCBCFZQKWFUJJ-OAHLLOKOSA-N 450.542 0.869 50 20 JCGD CSC[C@@H](C(=O)NNC(=O)c1cccc(S(C)(=O)=O)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 915076847 DMRGNUDMOHWNRO-XHSDSOJGSA-N 467.569 0.758 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)nc1 915906173 OZAVYBLHEMJEQP-UHFFFAOYSA-N 467.552 0.649 50 20 JCGD CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)NCC(=O)O)cc2)cc1OC 916105335 AJFVPKGSPPZWQA-UHFFFAOYSA-N 451.457 0.532 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NCCCN(C)S(C)(=O)=O)c2ccccc2c1=O 916580023 ANTFBVGMFRQSKS-UHFFFAOYSA-N 452.537 0.422 50 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O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1847544306 VVLMPPGNXCMHCA-ROUUACIJSA-N 457.679 0.986 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 725873504 YZQZKVVLSQFQOC-UHFFFAOYSA-N 485.975 0.879 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2CCC[C@H]2C(=O)N(C)C)c1 726277613 OUVJXQVUXAXIFN-IBGZPJMESA-N 496.634 0.604 50 20 JCGD CCS(=O)(=O)Nc1ccccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728336429 YXDDLZJWFXCMFI-QGZVFWFLSA-N 463.468 0.592 50 20 JCGD O=C(NNC(=O)c1cccc(OC(F)F)c1)NNC(=O)c1csc(N2CCOCC2)n1 728594239 JXVZPEQUCCJOHJ-UHFFFAOYSA-N 456.431 0.870 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=S)Nc2ccc(OC)nc2)c1 729692491 JEESHCBFYCKBOX-UHFFFAOYSA-N 468.561 0.300 50 20 JCGD Cn1c(CCC(=O)NNC(=O)c2ccncc2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 865908401 CMPGEWGUQFFCKM-UHFFFAOYSA-N 472.527 0.383 50 20 JCGD COC(=O)c1cc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1OC 915890834 GOKLPWTYAWVTBH-UHFFFAOYSA-N 464.500 0.876 50 20 JCGD CCCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(C(=O)NCC(=O)O)cc2)cc1OC 916105390 MELKFLUEQLCVFJ-UHFFFAOYSA-N 465.484 0.922 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(S(C)(=O)=O)CC2)c1 916237843 NMDIQIZHGUXPHE-UHFFFAOYSA-N 475.593 0.085 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccnc(N4CCCC4)c3)nc2)CC1 916254425 CRUQNXFKMJHKRZ-UHFFFAOYSA-N 474.591 0.839 50 20 JCGD Cc1cc(C)cc(OCC(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c1 916517229 YNIROEWUYGHTAX-UHFFFAOYSA-N 490.586 0.560 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3nnc(O)c4ccccc34)cc2S1(=O)=O 916741062 OTMPNJHBPJJWGA-UHFFFAOYSA-N 471.451 0.201 50 20 JCGD C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc1 920297625 KHAYSPVJOVSXME-QLFBSQMISA-N 454.549 0.554 50 20 JCGD CCCC[C@H](NC(N)=O)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 920884683 HVVQWTDBMRCNGZ-KRWDZBQOSA-N 469.564 0.015 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCC[C@@H]1SC[C@H]2NC(=O)N[C@@H]21 921302322 SCLVINCLXKOYDM-IPYPFGDCSA-N 468.605 0.775 50 20 JCGD CN(C)N(C(=O)CCc1nc2cc(S(=O)(=O)N(C)C)ccc2n1C)[C@@H]1CCS(=O)(=O)C1 1117805747 DJYFCKSJSIWPFK-CQSZACIVSA-N 471.605 0.249 50 20 JCGD CC(C)Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)n(C)n1 1777766074 HXROIFFVIJULCA-RCZVLFRGSA-N 482.390 0.740 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4ncccn34)C2)C1 1777932778 YJIGVPKNELMNCW-QVGKIPNLSA-N 464.486 0.307 50 20 JCGD CCCc1onc(C)c1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030493 RBQNGWJSOJYIMG-QFIPXVFZSA-N 456.503 0.691 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N1CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C1)CC2 1779034991 YUEJHRQJHOTCBZ-QYBDOPJKSA-N 493.564 0.942 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)c1ccccc1)C2 1779371048 KDIMWWRCKQDEGG-NTKDMRAZSA-N 465.510 0.696 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cnc(Cl)c(Cl)c3)C2)C1 1779493856 SSXAJGKBEMAQEI-FQEVSTJZSA-N 464.114 0.826 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3snnc3c2)C1 1780045303 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Cn3cccn3)[C@H]2C1 1785439394 XQTRKBUNUSOWBK-GFTQFONFSA-N 469.546 0.633 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1791040793 WQLNICPAXJIHOH-FPMLTQPBSA-N 471.982 0.679 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(C)(C)CCl)C[C@@H]21 1792271967 WDHQKBYGFXJRPW-VGWMRTNUSA-N 489.013 1.000 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792983359 IRSYZSCHKHRJEP-AICCOOGYSA-N 466.000 0.432 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnsn1)NC(=O)NCc1ccccc1 1794385643 ZMBSSYSJKDXSGX-HGKCTWBKSA-N 473.559 0.088 50 20 JCGD CCOc1ccc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736230 OTWFXGLVEJBNSK-VPTLXERWSA-N 472.734 0.936 50 20 JCGD CCc1[nH]nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)c1I 1795907122 IOCVOVVBYQTISR-PKCZLINISA-N 496.733 0.380 50 20 JCGD 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O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3ncccc13)CC2)c1cccc(B(O)O)c1 1815354680 PVOUBCFZPKECEL-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1[nH]nc2ccncc12 1817908484 RDVLUZHDCAFFSF-SFHVURJKSA-N 459.275 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)/C=N/O[C@@H]3CCCCO3)sc2C1 1819905345 ZPWDHZRFOXGTPT-RQAOHGNXSA-N 487.542 0.896 50 20 JCGD COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)NC(=O)c3cnccn3)sc2C1 1820027332 ZDRZYUGZSALOJL-SRVKXCTJSA-N 466.951 0.917 50 20 JCGD C=C(CC(=O)OCC)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1822928100 QZHPKOKXXIRRDE-LBPRGKRZSA-N 472.527 0.877 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1 1824772601 QMYPJTXYXAUXLD-LJQANCHMSA-N 482.541 0.234 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(CO)c(F)c1 1827905795 QAPMAVJMLGVGFA-INIZCTEOSA-N 469.303 0.994 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830535468 OYQPDVURHTXFIM-CXAGYDPISA-N 467.382 0.380 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830722353 AQIOCSITFRVQCY-AVRDEDQJSA-N 470.950 0.693 50 20 JCGD Cc1nn2cc(CC(=O)N3CCO[C@@]4(COCCN(C(=O)CCBr)C4)C3)nc2s1 1832106208 UUZBSPJGQRCPEY-GOSISDBHSA-N 486.392 0.883 50 20 JCGD Cc1ccn(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n1 1833082231 AAMXKJRWBBHHHO-HTAPYJJXSA-N 499.996 0.780 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1833596234 BLTNGELLWQEFNH-OXQOHEQNSA-N 473.979 0.963 50 20 JCGD Cc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)c1F 1833702283 PQXDDTLBAZJHHH-KPZWWZAWSA-N 461.332 0.969 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cncn3-c3ccncc3)CC2)CC1 1834013831 MGOHGFQBWUYURJ-UHFFFAOYSA-N 496.616 0.826 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(O)n1 1834798463 YUWSGEVQODECLV-UHFFFAOYSA-N 466.347 0.274 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccnc4ncccc34)CC2)CC1)c1ccc(B(O)O)cc1 1834799330 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CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)C2)C1 1840183284 XDRBFRZGAODQPT-DCLXLUIPSA-N 476.549 0.759 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1 1840183553 LWHRPULQGLZQDQ-QFIPXVFZSA-N 450.511 0.198 50 20 JCGD CC#C[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccc(O)cc1 1840219534 QQHPBDBWXLOXFP-NOXFTYBFSA-N 464.946 0.945 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(C)n1 1840337658 HQIXXCXSSBAJMC-VWLOTQADSA-N 481.358 0.081 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)CC3(O)CCC3)CCO2)C1 1840594799 SNPIJRVEKGOPHV-QHCPKHFHSA-N 491.497 0.895 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)C[C@@](C)(O)CC(=O)O)C2 1841925237 BRAOMRZOMYNKTA-ORAYPTAESA-N 461.943 0.938 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c3c2OCO3)C1 1844757857 UFQASTLCFWPWRG-UHFFFAOYSA-N 453.216 0.134 50 20 JCGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H](CCCNC(N)=O)NC(=O)OC(C)(C)C)C1 1847100336 JCQRGGRHFJCEHC-GJZGRUSLSA-N 490.001 0.785 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)COc2ccccc2F)c1OC 26696613 LEQGSCOCDXXDLF-UHFFFAOYSA-N 497.501 0.704 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCCSC)N(S(C)(=O)=O)CC2 726279618 VOSJRYWIDKFEDL-AWEZNQCLSA-N 460.578 0.646 50 20 JCGD Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNc1ccc(S(=O)(=O)NC2CC2)cc1 728209812 IBCIANSXPYLTSX-UHFFFAOYSA-N 483.572 0.244 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN1C(=O)c1ccccc1O)NNC(=O)[C@H]1COc2ccccc2O1 728325060 JMEKQDCUFIQGGB-HNAYVOBHSA-N 469.450 0.527 50 20 JCGD Cc1ccc(-c2nnn(CC(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)n2)cc1 730471592 RTYKLUJJMBMMBX-KRWDZBQOSA-N 452.427 0.179 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)CN1C(=O)COc2cc(Br)ccc21 751206148 FBOLPOSWOOZNJJ-UHFFFAOYSA-N 467.301 0.813 50 20 JCGD COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1 751207119 RZJBZVVQTKQZNJ-UHFFFAOYSA-N 464.500 0.266 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)n(C)c1 761384514 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CC(C)(C)OC(=O)NCCOCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1784339959 WAKDQIVPMPYGDE-QAETUUGQSA-N 477.986 0.497 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(Cc4ccccc4)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980917 DQSGQSJHKJLSSF-OYDLWJJNSA-N 488.353 0.518 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cc(Cl)n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981052 MZOLCXJTKMKGJC-OWQGQXMQSA-N 478.141 0.975 50 20 JCGD O=C(CCN1Cc2ccccc2C1=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1788148091 ITOASOINCBWUFW-VJBMBRPKSA-N 491.353 0.006 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1788639191 INXDVASLBFTTSS-LXFSFDBISA-N 467.288 0.151 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1 1788764927 OYALTIMRUIKBDD-QAETUUGQSA-N 473.643 0.703 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)nc1 1789725798 SKPZOCNHIMZSJU-FHWLQOOXSA-N 475.590 0.900 50 20 JCGD 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JCGD C[C@@H](Sc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934024 KJIVKOMJXMJNFJ-KOSHJBKYSA-N 484.383 0.617 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CN(CCO)CCO)CC2)CC1 1836535874 QIJTYBFKOUUJBW-GOSISDBHSA-N 477.444 0.018 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836681141 SVHOEPQBVRWSNP-IRXDYDNUSA-N 477.986 0.470 50 20 JCGD O=C1Cc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Br)C4)C3)ccc2N1 1836790251 CRNSECSOWMRXTR-VQIMIIECSA-N 470.295 0.942 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cn3cccnc3n1)CCO2 1836886064 BBDLNYOFOVPWED-SFHVURJKSA-N 452.309 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cccnc4n3)C2)C1 1837459237 NDZMUABBPQVTGA-DEOSSOPVSA-N 491.508 0.012 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)no1 1837546357 WYOFPHAAAHOMRP-YJYMSZOUSA-N 487.351 0.200 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837715058 TZHYXRLMSLYCIT-OXQOHEQNSA-N 475.615 0.137 50 20 JCGD Cn1cc(F)cc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920349 NWZPVJQKAJGJGV-UHFFFAOYSA-N 457.311 0.770 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838395336 DUSCMEHTUBHPGQ-SFHVURJKSA-N 467.954 0.551 50 20 JCGD O=C([C@H](O)N1CCOCC1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1838404012 JXAWKGPTJURWJW-YJBOKZPZSA-N 466.348 0.326 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1 1838559323 NJUVLQUQXGGFJO-UHFFFAOYSA-N 464.523 0.908 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1839153455 IHAVSDGUYIEVEZ-ZWKOTPCHSA-N 461.302 0.481 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1839964843 GEWBZAZQQIALEU-KUHUBIRLSA-N 466.336 0.973 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1840031115 GBOCPECNRPXRGM-QAJFTPDKSA-N 499.362 0.233 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1 1840185753 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C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21)n1cncn1 1791612461 YBNSXMQZXVPRBA-WOYTXXSLSA-N 484.985 0.951 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793879589 HHOFJQGWQCGDKS-BPKGMFCQSA-N 474.986 0.623 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNC(=O)c1ccc[nH]1 1794035914 FUXMMODIWLIOIP-LOUJCGABSA-N 455.353 0.898 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccon1)NC(=O)NCc1ccccc1 1794926869 HBIAJIWUAQSIMU-XEMDLRDOSA-N 456.503 0.224 50 20 JCGD O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2 1795113218 OLIVUDBEEPWOIV-VPTLXERWSA-N 492.370 0.976 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796187944 OGLWAKKYQTZWMT-DMUMMCEESA-N 485.346 0.197 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)s1)C2 1797751801 SNKCNRKOSCWEAI-WDAIWFPHSA-N 450.908 0.312 50 20 JCGD 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O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3nonc3c1)CC2)c1ccc(B(O)O)cc1 1815340371 KWFVBCLHMWFYKE-AWEZNQCLSA-N 463.284 0.899 50 20 JCGD Cn1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c2c1CCC2 1815356791 RMVCYUHYILTZPU-AWEZNQCLSA-N 465.344 0.585 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccnc(Cl)n1)CC2)c1cccc(B(O)O)c1 1815360545 ITJKESBPNRQGEJ-LBPRGKRZSA-N 457.708 0.806 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)n3[nH]nnc3n2)n[nH]1 1817812351 CPPQLDIGZKEFLO-SKDRFNHKSA-N 478.311 0.873 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc2c(c1)CNC2=O 1819202891 MWDSOVGWHXHZGN-HXUWFJFHSA-N 473.298 0.953 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1 1820691394 KKGUFRACWTUJNZ-UONOGXRCSA-N 466.951 0.907 50 20 JCGD CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)C#CC(=O)O)[nH]n1)NC(=O)NCc1ccccc1 1820711454 OXFMZTUWUFSNLE-GOSISDBHSA-N 481.513 0.836 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1827030294 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CC(=O)NCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1831694780 UHWOGUQEYIBZBK-RBUKOAKNSA-N 452.379 0.841 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNC(=O)c2cccnc2)CC1 1831871607 VFSZSLLZQSPQIO-HXUWFJFHSA-N 472.590 0.804 50 20 JCGD Cc1noc(C)c1CCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833847268 BSSIFHFZEOPXPO-UHFFFAOYSA-N 482.390 0.789 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1C)CCO2 1834037433 FFHUISMNPCFBGN-NWJFTTBMSA-N 468.514 0.594 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797813 JMMPFZAMLPBDKQ-OAHLLOKOSA-N 480.212 0.583 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CS(=O)(=O)N3CCCC3)CC2)CC1 1835116717 YKOTZZVAAFOYPW-SFHVURJKSA-N 479.043 0.237 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1 1835645620 OXCFJNFTERNPMF-BLLLJJGKSA-N 463.373 0.406 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc(Cl)ccn1 1835889409 NKLYDZQJESSIAE-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(/C=C/c1cc2ccccc2o1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835937446 XGMUMIAMGMTPIT-ZPLOFBHDSA-N 490.321 0.896 50 20 JCGD O=C(c1cc2ncccn2n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1836872736 KTYXDJMWKDHDCT-PBHICJAKSA-N 456.272 0.490 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838353181 GRMLGXOYBZQOIJ-GCJKJVERSA-N 483.949 0.309 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc1 1839197918 LZQOPQNIWYYLJI-WMLDXEAASA-N 494.339 0.246 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1839962515 IQOFZHNYOBMNSD-QMTHXVAHSA-N 493.248 0.972 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1840031100 FPRNSAVMLXKJOB-LIRRHRJNSA-N 469.336 0.051 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=CCN(C(=O)OC(C)(C)C)C3)C2)C1 1840149975 CVKBQZSLJLCFTK-VGOFRKELSA-N 487.981 0.874 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)sc1C 1840185793 SWTIGIDPQVBURU-FQEVSTJZSA-N 453.565 0.203 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1840371560 QDKWLONRKWYHEM-NSISKUIASA-N 490.388 0.150 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)c3ccccc3)CCO2)C1 1840800699 OSRFRDHBZSOHJG-PGRDOPGGSA-N 467.950 0.517 50 20 JCGD COc1cc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)nn1-c1ccccc1F 1843185434 YQXTXMRXDBOUKG-UHFFFAOYSA-N 478.289 0.831 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)C2=C3c4ccccc4C(=O)N3CC2)C1 1844650256 MJCYQQPNIKWWLB-UHFFFAOYSA-N 457.295 0.454 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccc(F)cc1 1845009724 NRMDVMBEXSAYPV-LJQANCHMSA-N 468.489 0.519 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(S(=O)(=O)N2CCCC2)ccc1Br 16786086 BROGKXCBZINKSE-LLVKDONJSA-N 494.389 0.429 50 20 JCGD N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)OCC(=O)NNC(=O)c3ccccc3)CC2)cc1 18662131 LEPNVCKVSXPHDG-UHFFFAOYSA-N 470.507 0.963 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)c1cc(C)oc1C 21194515 MCUJVGRNOXSNJP-INIZCTEOSA-N 451.501 0.899 50 20 JCGD CCn1nc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c2ccccc2c1=O 25436371 PRNJDAJHWPQTGU-QHCPKHFHSA-N 480.456 0.784 50 20 JCGD CCC1CCC2(CC1)NC(=O)N(CC(=O)OCC(=O)NNC(=O)c1ccc(OC)c(OC)c1)C2=O 104523464 JUUYQQZNLKYVOD-UHFFFAOYSA-N 490.513 0.899 50 20 JCGD CS(=O)(=O)Nc1ccc(F)cc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728323431 FXTBVPJLYPNCRH-MRXNPFEDSA-N 467.431 0.341 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728980797 GNMGQPDGMFDFJG-UHFFFAOYSA-N 460.516 0.022 50 20 JCGD O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)C1CCN(c2ncccn2)CC1 729044917 OIIVKMKTSWLXKD-FQEVSTJZSA-N 453.547 0.924 50 20 JCGD CS(=O)(=O)c1ccc(N2CCN(C(=O)NNC(=O)Cc3ccccn3)CC2)c([N+](=O)[O-])c1 729231766 XZSMAGNHXAJEMK-UHFFFAOYSA-N 462.488 0.499 50 20 JCGD C[C@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1)c1ccccc1 788024225 WGMIHPXMKWAOEC-YOEHRIQHSA-N 465.553 0.922 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1C(=O)[C@@H]2CCCC[C@H]2C1=O 807726222 CBYFIZPZLOKMOY-CHWSQXEVSA-N 451.863 0.828 50 20 JCGD O=C(CN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 912642860 AIHHDANBLBUSSJ-LSOMNZGLSA-N 472.523 0.039 50 20 JCGD N#Cc1ccc(-c2ccc(OCC(=O)NNC(=O)[C@H]3CC(=O)N([C@H]4CCS(=O)(=O)C4)C3)cc2)cc1 914459261 QAVPIOYWQTZNFW-PMACEKPBSA-N 496.545 0.787 50 20 JCGD CC(=O)Nc1nc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cs1 915062972 MPPPYBODBPBVIA-UHFFFAOYSA-N 453.502 0.197 50 20 JCGD COc1c(F)cc(CC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1S(N)(=O)=O 915547676 ASXLVGGYZROKIH-UHFFFAOYSA-N 473.866 0.682 50 20 JCGD CC(C)[C@H](NC(=O)C12CC3CC(CC(C3)C1)C2)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886380 VZWLDBWRQBNQCD-MTPYNGCESA-N 454.593 0.861 50 20 JCGD O=C(NNC(=O)[C@H]1CCN(c2cccc(Br)c2)C1=O)N[C@@H]1CCS(=O)(=O)C1 919886532 SHAAANJFXCFONN-DGCLKSJQSA-N 459.322 0.320 50 20 JCGD O=C(Nc1ccc(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1)c1ccc(F)cc1 919956439 WJUICCGITSTBJE-ZDUSSCGKSA-N 455.489 0.822 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)NCCc1cccs1 920860303 RTFQPNLYJSRGAD-INIZCTEOSA-N 488.613 0.403 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn4ccnc34)C2)C1 1778580279 YBBZVVPUAHRQTN-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)n1 1779033758 DHOUZRAONXQULP-XMMPIXPASA-N 466.542 0.773 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1 1779689981 IQDAVDRUIBQCJR-QHCPKHFHSA-N 476.497 0.023 50 20 JCGD CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CC[C@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)C[C@H]1CO2 1781060551 HHXFFHNDHWGKPK-YQMDMEMYSA-N 473.954 0.194 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C#N)(C(=O)N2CC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1 1781168174 WLBGQIVEMFOFHK-ZHRRBRCNSA-N 484.981 0.957 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1781222395 TUMCPMCSATWAHG-PXNSSMCTSA-N 450.960 0.530 50 20 JCGD C[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[S@@](=O)c1ccccc1 1781499191 HOCIUOAGMVGBIF-KRIMLYLISA-N 498.410 0.690 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(OC)c1 1782994746 VAGINIYADJUGOX-XMMPIXPASA-N 476.574 0.839 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1cnccn1)CCO2 1783349844 UAANMBVVOKAYMX-CKFHNAJUSA-N 468.352 0.598 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)CCO2 1783877385 XZRCNERYHQNVMF-BXTJHSDWSA-N 462.975 0.312 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc(C(F)(F)F)cn1)CCO2 1783933944 OLFWQUQZPWDGOY-SFHVURJKSA-N 458.441 0.312 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCO[C@@]4(CCN(C(=O)C(Cl)Cl)C4)C3)n2)CCCN1 1783943591 LJMIMAJMKOZOLE-HXUWFJFHSA-N 470.357 0.655 50 20 JCGD O=C(C[C@H]1COc2ccccc2O1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784391847 IOIQHFMTEVJBHA-UDSSINMLSA-N 480.326 0.190 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)[C@H]2C1 1787125816 WSJDXXIAZDPYCB-WJWMFLMHSA-N 489.997 0.590 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)[C@H]3SC(=N)NC3=O)[C@H]2C1 1787498177 NAKUQJDSRVRUHU-RHIYVLOFSA-N 461.382 0.552 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@H](O)N3CCOCC3)cc2)CCC1 1789555848 OWWSYMZYTUQECH-QFIPXVFZSA-N 468.514 0.083 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21 1789866343 PNKNMRMQQPZNOM-DDWFUNMISA-N 479.386 0.668 50 20 JCGD Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(C)n1 1791495577 GPSRDVPXSROJHW-PMVMPFDFSA-N 465.359 0.604 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCn3cncn3)[C@H]2C1 1791524966 YLTLUMXFAMSUBD-QSFXBCCZSA-N 486.485 0.795 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCOC3)[C@H]2C1)NC(=O)NCc1ccccc1 1792211438 HEBAWHMYLQFDOG-LRSLUSHPSA-N 487.601 0.739 50 20 JCGD COc1cc(F)ccc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1792305911 VXPHFWMWXUXIJS-QRFRQXIXSA-N 464.538 0.730 50 20 JCGD COCCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1792842007 FPGNQHZMTAXHQV-HATOLVCRSA-N 461.563 0.349 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)c1cccc(Br)c1)C2)[C@@H](O)CCl 1792979065 SGXOSBRTPLHVBL-URLPEUOOSA-N 461.740 0.672 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795741122 KGTXPNWQBJAKDB-IZZQQSIFSA-N 489.378 0.121 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]nc2ncccc12 1796217718 YEJVZHNSIVLCJY-SUGIQXKYSA-N 464.486 0.295 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1 1796446254 QDKYENHAWNHLEX-SWLURDMPSA-N 480.525 0.982 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1c(Cl)ccc2c1OCO2 1796939242 CPVAWZUQJBWRSL-HBCWATKFSA-N 472.690 0.266 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)Nc1cccnc1 1797888124 XCAZGWVNQKJMSR-FSDCSDTHSA-N 495.964 0.742 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCc1ncccc1-2 1798478301 UYLWGTRARSEXLC-USGNIVHTSA-N 481.557 0.147 50 20 JCGD Cc1cccc2c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)n[nH]c12 1800071071 OWTJFXQJYJQUOI-HBCWATKFSA-N 463.498 0.387 50 20 JCGD N=C(N)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800434861 FYARJCPXAXXUAP-JYYAWHABSA-N 452.353 0.065 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(C(F)(F)F)c1)C2 1801009447 IRAQYVPXYIELDL-ZSBFGKGUSA-N 457.453 0.677 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801015342 JCMMEFUSANOMBA-RNJOBUHISA-N 454.351 0.655 50 20 JCGD O=C1CSc2ncc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)cc2N1 1801076400 HFALPCYVDHIRAV-BJWYYQGGSA-N 466.328 0.371 50 20 JCGD C#CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1801598333 ZSNURNJUTOTHRZ-YRPNKDGESA-N 469.347 0.074 50 20 JCGD Cc1c(C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)cn2[nH]cnc(=O)c12 1803141027 KGJLWZOXOZYKMM-UWWQBHOKSA-N 458.906 0.645 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)C1 1803141921 VVDBPSAPYGSEJN-QQXKLLMISA-N 496.992 0.915 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]2c2cccnc2)n1 1803142764 ILRCYZKEFPTHFE-AOIWGVFYSA-N 461.950 0.988 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(C)(C)C 1803386824 YWVPAQNQOJFGIU-ILWGZMRPSA-N 480.374 0.632 50 20 JCGD C[C@H](Cn1cccn1)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1804724212 ZXZZTDGIQKTEKH-SFGWALBWSA-N 455.563 0.993 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc(-n2cnnc2)cc1 1806991666 CSNSRRYHMTZLCY-XUZZJYLKSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CC2CCOCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361644 CMIRUKWYUFBPQZ-NFBKMPQASA-N 451.332 0.898 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CC2CCOCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371488 VQFDSAFZMZEYMN-REWPJTCUSA-N 451.332 0.898 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)/C=N/O[C@H]2CCCCO2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374038 GBEKVHNJFIVEKW-PNYYAQIVSA-N 480.330 0.610 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1 1807412537 HVFYCQVORTYLNF-FOIQADDNSA-N 482.932 0.950 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)Cn2ccnn2)[C@@H]1c1cccnc1 1807676813 LVOJOSREAFZGEX-ZXRGJLGVSA-N 463.502 0.513 50 20 JCGD CN1CCC(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1810293472 DXGGZSDPDFWNRF-WIYYLYMNSA-N 465.558 0.742 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@@H]1c1cccnc1 1810301767 CBPLSNJACFEIHN-FXAWDEMLSA-N 461.482 0.347 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)/C=C/C(=O)NCc2ccco2)[C@H]1c1cccnc1 1810471503 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3C[C@H](O)CN3)sc2C1 1822612262 HCDPFJQNNAZOGM-FFSVYQOJSA-N 489.510 0.925 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)C3CCC4(CC3)OCCO4)sc2C1)c1cccc(B(O)O)c1 1824899559 KYRDBWAZTKZZOJ-QGZVFWFLSA-N 485.371 0.982 50 20 JCGD COc1nccnc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1825508104 WCPUXXGYFWPSGQ-IBGZPJMESA-N 452.320 0.712 50 20 JCGD Cc1cc2nnc(C(=O)N[C@@H]3CCc4nc(NC(=O)CCC(=O)NN(C)C)sc4C3)c(C)n2n1 1826086023 KVYTWIUIQBSHTQ-CYBMUJFWSA-N 485.574 0.796 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826087707 JOQOLINVPUUTOH-CHWSQXEVSA-N 460.564 0.719 50 20 JCGD Cc1ccc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc1 1828272142 VUHWGTSPCVZROW-SFHVURJKSA-N 492.366 0.787 50 20 JCGD O=C(c1ncon1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828550977 FOSUNXFSXGJBHT-KKSFZXQISA-N 477.905 0.735 50 20 JCGD C[C@H](NC=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829220886 GHWCMSOYKRSIGE-AQOAWAETSA-N 480.949 0.173 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)CNC(C)=O)C2)C1 1829341180 YBOJXYGBMWOPTL-CVDCTZTESA-N 494.976 0.828 50 20 JCGD CC(=O)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n[nH]1 1830535263 LBAKFWHKFXSFAL-XIKOKIGWSA-N 457.325 0.713 50 20 JCGD COC(=O)C12CC(C(=O)N3CCOC[C@]4(CN(C(=O)[C@H](C)CBr)CCO4)C3)(C1)C2 1830544441 YRNVXYMTURZFPY-CKIVDRAYSA-N 473.364 0.817 50 20 JCGD O=C(c1cc(N2CCCC2)ccn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728759 XSQZKAPGXBCWEN-WIYYLYMNSA-N 452.939 0.352 50 20 JCGD O=C(c1ccc(OCCCO)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830730595 AIZXHYUGTTXFON-WIYYLYMNSA-N 456.923 0.118 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830733015 CVQHUHSJVJFSNT-JXFKEZNVSA-N 455.895 0.535 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1831446720 MYQKTWSCGRCJKD-IAGOWNOFSA-N 457.376 0.585 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSc2nc[nH]n2)CC1 1831876495 GMPAAFLBPHPQJL-MRXNPFEDSA-N 451.597 0.890 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)C3=NN(C)C(=O)CC3)CCO2)C1 1832380360 JSZSPCPEUQAFSR-FZKQIMNGSA-N 459.341 0.225 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CCC(=O)N3CCCC3)CC2)CC1 1833700807 TUNRVTGBLWICMB-UHFFFAOYSA-N 478.638 0.334 50 20 JCGD Cc1nc[nH]c1CSCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801319 YBGGJDWTGPBGJH-UHFFFAOYSA-N 499.446 0.517 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cc3cc(C)n(C)n3)CC2)CC1 1835116489 SOWZEGPPZLDNSK-MTDXEUNCSA-N 496.616 0.977 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(=O)n3O)CC2)CC1 1835118314 NOEHHPITGYXNAO-JVWAILMASA-N 497.556 0.405 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](CN)c1ccccc1)CCO2 1835811709 MMRSDVBNQQQIGE-CNCCTLMSSA-N 496.568 0.319 50 20 JCGD Cc1ccc([C@@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1835932136 PXJAVYRKSFXFCD-CLOONOSVSA-N 466.343 0.549 50 20 JCGD CN(CC(=O)NC1CCN(C2CCN(C(=O)c3cn[nH]c3)CC2)CC1)NC(=O)NCc1ccccc1 1836344125 YRFSRTNEZDVQED-UHFFFAOYSA-N 496.616 0.941 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(C(F)(F)F)cn3)CCO2)C1 1836377737 LBOCHSLXHSGGKI-YVEFUNNKSA-N 466.844 0.819 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C3CC3)C2)C1 1837460376 DWFOJUXUBAKFPA-VWLOTQADSA-N 479.537 0.946 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(O)[nH]3)CCO2)C1 1838067837 JSKCMGOMYHBGHQ-NRFANRHFSA-N 489.441 0.333 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)c(NC(C)=O)c3)CCO2)C1 1838610868 HKLSEZIAXBPMGB-VGOFRKELSA-N 483.949 0.977 50 20 JCGD O=C(Cc1ccc(Br)nc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839027614 KFSVFIQYIQRLQP-KDOFPFPSSA-N 476.755 0.443 50 20 JCGD O=C(c1ccc2nc(CO)[nH]c2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200973 PQAMDCODFZAOFN-LPHOPBHVSA-N 485.310 0.816 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840009259 WLKOCTLKNLZDGX-FHTPNYMGSA-N 487.981 0.300 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1840031137 GJYWKUDWIKUTAT-AUUYWEPGSA-N 471.352 0.374 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NNc3ccccc3)C2)C1 1840149716 YSRPRMAHTBNCLR-MDKPJZGXSA-N 454.955 0.702 50 20 JCGD O=C(c1ccc2nc(CO)[nH]c2c1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840187429 ABAKUYOIRKRPGK-IBGZPJMESA-N 457.314 0.929 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCCC3)CCO2)C1 1840939076 FWOFSODPLACDHC-DMUURETOSA-N 474.562 0.063 50 20 JCGD C/C=C(/C)C(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C1 1843428595 CHLUNVPJXCEALC-VTLRUXEHSA-N 485.390 0.972 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CC[C@H]2O)C1 1843825645 ZPAXVQWWXBUUIG-IAGOWNOFSA-N 481.594 0.181 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)C(F)F)cc1)NNC(=O)[C@H]1COc2ccccc2O1 9788096 KSLDCGSBKCBJRG-OAHLLOKOSA-N 470.406 0.827 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)cc1C 16233098 XQKISOWLQMRGLK-UHFFFAOYSA-N 450.517 0.503 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNS(=O)(=O)c3ccnn3C)c2)cc1 727349342 BGJFCDRMSRYWLM-UHFFFAOYSA-N 465.513 0.853 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CS(=O)(=O)c2cccc(Br)c2)n1 728726104 CBBYIGDJZWMJIF-UHFFFAOYSA-N 490.357 0.921 50 20 JCGD CCOC(=O)/C(C#N)=C/NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 730964549 VCHIFAHRNAKLQS-WCRPCQDQSA-N 466.516 0.544 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2sc(S(N)(=O)=O)cc2C)c1 751280951 MCSYGIOTQHPRFI-UHFFFAOYSA-N 474.586 0.809 50 20 JCGD Cc1nc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nn1-c1ccc(F)cc1 756744224 BXJRUUDSHLFJBY-QGZVFWFLSA-N 455.402 0.859 50 20 JCGD O=C(Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O)N1CC[C@H](B(O)O)C1 864234850 XFSNYZZSMHCJBL-FQEVSTJZSA-N 487.325 0.532 50 20 JCGD O=C(NCCCN1CCN(c2ncccn2)CC1)NNC(=O)c1nn(-c2ccccc2)cc1O 913638373 KRDKTUUWRGSASK-UHFFFAOYSA-N 465.518 0.524 50 20 JCGD CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Cc1ccccc1 915901400 SJMSXUAXQKVUPQ-FQEVSTJZSA-N 489.598 0.824 50 20 JCGD O=C(CS(=O)(=O)Cc1ccc(Br)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1 916144620 GUABIYSDGWGIDC-UHFFFAOYSA-N 479.316 0.801 50 20 JCGD O=C(NNS(=O)(=O)c1ccc2c(c1)C(=O)OC2)c1cccc(S(=O)(=O)N2CCCC2)c1 917717355 CXBLXALSICOVGQ-UHFFFAOYSA-N 465.509 0.765 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)OCC(=O)NNC(=O)c3ccc(Cl)cc3)cc2S1(=O)=O 919539155 LNRPGKRPJRZTAC-UHFFFAOYSA-N 495.897 0.749 50 20 JCGD COCCCNC(=O)NNC(=O)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(C)C 920862454 HJTMLMIDOWMEOP-KRWDZBQOSA-N 458.537 0.518 50 20 JCGD CN(C)N(C(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1)[C@H]1CCS(=O)(=O)C1 1337123791 VHEFLRNBOCCFSU-ZDUSSCGKSA-N 475.497 0.852 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4c(F)cccc34)C2)C1 1778634807 RMWXRYIBDGXYSW-QFIPXVFZSA-N 467.461 0.458 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ncccc3C(F)(F)F)C2)C1 1779710510 HRVXOIDRKYJPTI-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD CSc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1O 1780151719 YLVITPLLIKNSCS-QFIPXVFZSA-N 456.329 0.551 50 20 JCGD CC[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559018 TVSZECBCXCSZPB-YOSAUDMPSA-N 475.590 0.617 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CCCn3ccnc3)CCO2)C1)NC(=O)NCc1ccccc1 1780970812 ZJARNEKHHUKPMI-VWLOTQADSA-N 497.600 0.839 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1781226877 BUEFZHPGPKJLFK-IAGOWNOFSA-N 465.359 0.518 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781333543 ICOOMCWFHSSHTK-XJKSGUPXSA-N 461.244 0.277 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H](O)Cc1ccccc1 1781894419 IKEYLAAEURRHRR-TZBSWOFLSA-N 466.343 0.098 50 20 JCGD COC(=O)CCCCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214583 VRAVNISXKRDZGU-WZONZLPQSA-N 468.595 0.997 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1 1782580480 FKHYHIIHCTYWOW-SGCYSOCQSA-N 464.486 0.535 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CSCN3C(=O)[C@@H]3CCC(=O)N3)C2)C1 1782872489 SNVZCOVLMUCFKK-GXYOHSSGSA-N 487.022 0.404 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)COc1cc(Cl)ccn1)CCO2 1783934269 BVLQHUGBKOLPKG-FQEVSTJZSA-N 453.927 0.317 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1785609253 WNJQKGHVEAKGOH-SVIJTADQSA-N 495.404 0.821 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)C2)C1 1785726378 ZYQMZDCSQUQZNQ-QYWGDWMGSA-N 475.970 0.706 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc(F)cc3)[C@H]2C1 1786538718 ZTHNTPBGCLZGPA-YSSFQJQWSA-N 455.490 0.660 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3noc(C)n3)C[C@@H]21 1787506534 DLHYWEREWJCRFY-OTTMNBPASA-N 457.491 0.034 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3cc(=O)n4[nH]cnc4n3)CCC2)cc1)c1ccc(B(O)O)cc1 1788140744 RHWNCJQKYMNPSZ-UHFFFAOYSA-N 472.270 0.159 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccnc4c3)C[C@@H]21 1788611077 KKBLYGPQKNJBRG-XERREHJYSA-N 475.509 0.535 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)c([N+](=O)[O-])c3)[C@H]2C1 1790022230 JPYBNPARQRBJAY-MPGHIAIKSA-N 463.491 0.267 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4c(O)nnc34)C[C@@H]21 1791058139 ZLOZKNZEKOZQRB-IMIFBBOLSA-N 452.309 0.812 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1792780158 DDWHQMUHZQRGMR-NZBFACKJSA-N 458.342 0.559 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3c(Br)cc(F)cn3n1)C2)[C@@H](O)CCl 1792983474 JFCSMZZITYGVQS-FQPOAREZSA-N 490.717 0.434 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(=O)O)ncn1)C2 1793878385 ZPVMYMDFLRNCTJ-VZAMPYOESA-N 497.936 0.510 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(Cl)cccn13)C2)c1cccc(B(O)O)c1 1795739074 UHCUVJIDHNQMKB-CCWDJLKJSA-N 468.706 0.185 50 20 JCGD COc1ccc2c(c1)CC[C@H](CC(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)c1cccc(B(O)O)c1)C2 1795739179 QKPHXUGLLZDYMD-CJQNEGCDSA-N 492.381 0.773 50 20 JCGD N#Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(C(F)(F)F)n1 1795995279 ZFEYIQGBHUYDAQ-ZSBFGKGUSA-N 488.231 0.169 50 20 JCGD CCOC(=O)c1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)ccn1 1796441382 FIFZNDCFOFGRGN-VYKSVWDLSA-N 496.524 0.596 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1796450570 KRJTUUWLTVTCBF-FMPTWSOUSA-N 474.986 0.575 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1[nH]nc3c(Cl)cccc13)C2 1797753217 YIIOQVNJUVTZNP-NXCRSVRDSA-N 497.943 0.661 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)[C@@H](O)C1 1799200474 XDRNRCOHZVKQLP-OREBXVKISA-N 485.654 0.655 50 20 JCGD COc1cc2c(O)cccc2cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800013387 IWIBQYQRFYTOTK-MRSFGVLCSA-N 490.321 0.751 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1 1801013035 LANSGYCIHSCJSO-MRSFGVLCSA-N 476.574 0.599 50 20 JCGD COC(=O)CSCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803576563 ADGKQMSXACRDOH-QRWLVFNGSA-N 486.554 0.306 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc[n+]([O-])c2)[C@H]1c1cccnc1 1804784020 WSGGUHFIPDUYNK-OXJNMPFZSA-N 461.482 0.347 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362805 NOWKHFOSDZWAEQ-GCJKJVERSA-N 470.298 0.438 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1 1807365897 PSSFLYGABMXSPL-OYDLWJJNSA-N 489.337 0.823 50 20 JCGD N=C(N)SCCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807371138 QTSSDDKNHYTCPF-QFBILLFUSA-N 455.349 0.098 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807373913 DJKOICXNENKTCG-DENIHFKCSA-N 477.330 0.238 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1)[C@H](F)Br 1808650833 GIZJBMSUMBVVAT-CQDKDKBSSA-N 456.272 0.330 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1 1810302903 NYAVNHPBUBFHPJ-BEFAXECRSA-N 489.492 0.837 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)COc2cccnc2)[C@H]1c1cccnc1 1813071370 SZVZBAQARXAUPF-JPYJTQIMSA-N 454.531 0.934 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1cncn1 1813400815 WBHLRAZJUVWFEC-OGWOLHLISA-N 463.502 0.252 50 20 JCGD CC(=O)O[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(C)C 1815343994 BACQTBVARQJPII-CRAIPNDOSA-N 459.333 0.636 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815359726 BGRLVCIWUFAKEK-BXUZGUMPSA-N 461.305 0.610 50 20 JCGD COCc1oncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2 1817805091 PTNVTKNWQCREGY-LLVKDONJSA-N 450.521 0.876 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nc2ncccn2n1 1818617805 SNFAOAVJRAZDGK-MRXNPFEDSA-N 460.263 0.147 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnc3ncccn13)CC2 1819797621 WMWUYMGWZODDCV-LLVKDONJSA-N 477.510 0.724 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nn[nH]c1C(F)(F)F 1820324573 BESDWGXRDWQVCO-ZDUSSCGKSA-N 477.212 0.846 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCSCC2)[nH]n1 1822411824 DMCOHPNHTUDLDZ-MRXNPFEDSA-N 451.597 0.824 50 20 JCGD CN(CC(=O)N1CCC([C@@H]2CCCCN2C(=O)C(O)O)CC1)NC(=O)NCc1ccccc1 1824026010 FIFOACLOKYCKIT-IBGZPJMESA-N 461.563 0.263 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)Cn3cccc([N+](=O)[O-])c3=O)sc2C1 1824717908 BKSZGVZUWOFFPB-LBPRGKRZSA-N 491.530 0.198 50 20 JCGD Cn1nc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)cc1O 1825458584 UZPNPNSWFXBZJJ-GOSISDBHSA-N 455.519 0.671 50 20 JCGD C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCS(=O)(=O)CC1)CC2 1825635459 GURNKVCPQWAPFX-WDEREUQCSA-N 479.422 0.569 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826886748 PROCGVDWCSRPNM-BBRMVZONSA-N 466.328 0.911 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccnc1Cl)CCO2 1829501584 LSMITRGORSOGES-FQEVSTJZSA-N 453.927 0.178 50 20 JCGD CN(CC(=O)N1CCC([C@@H]2CCCCN2C(=O)COCCO)CC1)NC(=O)NCc1ccccc1 1830371886 HDMAPNRBLKSRPZ-QFIPXVFZSA-N 489.617 0.961 50 20 JCGD COc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c1 1830732370 WSNXHTXZSXCFNL-GHTZIAJQSA-N 458.914 0.823 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1831192755 HTIYTWMOEVJNCR-KXBFYZLASA-N 462.385 0.780 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1cccc3ncccc13)CCO2 1831353976 YSWCPHFHIQVTLG-RUZDIDTESA-N 483.569 0.607 50 20 JCGD CN1Cc2ccccc2C[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832463204 QWTUNSKBYCGVDO-KNKQGSTJSA-N 451.951 0.099 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCOC3)C2)C1 1832551177 GSMJOSZVORTZPZ-XFQAVAEZSA-N 475.970 0.611 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3CCC(=O)NC3)CC2)CC1 1833121244 ZYVIIPZHUBVYBW-SSGLAOATSA-N 485.589 0.218 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CN3CC(=O)NC3=O)CC2)CC1 1833709708 DCWLZVNABFQPLD-ZDUSSCGKSA-N 472.384 0.141 50 20 JCGD Cn1nccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1834232500 IJBBYEUWGAEAOU-BTYIYWSLSA-N 485.969 0.622 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4c(F)cccc34)CC2)CC1)c1ccc(B(O)O)cc1 1834798705 ZPQYEMCPQFKFBN-UHFFFAOYSA-N 493.348 0.881 50 20 JCGD O=C(CSc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835088948 STXMELQAGNFUNU-QHCPKHFHSA-N 470.356 0.229 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1 1835185033 GMGOWYDJFNDDHK-IEBWSBKVSA-N 462.927 0.760 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cn4ccccc4n3)CC2)CC1 1835300868 JAIBVVQOJFPKOF-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)COCc3ccccc3)CCO2)C1 1835366967 ACWUPNSMBCEDGD-WINMZROPSA-N 497.552 0.794 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C[C@H]3CCCCO3)CC2)CC1 1835737194 VKQUOLSFESMPIY-LJQANCHMSA-N 472.590 0.830 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3sccc3Cl)C2)C1 1835938056 HSBXGJUQTWYQEQ-HXUWFJFHSA-N 464.736 0.465 50 20 JCGD O=C(/C=C/c1cccs1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835963514 BUDGBLSNEBNDRQ-VQKOGROQSA-N 456.329 0.211 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CC(N)=O)CC2)CC1 1836907256 GPDVJEHRQJOTIY-CXEIWHQESA-N 474.562 0.631 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cnc3Cl)C2)C1 1837459458 PSVMRBPPPJMIGK-OAQYLSRUSA-N 492.895 0.256 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)N1CSCSC1)CCO2 1837573969 KFODYZPDRDLHBL-RVKKMQEKSA-N 468.041 0.740 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cncc(O)c3)CC2)CC1 1837920991 PQCKSPPDRLSTSG-UHFFFAOYSA-N 453.304 0.393 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839036212 VFFZUNRMNGEOLB-AVBTWRTFSA-N 471.913 0.000 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1 1839203186 CJZFSBRTNKCZFP-YLJYHZDGSA-N 486.338 0.872 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C(=O)N(C)C)c3)C2)C1 1840155645 BXZPQAROWPXEJW-XMSQKQJNSA-N 467.950 0.712 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1C 1840644476 VBFZDNIDHLADMS-DEOSSOPVSA-N 483.525 0.386 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1F 1840682345 GATLCQPLLOUMGA-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840739478 HOWBCEULUJQLOJ-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)c(F)c(Cl)c1)CCO2 1840753784 MBQPIUNOJJZXSS-QFIPXVFZSA-N 494.687 0.682 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c([N+](=O)[O-])cc1O 1843011689 GTKJJGRGKGDZNP-UHFFFAOYSA-N 455.232 0.120 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013029 AAGXVCATWZQLHJ-GOSISDBHSA-N 457.336 0.653 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc3nc(Br)nn3c2)C1 1843128218 HFGFWUCTTIFIFD-UHFFFAOYSA-N 499.329 0.621 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)CC2)CC1 1843951677 ZWBIJVURUMFNOE-LJQANCHMSA-N 454.999 0.512 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1844707683 WRQLUBPKDYDGML-UHFFFAOYSA-N 457.462 0.972 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846189025 AKILFLCNNPNENQ-OSPHWJPCSA-N 469.347 0.583 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cncc(S(C)(=O)=O)c1 1848326584 NHNSGOYDCJPJBW-HGKIJXOGSA-N 472.527 0.435 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc(B(O)O)cc1 1848330515 OAWQIPAKOMVSEY-PMACEKPBSA-N 460.299 0.695 50 20 JCGD COc1ccccc1CC(=O)N1CCC(NC(=O)NNC(=O)CNC(=O)c2ccco2)CC1 726251760 QOWCSCQQNWUIQD-UHFFFAOYSA-N 457.487 0.582 50 20 JCGD O=C(COC(=O)[C@H]1CCCCN1C(=O)c1ccco1)NNC(=O)[C@H]1COc2ccccc2O1 728331227 GHVIUSSPXDMEKJ-RDTXWAMCSA-N 457.439 0.805 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN2C(=O)/C=C\c2ccc(C(N)=O)cc2)n1 728729484 OWSRDNIDPQAWLO-SKHCZCESSA-N 499.549 0.488 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](NC(=O)c2cc(Cl)ccc2F)[C@@H](C)O)n1 728729996 YDHOCFPTSNQRLP-BMLIUANNSA-N 486.909 0.657 50 20 JCGD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)CC2)C1 731214691 WCCBWAMWOCFMRN-AEFFLSMTSA-N 460.535 0.668 50 20 JCGD COCCn1nc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)ccc1=O 732678700 LHVTYRCJEFTKNJ-UHFFFAOYSA-N 474.477 0.723 50 20 JCGD O=C(CNC(=O)NCc1ccc([N+](=O)[O-])cc1)NNC(=O)c1csc(N2CCOCC2)n1 748213149 YOGLEXZBJRBPCC-UHFFFAOYSA-N 463.476 0.148 50 20 JCGD Cc1cc(=O)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)nn1-c1ccccc1F 792033195 OHPGWSHKLYTKPI-LJQANCHMSA-N 482.424 0.824 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)cc1 825549127 KDHPPAISGJIOQL-OAHLLOKOSA-N 465.532 0.960 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)c(Cl)c2)C[C@@H](C)O1 912918782 DQCXRVYFGBGDCC-TXEJJXNPSA-N 467.375 0.918 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CNc2ccccc2OC)o1 915064796 QCYZOMHBDXZUGK-HNNXBMFYSA-N 494.526 0.878 50 20 JCGD O=C(NC[C@H]1COc2ccccc2C1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916199480 OXIAMSCGNGNUFL-INIZCTEOSA-N 474.539 0.903 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(C(=O)NCC(=O)NNC(=O)Cc2ccccc2OC)cc1 919820258 RINSTJRBMPXHDM-UHFFFAOYSA-N 476.555 0.846 50 20 JCGD CCOc1ccccc1OCC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 921019939 OAVUAIWXJFOMSM-UHFFFAOYSA-N 468.557 0.991 50 20 JCGD CC(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)n[nH]1 1780153350 LVBBGDGYBYTHDR-AUSIDOKSSA-N 469.546 0.973 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(CO)o1)CCO2)NC(=O)NCc1ccccc1 1780968220 GRLXAXAOEHAMGE-XMMPIXPASA-N 485.541 0.562 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2)NC(=O)NCc1ccccc1 1780969464 HFPACUKEKHYHCE-XMMPIXPASA-N 498.540 0.283 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3c(F)cccc3n1)C2 1782213461 UIYXOOXQXLFQIK-UZUQRXQVSA-N 474.537 0.974 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc4occc4c3O)C2)C1 1782394890 NTZUETIVMDDVSG-QHCPKHFHSA-N 450.256 0.576 50 20 JCGD Cc1ncc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)s1 1782508555 WGXMPSXKCJIVMM-DENIHFKCSA-N 457.361 0.502 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCCS3(=O)=O)C2)C1 1782959559 LLWKPWACTKIGFH-WIYYLYMNSA-N 495.510 0.541 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1occc1Br)CCO2 1783934418 GAHPXTCBBVXOES-GOSISDBHSA-N 457.325 0.859 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935750 WKWSXFVIOHYWHN-JOCHJYFZSA-N 491.501 0.337 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3C(N)=O)C[C@@H]21 1783969213 JPNYKAYHVBQLDC-JURCDPSOSA-N 453.337 0.805 50 20 JCGD CC(C)(C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccn1 1784277849 IHPKQTFTVJLZDL-QHCPKHFHSA-N 452.515 0.501 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1 1784370501 HEFTUEFQHLKWBM-URKNILKWSA-N 470.368 0.318 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1)NC(=O)NCc1ccccc1 1784851862 IQZHIHCNTZJEQL-HSJYVMOXSA-N 471.558 0.055 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncn3C)[C@H]2C1)NC(=O)NCc1ccccc1 1786127758 VRBVQFYZPUCJTK-ZJOUEHCJSA-N 483.573 0.360 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)c2c1 1786980181 SDAFABZFHWUQGY-OEOAZWSVSA-N 475.354 0.992 50 20 JCGD Cc1cc(F)c(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786985005 IMTNEVCSPYMCJQ-QSFXBCCZSA-N 458.270 0.860 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C[C@@H]21)c1cccc(B(O)O)c1 1786986562 LJLVUEFRFYLKFA-LFBFJMOVSA-N 491.397 0.624 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508104 FVGPZBMSEFTWPW-WFHGCUKPSA-N 453.927 0.354 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788140170 KVBBBEBDDPSGOY-OAHLLOKOSA-N 473.360 0.442 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccoc4C3)C[C@@H]21 1788607719 AXEBXPBPXPIEBL-UGJIMAENSA-N 467.526 0.677 50 20 JCGD CN1CCN(CC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)CC1 1789178775 HOJQLVHRGNFKNC-UHFFFAOYSA-N 450.348 0.362 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)nc4cccnn34)[C@H]2C1 1789201689 YGQKTAITKHRMIX-OSFYFWSMSA-N 464.320 0.466 50 20 JCGD CCOc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1789668389 KKUDCWVFJBEXBY-NDXORKPFSA-N 467.526 0.991 50 20 JCGD CC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724944 RYSZSLSUEBMMPI-MUGJNUQGSA-N 461.563 0.083 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1791124065 PEBOSLGEYAKULD-FHAIXYJRSA-N 489.997 0.326 50 20 JCGD CCOC(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21)OCC 1791419798 CZCINOXBCYVGHU-BODMQJBDSA-N 477.562 0.889 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1793418141 MYBIOHGCJQPLOI-ACDBMABISA-N 489.378 0.550 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)CC1=O 1793869869 DGMIKJJOLWRQSX-BFMVXSJESA-N 463.962 0.846 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1CCOCC1 1795469565 SOXCDZLSKUKKKR-FAQVEIGNSA-N 490.513 0.446 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1 1795736296 WWSVQFZUVKRFDE-CEQLMSFQSA-N 466.299 0.060 50 20 JCGD CC[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)NC(=O)OC(C)(C)C 1795739692 BEVJSKFSDBLRPO-SHJAMOMRSA-N 489.378 0.263 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc2cc(Cl)ccn12 1796058114 XTSSTGASZLFVRY-YVWYUNDQSA-N 468.706 0.185 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(-c2ccco2)no1 1796125173 QRFNKBNYJIWFPR-YVWYUNDQSA-N 451.244 0.131 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3c1OCCC3)C2 1796443761 HCNNCKIMFVGEOT-OBAMXFLESA-N 469.502 0.003 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797751540 FGVMKLXKQJTRNE-IHSNIMORSA-N 452.515 0.389 50 20 JCGD CC(=O)Nc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)ccc1C 1797753755 FHDCMTFBSMFKBT-UPHUGPLXSA-N 480.525 0.469 50 20 JCGD C=C1CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1799094837 BMVVMYIXCDJNEB-VTYHHJSWSA-N 455.559 0.888 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc(C(F)(F)F)c1 1799852988 NYLDFBWEKZTQBF-CWPLJXCYSA-N 492.259 0.911 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3cc(F)cc(F)c3)[nH]n1)C2 1801009646 XJQOECQBPBACAL-YEZVWNJWSA-N 490.511 0.931 50 20 JCGD CN(C)c1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1801194101 LVKQRZPGFAKUPN-IRJINJETSA-N 465.359 0.268 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1802225814 DGUCDKZJELIYBG-QRJUGERDSA-N 496.026 0.552 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@H]1CCN(C(=O)C(O)O)[C@H]1c1cccnc1 1804239198 HXXPFPNRSAYPTQ-ILXRZTDVSA-N 456.927 0.530 50 20 JCGD Cc1nc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)no1 1804493125 DKGQNPIABREETL-MGPUTAFESA-N 464.486 0.334 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807361260 HURWZTPISIAHSH-YYWHXJBOSA-N 479.371 0.108 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807368044 PPEPQAXVMASJPM-URXFXBBRSA-N 499.373 0.151 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cnc(O)nc3O)C2)CC1 1810869243 BEJWONPYYWIHRO-UHFFFAOYSA-N 455.475 0.045 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@H]1c1cccnc1 1812889745 SDKDKGBTVYJZSC-UNWOCNEZSA-N 464.526 0.967 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813074737 WLXOHBUIVPFMRI-SGXKBVARSA-N 496.572 0.069 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)C(=O)N(C)C)sc2C1)NC(=O)NCc1ccccc1 1814627860 GFVNMGJKKUQZGY-HNNXBMFYSA-N 487.586 0.490 50 20 JCGD CC(C)(NCCC#N)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1814979042 AQWGMGSJUTWYCH-GFCCVEGCSA-N 470.559 0.649 50 20 JCGD O=C(Cc1ccc(F)cn1)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339621 KJMAFNAFKWCVGU-INIZCTEOSA-N 454.292 0.826 50 20 JCGD O=C(CNC(=O)c1cccs1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350341 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Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(C)c1C(=O)O 1830735721 MGFDETLBVRVYQT-HRAATJIYSA-N 454.907 0.671 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832072146 ABUIMZJNNRQOIX-QHCPKHFHSA-N 492.259 0.096 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832800165 KVFBXMITSCSQOQ-RHSMWYFYSA-N 474.312 0.421 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C3CC(F)(F)C3)CC2)CC1 1833130852 AZMJNVFYFVSNNI-UHFFFAOYSA-N 464.517 0.916 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn(C)c3C(F)(F)F)CCO2)C1 1833329584 FUTBNWKQVGQDJP-GUYCJALGSA-N 468.860 0.763 50 20 JCGD Cc1ccncc1CCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833828939 HTBSCORBEUHXIY-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)/C=C/c3cnccn3)CC2)CC1)c1cccc(B(O)O)c1 1834801466 MCVCGAKPCYCAER-SNAWJCMRSA-N 463.347 0.055 50 20 JCGD NC[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)c1ccccc1 1834822233 DUJGWKZSCOMISI-YLJYHZDGSA-N 454.365 0.970 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CSC(=N)N)CCO2)C1 1835514578 PVZSFNNQSXKXFH-HXUWFJFHSA-N 495.514 0.217 50 20 JCGD O=C(/C=C/c1ccc(F)cc1F)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927150 JBNFYCDMLWHOIX-LHLOKTHNSA-N 486.280 0.428 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)ccc1F 1835939099 FKBWPYAQLYGWHZ-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(F)c1 1835939431 QLQNXRDLNZWHTD-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Br)CC2)CC1 1836414424 KDWWHMADQMHATR-KRWDZBQOSA-N 464.380 0.622 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]cc3[N+](=O)[O-])CCO2)C1 1837797613 XVJQUWAMJGNOIC-CVEARBPZSA-N 450.279 0.624 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838418063 TZTCMWWJCHXBTF-DJJJIMSYSA-N 499.387 1.000 50 20 JCGD Cc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838899902 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O=C(c1cccc(B(O)O)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(OCC(F)(F)F)n1 1848336495 YEEGWVDTTGELQX-IRXDYDNUSA-N 463.221 0.832 50 20 JCGD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)C2=O)cc1 21191014 IKLCYTMZANPYEF-JTSKRJEESA-N 454.439 0.450 50 20 JCGD NC(=O)Nc1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 21197816 UFCYABREHDSEIC-UHFFFAOYSA-N 475.527 0.592 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1 726293499 XMTBSQNIYZUJAF-UHFFFAOYSA-N 458.294 0.475 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)C1 728202338 CSENJIKSGPNQMF-AWEZNQCLSA-N 487.542 0.135 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728890103 WFVZLXJNYQFBQP-SFHVURJKSA-N 492.627 0.941 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)n1 760436876 SUUMWCGNOBTFIM-ZDUSSCGKSA-N 474.495 0.509 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)NCc2cccs2)c1 788024380 XFVYWZFHIILLJB-CYBMUJFWSA-N 457.555 0.422 50 20 JCGD C[C@@H]1Oc2ccccc2N(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1=O 813580609 QTLZEQMYAAQRRH-UGSOOPFHSA-N 455.423 0.331 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1 849119995 IRQMGONYSAWELJ-UHFFFAOYSA-N 496.929 0.923 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(F)c2)c1 913149193 OZEOESOFFJDKFK-UHFFFAOYSA-N 486.547 0.596 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 913155985 NHOVEBDQSNMIHO-OWCLPIDISA-N 457.516 0.330 50 20 JCGD C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1 914460175 XHJUYWRVGSXWQC-ZDUSSCGKSA-N 464.475 0.175 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@@H]3CCN(Cc4ccccc4)C3)nc2)CC1 915902617 IUMPFPPRUWNLRD-LJQANCHMSA-N 473.603 0.918 50 20 JCGD C[C@@H](NC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)c1cccc(S(N)(=O)=O)c1 916197052 LUVDAISLWMLOKN-QGZVFWFLSA-N 474.587 0.938 50 20 JCGD Cn1ncc2c1CCC[C@H]2NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916604495 INBIXSKGOHVLOL-LJQANCHMSA-N 490.586 0.782 50 20 JCGD O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCS(=O)(=O)NCc1ccccc1 916645471 XMHRMRUFDYPHGY-UHFFFAOYSA-N 451.461 0.424 50 20 JCGD O=C1CN(C(=O)c2ccc(CNC(=O)NNC(=O)c3cncn3-c3ccccc3)cc2)CCN1 1317889611 RXTDWMSZJXKRLT-UHFFFAOYSA-N 461.482 0.589 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)C1 1779034081 LVISDMNPKQQZCZ-CKNGIIGNSA-N 473.530 0.108 50 20 JCGD Cc1cccc2c(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)n[nH]c12 1779037348 WSHBEXIEKWWJEB-HSZRJFAPSA-N 463.498 0.627 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnn3c1CCC3)CCO2)NC(=O)NCc1ccccc1 1780967921 DFABXJPCDYHXBD-VWLOTQADSA-N 495.584 0.619 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1 1781764972 DWJDASALIRTPQY-FQEVSTJZSA-N 451.455 0.550 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(Cl)Cl)C1 1782219707 BEGCSPHUKLKBFQ-SPYBWZPUSA-N 460.362 0.775 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCN3C(=O)OC(C)(C)C)C2)C1 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O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc4[nH]ccc4c3)C[C@@H]21)c1cccc(B(O)O)c1 1786986611 QIHNQIXLGGGARY-BVSLBCMMSA-N 476.342 0.469 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3cc(=O)nc4cccnn34)CCC2)cc1)c1ccc(B(O)O)cc1 1788142352 SCKHIAAXMDFMJA-UHFFFAOYSA-N 483.293 0.831 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C[C@@H]21 1788607872 QWFYHZHUJULIPD-PWZKMPOXSA-N 492.536 0.472 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)[C@H]2C1 1790174362 ZGIUQGOPTXKNDK-YGJAXBLXSA-N 478.384 0.840 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc2ccccc2n1C 1792818983 PBNFYPINCMWILY-MRSFGVLCSA-N 455.559 0.683 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793879237 RIWIVEHHRHAGHP-SLZITWOASA-N 460.959 0.233 50 20 JCGD COC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1795133476 CBUXKCLESCCGCO-VTEUUUEMSA-N 463.443 0.677 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1nc(-c2ccccc2)ns1 1795919891 ZFCJSLVYAMDFDN-IZZQQSIFSA-N 478.339 0.402 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1796439553 KOHOLAFDRRSTDW-GOAQRRQVSA-N 487.557 0.689 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn(C(F)F)c1=O)C2 1796441678 OZCQDLYFFKXBQW-DBOAAZOQSA-N 490.467 0.581 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ncccn13)C2 1796442070 PSKQAMFAONTDHR-LOHQAQBBSA-N 464.486 0.067 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2 1796844089 MVPCQPMVPFIJFI-YVSFHVDLSA-N 469.583 0.537 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1c(Cl)ccc2c1OCO2 1796939638 WKWGUVGJOQQHGN-HBCWATKFSA-N 472.690 0.266 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O 1797121990 WOSRUNZCKACBCV-MULDDASSSA-N 489.997 0.448 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@@H]1CCOC1)C2)NC(=O)NCc1ccccc1 1799099379 VXZKZHPZZATKKK-IUBSTNSRSA-N 487.601 0.739 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)c2n1 1800138184 MZTHSBKUMQABKH-RMFSNUHRSA-N 462.315 0.148 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1800825211 WLYAUVZSLBAHSF-HKQPUQOZSA-N 463.934 0.871 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC(c2ccccc2)=NN1 1801214699 QUKDFNCKYUXBNY-KYFSNAEOSA-N 461.526 0.703 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1CCN(C(=O)C(O)O)[C@@H]1c1cccnc1 1804239201 HXXPFPNRSAYPTQ-SOUVJXGZSA-N 456.927 0.530 50 20 JCGD COc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1807360670 CRPGKOXMJQVDOB-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364360 FDPWVIUTURPJJC-UDDWMFPDSA-N 451.332 0.632 50 20 JCGD COc1cccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1807369184 CAPUDAXFZZBEIV-GCJKJVERSA-N 460.299 0.798 50 20 JCGD Cc1[nH]nc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1F 1807369590 PJUJAZRJWNQONG-JXFKEZNVSA-N 451.267 0.565 50 20 JCGD CN(C)CC(=O)N1CC[C@@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1807454727 WVWOPUXHRZTVGL-XUZZJYLKSA-N 481.601 0.995 50 20 JCGD Cc1nnsc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808645944 DLWXHSUESNRGIY-SJLPKXTDSA-N 451.317 0.555 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810398552 UEABBBFVHVCYPE-VGOFRKELSA-N 476.541 0.982 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n(C)n1 1810923021 BZFIGMALNQRUTK-PGRDOPGGSA-N 461.331 0.691 50 20 JCGD NC[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccc1 1815159746 JMUSXUASVLOANM-ZWKOTPCHSA-N 464.356 0.791 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3cccnn3n1)CC2)c1ccc(B(O)O)cc1 1815343576 ARZJHSZTAYBFFU-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD Cn1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c2c1CCC2 1815356792 RMVCYUHYILTZPU-CQSZACIVSA-N 465.344 0.585 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCN(C)CC1)CC2 1817280569 ZNQXCWXUBAVGMB-PJAVDKHJSA-N 486.602 0.437 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CNC(=O)C1)CC2 1817283056 SIZYXITWQFJTMR-ACLYYTTKSA-N 457.516 0.325 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCc1cn[nH]c1)CC2 1819793693 RJTMTYHYWWNKDS-LBPRGKRZSA-N 454.516 0.723 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)CC1 1825504906 TUIVZMWAHCXNBG-IBGZPJMESA-N 481.513 0.720 50 20 JCGD O=C(CSc1nc[nH]n1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827055061 ODLYYLDPDYVKJZ-SFHVURJKSA-N 457.365 0.510 50 20 JCGD O=C(c1cc2ncccn2n1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059605 SCAPYFHGTFGWMF-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD CN1N=C(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)CCC1=O 1828923750 WYBUTHBDFDDBCG-LJQANCHMSA-N 469.546 0.527 50 20 JCGD Cc1nn[nH]c1C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829031100 ZMZMMGOPPYTVOY-VGSWGCGISA-N 490.948 0.779 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc2)CC1 1829693842 YFMUXKIPTRSWNF-OFNKIYASSA-N 480.993 0.108 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830370036 HAJBGKAPYAEVKZ-OAQYLSRUSA-N 464.987 0.778 50 20 JCGD COc1nn(C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830535867 VMQAABBCMWLRTQ-SCLBCKFNSA-N 459.341 0.530 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H](N)c3cccnc3)C2)C1 1830537635 LLHGTJMBMLIZGW-WRWLIDTKSA-N 469.380 0.959 50 20 JCGD CCOc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1 1830543662 XRCAJDSWHWUQTE-IFXJQAMLSA-N 471.352 0.976 50 20 JCGD Cn1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc2c[nH]c3nccc-3c21 1830730915 GFTBBQUHDVZDFE-HTAPYJJXSA-N 475.933 0.676 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731216 HYFIIAFKNVBOIW-OXJNMPFZSA-N 485.877 0.190 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830733413 LIVKGPCJHKNUFT-PNLZDCPESA-N 489.997 0.690 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1831298903 YPBLGMXYTBIJSD-OZIGNCPNSA-N 452.935 0.855 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832078572 IRUCDPMAQRBEDJ-GSHUGGBRSA-N 489.997 0.832 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)cnn1C 1832549120 FMAPBHVIRWANNO-JTSKRJEESA-N 499.996 0.931 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cn1 1832913236 QVRGYCCZKCHTQY-HSZRJFAPSA-N 461.563 0.152 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1 1833264832 LXBWMMHUEYDPGX-LSDHHAIUSA-N 495.484 0.917 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738339 XMHMQEKMXLKIHO-MRXNPFEDSA-N 473.578 0.671 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835846728 DOVSYUKQJKTEDU-GOSISDBHSA-N 479.390 0.447 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1F)CCO2 1836315462 BURGRQLKAGRMLS-WGLQLPMYSA-N 472.477 0.425 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1836398537 MOEJNXSXCUCFSB-QGZVFWFLSA-N 473.338 0.519 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@@H](F)Br 1836412487 IUKVEDDFKIEZBK-QGZVFWFLSA-N 470.148 0.242 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccc(F)c1[N+](=O)[O-] 1836452140 YXWQVQZVHIJCRT-UHFFFAOYSA-N 498.320 0.913 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@@H](C)O1)CCO2 1836605228 LBEIQNMDQZJKID-HSQMAOTMSA-N 461.519 0.144 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1 1836866974 TZOFVBHUOIISMD-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD C[C@@H](Sc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456400 LXXXJBPVYQCZSQ-MZNJEOGPSA-N 499.593 0.936 50 20 JCGD Cc1cc(F)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459906 OUHBTHKYYMFHEL-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837637284 ZLELPVMBZBGXPO-OQBWYENPSA-N 469.922 0.162 50 20 JCGD O=C(CCBr)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837653805 YKHLJZVLIKMGFF-UHFFFAOYSA-N 467.169 0.764 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)cn3)C2)C1 1838528014 AAOZVXJLPSLGAY-JOCHJYFZSA-N 487.469 0.637 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2 1838998023 AMEHCBGWGYBVNL-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD O=C(c1ccc2nn[nH]c2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203057 YIDNOFWAVSJPIB-WMLDXEAASA-N 456.272 0.718 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1O 1839427668 NDZHDFMWTJVFRX-QHCPKHFHSA-N 478.546 0.234 50 20 JCGD O=C([C@@H](O)Cc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839960741 LEHTUFOLLVDYGE-TXPKVOOTSA-N 459.312 0.737 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1839964049 DLUSQPDMCSJYOH-AUUYWEPGSA-N 466.336 0.973 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1840032863 MJKIZFUBUWYYOK-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1 1840033818 ROPJVTWGFGGHCO-ZUOKHONESA-N 466.332 0.783 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nc3Cl)C2)C1 1840185949 XGEWIUBBSDKFCB-HXUWFJFHSA-N 488.372 0.831 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Oc1ccccn1)CCO2 1840424544 QJGXBBOQSZSQRA-GEVNIGOCSA-N 498.540 0.439 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc(C)c1O 1840675355 ZECZCZYBJZSRKS-XMMPIXPASA-N 468.315 0.073 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)CN2CCS(=O)(=O)CC2)C1 1841894941 NOKJYYZUDFTZRQ-SFHVURJKSA-N 498.443 0.926 50 20 JCGD CC(C)C(=O)Nc1nc(O)c2ncn(CC(=O)N3CCCC34CN(C(=O)[C@H](F)Cl)C4)c2n1 1845884501 SCXPOIRQIPXBKN-ZDUSSCGKSA-N 467.889 0.864 50 20 JCGD CCn1nnc2c1[C@H](C(=O)N1CC[C@H]3[C@@H]1CCN3C(=O)[C@H](O)CCl)CN(C(=O)OC(C)(C)C)C2 1847556832 QEIMJFIIKZHARV-BSWAZPDLSA-N 496.996 0.934 50 20 JCGD Cn1cc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 21444326 GHHJZFXDNWEVMX-UHFFFAOYSA-N 480.510 0.449 50 20 JCGD O=C(CN1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1)Nc1ccccc1 23391346 WQWSPGNSNHISKL-UHFFFAOYSA-N 473.559 0.590 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)c1cccc(S(=O)(=O)N(C)C)c1 727611271 YOMONVNJIGNANS-ZDUSSCGKSA-N 458.504 0.618 50 20 JCGD CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc(C3CC3)nc21 728889388 GJCJFXHMWTYCEX-UHFFFAOYSA-N 478.513 0.862 50 20 JCGD O=C(NNC(=O)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)c1ccc(-n2cnnn2)cc1 729493860 AIKUZWLBTNPIID-INIZCTEOSA-N 488.505 0.599 50 20 JCGD Cn1[nH]c(Br)c2c(=NCCNC(=O)NNc3ccc(-n4cccn4)nn3)ncnc1-2 729626641 OBIYAPLUGQLJCP-UHFFFAOYSA-N 473.299 0.213 50 20 JCGD C[C@@H]1Oc2ccccc2N(CCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1=O 761465534 XPFHJDQNWASSGJ-NSHDSACASA-N 466.903 0.953 50 20 JCGD Nc1nc(Cl)c(C=NNC(=O)c2csc(N3CCOCC3)n2)c(N2CCOCC2)n1 874080740 SXZGIRHBHHYKEG-UHFFFAOYSA-N 452.928 0.606 50 20 JCGD O=C(NNC(=O)[C@H]1CC[C@H](C(F)(F)F)NC1=O)c1cccc(S(=O)(=O)N2CCCC2)c1 914830370 QRGIGEWCQRNYOH-UONOGXRCSA-N 462.450 0.689 50 20 JCGD Cn1c(CC(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)nc2ccccc21 916266904 MMWSUWOHJWURJI-UHFFFAOYSA-N 451.535 0.449 50 20 JCGD O=C(NCCNC(=O)c1cccnc1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 916443564 LOPSQPXQFRLFFT-UHFFFAOYSA-N 474.543 0.630 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2cccc(S(N)(=O)=O)c2)nc1 916624153 UYWJJJPNKVPPLH-UHFFFAOYSA-N 456.550 0.586 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)CC(F)(F)F 918365214 WVRBPJPSCHOBOM-PGJNLMOESA-N 471.479 0.480 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2C[C@@H](C(=O)NNC(=O)NCC3CC3)CC2=O)cc1 920860182 KTOKOXQULDFVOJ-HNNXBMFYSA-N 451.549 0.810 50 20 JCGD CC1(C)NC(=O)N(CCC(=O)NN/C=C2/C(=O)N(c3ccccn3)C(=O)c3ccccc32)C1=O 920977507 BFHWJISLEJVZEL-DTQAZKPQSA-N 462.466 0.951 50 20 JCGD CCOc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029458 SFQDHFCPSFMKQU-QFIPXVFZSA-N 454.487 0.236 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(F)c1 1779032799 ZLDABCXVDLKPTO-DEOSSOPVSA-N 485.516 0.909 50 20 JCGD Cc1ccc(C(=O)C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779033849 FXQVOYUSOIQUTP-QHCPKHFHSA-N 451.483 0.320 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779036928 IYPRSTLDVHWRJY-QHCPKHFHSA-N 482.497 0.621 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1780199887 ACUAHIJVFVYEOQ-FOIQADDNSA-N 465.894 0.376 50 20 JCGD CN(C)c1cccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1780373150 VJJWRYFKCMNUPP-RCZVLFRGSA-N 465.359 0.874 50 20 JCGD O=C1NCCn2nc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@H](F)Br)C3)cc21 1780771604 NAONYRZXSOTNGT-QWQRMKEZSA-N 472.315 0.445 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1cc(C)on1)C2 1782175747 QKPPAUBILKRBLW-AKCHCHLHSA-N 456.927 0.481 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(F)c1[N+](=O)[O-])CCO2 1783934702 KTVBASMFKJCPAJ-FQEVSTJZSA-N 451.455 0.550 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@H]1CCc2ccccc2[C@H]1O 1784148491 LQFVORJPXDNCFK-KGZUAYNTSA-N 478.354 0.256 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CCn3nc(C)cc3C)C2)C1 1784318566 KEGIETQKQYXNRU-UPQSEYGOSA-N 469.546 0.854 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cn4nc(C)sc4n3)[C@H]2C1 1784852959 RKWNCJDUOXUMLW-TUUVXOQKSA-N 455.968 0.875 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc(OC)c1C 1785175304 MWIFESKCUJMXDG-XMMPIXPASA-N 483.525 0.768 50 20 JCGD Cc1ccccc1NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786979928 QGSQEBDOVRSTLW-VCOUNFBDSA-N 451.332 0.380 50 20 JCGD COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1C 1786981979 JHSPYGVVEZFKBL-XJABCFGWSA-N 452.316 0.591 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609714 CGQGNNLMOINMDK-LPWQTFTOSA-N 460.579 0.256 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]cnc3-c3cccnc3)C[C@@H]21 1788610023 MIXLRXSHRZVSBN-SNRMKQJTSA-N 490.524 0.377 50 20 JCGD Cc1nc[nH]c1CSCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611033 GWWXQJSKZPOSPU-FNHZYXHNSA-N 487.586 0.243 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc(C(F)(F)F)n1 1788879213 LQGCPQAFFKYSEG-ZVZYQTTQSA-N 477.248 0.687 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1792531073 OHOZNJREXKAVQB-UNPPPGBBSA-N 487.981 0.059 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)cc(C(F)(F)F)n1 1792980566 LRQBMFFIYFLJSX-OXIQGZBJSA-N 451.829 0.912 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)c(C)nn1C 1794494650 SIKMIHSKWOSFSQ-LVTGYEAHSA-N 459.482 0.205 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)C2)c1cccc(B(O)O)c1 1795738698 AJJNTOYXZLUBCC-ZSQJQDDOSA-N 464.352 0.458 50 20 JCGD Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c(C(F)(F)F)o1 1795738866 JZYYWRKAMVQCMM-AGGWBTHJSA-N 467.209 0.199 50 20 JCGD CC(C)n1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1C(=O)O 1796190716 CRZMORUBSMBPER-BJWYYQGGSA-N 454.292 0.408 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(F)ccc3[nH]1)C2 1797750566 IRVWZGBJWGZWIA-VTEUUUEMSA-N 466.473 0.823 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCCC1=O)C2 1798522093 CYEBEWVHBNKKQI-USGNIVHTSA-N 474.470 0.346 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(O)nc1O)C2 1798522345 PWDOCWBPUQEMOZ-DPIQGUFMSA-N 487.425 0.238 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2cccc([N+](=O)[O-])c2)CCC1 1799245101 YXORDSWEAJVSLE-OPMZPASUSA-N 493.325 0.600 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1802862916 KRQJLZWKIYRGET-LDQXTDLNSA-N 496.373 0.994 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807359900 MSIKBZXOPOOTOE-CEMLEFRQSA-N 450.348 0.565 50 20 JCGD CN1CCC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)C1 1807552008 QUFIMHJPGOPLME-LQWHRVPQSA-N 465.558 0.742 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CN2C(=O)C=CC2=O)[C@@H]1c1cccnc1 1808416819 RUNSPHSUCGANST-MYSHNMEISA-N 491.508 0.146 50 20 JCGD Cn1c(=O)c(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)nc2ccccc21 1809971994 GBUWMXWYFJLPKL-UHFFFAOYSA-N 488.353 0.772 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnn2c1CCC2 1812140583 FJYSYCHNQHLGCZ-PGRDOPGGSA-N 459.315 0.538 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1812864678 JZPAGTCEDJOBGO-GHJWDPDVSA-N 452.309 0.423 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(Cl)nc1)CC2)c1cccc(B(O)O)c1 1815347922 XNGYCYLZXZWXIJ-CYBMUJFWSA-N 457.708 0.806 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnnc(Cl)c1)CC2)c1cccc(B(O)O)c1 1815354696 BANJJRINUISCBL-CYBMUJFWSA-N 457.708 0.806 50 20 JCGD COCc1c[nH]c(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1 1815361168 ZIYIGQPHVJGYMF-HNNXBMFYSA-N 454.317 0.837 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc2c(c1)CNC2=O 1819202889 MWDSOVGWHXHZGN-FQEVSTJZSA-N 473.298 0.953 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1820204818 LLDATRAVGXBNQX-CJNGLKHVSA-N 465.344 0.944 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCc2ccc(O)nn2)n[nH]1 1821640410 PXVFJLXKCJBAKM-KRWDZBQOSA-N 479.501 0.843 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@H](O)CCl)[nH]n2)N1 1821781153 ZLIBCKIFYUHZNF-SPWCGHHHSA-N 498.993 0.182 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC(=O)N1)CC2)NC(=O)NCc1ccccc1 1822518238 HDCWWTDAUFEKIL-NVXWUHKLSA-N 499.597 0.680 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826089677 LEGBQCIITLLQQY-OAHLLOKOSA-N 485.607 0.498 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCN(C)CC2)CC1 1828442759 BXJDADQBFNNUQB-DPRDIOBOSA-N 485.633 0.988 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)CBr)CCO2)C1 1830540941 WOEWXEBQKVEIAX-QMTMVMCOSA-N 462.385 0.779 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CC(=O)NC3=O)CC2)CC1 1833711944 NXHYCDBJXNHKHR-LJQANCHMSA-N 462.378 0.346 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCc3cncnc3)CC2)CC1 1835737125 ZNEITFKZQMUJOD-UHFFFAOYSA-N 480.573 0.293 50 20 JCGD CN[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)C(=O)O 1835763964 OOXJWUFRHWJUHQ-GAGRNPODSA-N 492.479 0.391 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(F)CCCCC3(F)F)C2)C1 1835937454 XNIPLXAIEGUFAZ-SFTDATJTSA-N 484.280 0.354 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1C 1835939355 NLMIKXXRSHQYFS-XMMPIXPASA-N 452.316 0.367 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459536 IRFCGTUXVBYEEC-XMMPIXPASA-N 499.524 0.086 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920858 JZYKBEOSEFWARV-QHCPKHFHSA-N 471.407 0.851 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](COC(C)=O)OC(C)=O)CC2)CC1 1838401099 YRMKEEJDQPNRCU-MOPGFXCFSA-N 476.954 0.734 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3c4c(nn3C)CCC4)CC2)CC1 1838710719 HHHLGHKBBZNBPF-UHFFFAOYSA-N 474.606 0.894 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1OC 1839399344 YBKSMBMBMNVJEC-VWLOTQADSA-N 498.341 0.076 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1 1840035086 FTLRIUIFFKZJEF-UGSOOPFHSA-N 464.357 0.751 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C(=O)OC(C)C)C2)C1 1840150078 GCRRAWSBLCXFDM-VGOFRKELSA-N 483.949 0.971 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1 1840184268 GBEKJTJFGOZJDI-XMMPIXPASA-N 469.542 0.678 50 20 JCGD O=C(c1nccn(Cc2ccc(F)cc2)c1=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010676 QNTLLKUHHONFOC-UHFFFAOYSA-N 490.300 0.241 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264889 VYEZGGAJIRVZCY-AWEZNQCLSA-N 468.489 0.460 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cc(Cl)cc3nn[nH]c23)C1 1844751397 OEVSYCPHRQLRSP-UHFFFAOYSA-N 454.878 0.741 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1845077131 SNGFQLXOJVICGL-HSALFYBXSA-N 499.373 0.208 50 20 JCGD C[C@H](C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1ccnn1 1845814499 HLMUMDMTNAPWLR-QGZVFWFLSA-N 454.535 0.389 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)C[C@H]2C1 1846104976 AKEQXVDZTREWSM-AVRWGWEMSA-N 483.374 0.831 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H](Cc2cnc[nH]2)NC(=O)OC(C)(C)C)C1 1846535249 CSVYXJVGOLFPHF-KRWDZBQOSA-N 491.593 0.422 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)[C@H]2OCC[C@H]21 1847563568 KNGVVYXXJSFEQZ-JQVOGXOBSA-N 457.955 0.812 50 20 JCGD O=C(Cc1ccc(Br)cn1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1848243134 URJRVPBTMCFGCQ-ROUUACIJSA-N 458.121 0.582 50 20 JCGD O=C(COC(=O)C1CCN(C(=O)N2CCCC2)CC1)NNC(=O)[C@H]1COc2ccccc2O1 728328404 IVXXTVCQZQVHAX-GOSISDBHSA-N 460.487 0.445 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)OCc1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1 728342495 GUTJVRZKFIQQPL-FUHIMQAGSA-N 499.476 0.289 50 20 JCGD COc1ccc(C(=O)NNC(=O)Cc2cccnc2)cc1S(=O)(=O)NCc1ccccn1 728981601 DVPKBLBXKDVSOC-UHFFFAOYSA-N 455.496 0.967 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(CN3CCC[C@@H](C(N)=O)C3)c2)c1 731117860 KWYZASCCIAJTKK-LJQANCHMSA-N 487.582 0.932 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N3CCOCC3)CC2)cc1 745992123 VDACBNMGPOYCDF-UHFFFAOYSA-N 468.532 0.337 50 20 JCGD C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)[C@H](C)Oc2cccc(Br)c2)C1=O 748546389 JJFGBWDQPASOGR-JTQLQIEISA-N 453.249 0.341 50 20 JCGD CC(C)(C)NC(=S)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C\c1ccccc1 825164362 UFEKIIGEGXOBEV-WVUXNXBLSA-N 476.646 0.674 50 20 JCGD O=C(COC(=O)CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccccc1 825248637 AOWBBSNMAXCVQO-UHFFFAOYSA-N 491.522 0.911 50 20 JCGD O=C(COC(=O)c1cccc(N2CCCS2(=O)=O)c1)NNC(=O)[C@@H]1COc2ccccc2O1 830414095 AOIXAEVKZUFBNC-SFHVURJKSA-N 475.479 0.371 50 20 JCGD Cn1nc(C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)c2ccccc2c1=O 913573033 JETXSWZLGJLEDV-OWBHPGMISA-N 455.496 0.675 50 20 JCGD COc1cc(CNC(=O)NNC(=O)COc2ccc(C#N)cc2)ccc1OCC(=O)N(C)C 916641557 RUTPRXQGBHJINY-UHFFFAOYSA-N 455.471 0.943 50 20 JCGD O=C(COc1ccccc1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)NC[C@H]1CCCO1 918217550 JQYNBTDLDISUNE-LJQANCHMSA-N 494.512 0.481 50 20 JCGD COc1ccc(C(=O)NCCNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)cc1 918220969 DVVFTMWGWLZXBD-UHFFFAOYSA-N 450.521 0.833 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)NCCNS(C)(=O)=O)cc1 920852407 ZIQHSLAZQBKNJT-RVDMUPIBSA-N 460.516 0.006 50 20 JCGD COc1ccc2cc(C(=O)N3CC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)[nH]c2c1 1777769689 QCTWPTVOFZAZMK-DEOSSOPVSA-N 463.299 0.614 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091012 JWOSLGOWTGXGOU-BMLDHVPYSA-N 488.589 0.939 50 20 JCGD CN(C)c1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779032696 RVAWSPWHPCSGNW-HSZRJFAPSA-N 452.515 0.508 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(F)c1[N+](=O)[O-])CCO2 1779037113 OMHAQCUTARDJOU-OAQYLSRUSA-N 472.433 0.490 50 20 JCGD Cc1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn2[nH]cnc(=O)c12 1780021719 NDEWHPGMJYPHKZ-KZULUSFZSA-N 452.309 0.558 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780774762 LLURUCLGCSEKQR-RLSLPTNOSA-N 454.293 0.255 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2 1781383331 KZMZUXVINSAZDT-NQIIRXRSSA-N 480.986 0.156 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1 1782809296 YBPSOSJIQNUKJC-LMVRJCEZSA-N 451.951 0.051 50 20 JCGD COc1cc(CC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc(OC)c1OC 1783933263 FZRHZRJALZUOGA-DEOSSOPVSA-N 492.573 0.458 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3c(n1C)-c1ncccc1OC3)CCO2 1783933885 KUKCDGWUOSIAGI-RUZDIDTESA-N 496.568 0.796 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)CCO2 1783935151 PVZWRMCDIRFENE-OAQYLSRUSA-N 473.490 0.288 50 20 JCGD Cc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)n1 1784221934 WPOBEJBDZJSPHG-YSSFQJQWSA-N 452.515 0.225 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COCc3ccccc3)[C@H]2C1 1786713266 XABYCHCLLZCLFR-YYWHXJBOSA-N 467.526 0.495 50 20 JCGD N#Cc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1Cl 1786984811 MDXHTSTUPWCRCN-VDGAXYAQSA-N 467.718 0.799 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C)n(C)n3)C[C@@H]21 1787509027 XILRWYRERBCMRD-LVWMUPNFSA-N 455.519 0.456 50 20 JCGD CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CSCN3C(=O)[C@@H]3CCC(=O)N3)C[C@@H]21 1789865072 JAVQEDOIJOJDDY-NYXISSTPSA-N 487.022 0.164 50 20 JCGD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1792238452 CIESASUQHJFZQW-SRVKXCTJSA-N 464.407 0.611 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)[C@@H](O)C1 1792453913 XPMDFIKUJWXTCT-QKGCVVFFSA-N 480.389 0.998 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr 1792870767 LCGNITJRSYFFCB-URXAQBOPSA-N 463.325 0.102 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3c(Br)cccc3n1)C2)[C@H](O)CCl 1792981228 HIIMQSRMKRTAQD-DDFXLWFNSA-N 471.739 0.900 50 20 JCGD O=C(Cc1c(F)ccc(F)c1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793642665 RRTFKALSNRIROI-GFENJXEQSA-N 462.233 0.230 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc(OCC(F)(F)F)n1 1794335644 YIBKELUOPWGTOZ-CCWDJLKJSA-N 493.247 0.220 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)nn1C 1794724759 DHNKKNFGLNTBSD-HATOLVCRSA-N 483.573 0.278 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)c12 1795740539 GFPSIGQWQMQFPJ-MFKICJERSA-N 463.299 0.373 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2 1796441662 NXQIJDQCOIZZFS-LOCKBPMISA-N 484.557 0.111 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796444381 QHJIJRULHACVCX-MLYANYNQSA-N 461.519 0.299 50 20 JCGD CO/C=C(\C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1797621353 OHSCFEANNWAOIX-MSZOGTQKSA-N 459.547 0.472 50 20 JCGD COc1cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)ccc1[N+](=O)[O-] 1800047225 BQQIVQIVZOSZOX-REPLKXPHSA-N 467.287 0.778 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1800595254 ZPAZIRVPFYTXEH-MGQVEPIASA-N 451.288 0.388 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1800743933 OFPKUAQBCICZLR-NSAZKJPHSA-N 489.573 0.264 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)C2 1801008879 GCOBGGIQWBTKGU-JRYVQNIKSA-N 458.559 0.245 50 20 JCGD CC[C@@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)NC(=O)OC(C)(C)C 1801012817 ZLUHHBKUWUUWSY-DLRJPAPCSA-N 483.610 0.642 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)C1 1801014773 FQUOVJUZEBDOKZ-AICCOOGYSA-N 480.389 0.998 50 20 JCGD COc1ccc([C@H](O)C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc1 1802797110 HSVABNUJVFMVDB-QDSKXPNFSA-N 489.337 0.823 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1803007568 DKPFUQOLZYEGOL-AOLWHUPESA-N 466.336 0.717 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CS(=O)(=O)N2CCCC2)[C@H]1c1cccnc1)[C@H](O)CCl 1803138802 FHMLNNGEHVWSRM-JZXOWHBKSA-N 458.968 0.113 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807366862 HUOXGCTWUXURMD-AGHHOFFYSA-N 461.331 0.614 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2COc3ccccc3O2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369197 CEZRBZXQLVBRQF-IEXUWNMDSA-N 487.321 0.921 50 20 JCGD CN(C)c1cncc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1807369314 FZGLMWDIQUGLCY-AUSIDOKSSA-N 473.342 0.856 50 20 JCGD O=C(CSc1ncccn1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807571284 NESSLMNLRRLPAC-WIYYLYMNSA-N 477.355 0.663 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1808592596 VPTDDDAGRFEESL-AVRDEDQJSA-N 488.309 0.576 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CNC(=O)c3ccco3)C2)CC1 1810139340 PHLXUSBZQOPGQI-UHFFFAOYSA-N 468.514 0.553 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1F 1810300113 XCODELBETGWOBI-HNAYVOBHSA-N 480.504 0.895 50 20 JCGD CC(C)(C)NCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303414 RTWWHUJRCZBKRH-OXQOHEQNSA-N 453.547 0.788 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCc2cnccn2)[C@@H]1c1cccnc1 1810309443 QYZWWLRZRHKEJB-HTAPYJJXSA-N 474.525 0.823 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCNC3=O)[C@H]1c1cccnc1 1813029758 WOJWJHSFHJKDKN-VKJFTORMSA-N 460.922 0.595 50 20 JCGD COc1nccnc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813071280 RPUKKPAPGJIPPW-OXQOHEQNSA-N 455.519 0.573 50 20 JCGD O=C(CCc1ccc(O)nn1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815359725 BDAIOBJWWFONBV-OAHLLOKOSA-N 467.316 0.177 50 20 JCGD CN(C)c1ncc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)o1 1817470663 GDPUHAHSCREFOO-MRXNPFEDSA-N 452.280 0.763 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)N1CCN(C)CC1 1817472741 VRULMZKEZIYRNZ-OXJNMPFZSA-N 468.367 0.031 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)N2CCCC2)[nH]n1)c1cccc(B(O)O)c1 1817474111 MIUUXBMCWOJODP-LJQANCHMSA-N 467.335 0.798 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CSc2ncccn2)[nH]n1)c1cccc(B(O)O)c1 1817475544 SJRDPZLULUPCKV-KRWDZBQOSA-N 466.332 0.978 50 20 JCGD CNc1nsnc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819790537 GEBIWBVDXBQTEA-QMMMGPOBSA-N 473.544 0.574 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc(Cl)ncn3)sc2C1)c1cccc(B(O)O)c1 1820934318 WSWKEYCIJCHFBN-GFCCVEGCSA-N 457.708 0.806 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCNC(=O)c2ccc[nH]2)[nH]n1 1822410194 BCCGKELXFWQFCF-QGZVFWFLSA-N 472.550 0.923 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H]3CCc4nc[nH]c4C3)sc2C1)c1ccc(B(O)O)cc1 1826617505 UGCHNHOLVZOVCB-DZGCQCFKSA-N 465.344 0.577 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCn2ccnn2)CC1 1828925545 LDFCHVQNTDNJOK-LJQANCHMSA-N 454.535 0.600 50 20 JCGD CC(C)N(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C(=O)OC(C)(C)C 1830719868 MXZAJEZBTIIOMA-HRAATJIYSA-N 477.986 0.688 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830738369 OLKYCJYBKOQMSI-APWZRJJASA-N 459.858 0.333 50 20 JCGD COc1ccc2c(CC(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)c[nH]c2c1 1830814880 PIPOQZVZXLPDGC-SIKLNZKXSA-N 465.934 0.775 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1 1832197980 DYTAGONFSCUHKM-YWZLYKJASA-N 480.363 0.919 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)ccn1 1833368930 JLYWGOHJINSLAF-RUZDIDTESA-N 481.358 0.443 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833571964 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1835933940 HPHXUMVUFFFYIX-RUZDIDTESA-N 484.333 0.517 50 20 JCGD O=C(CSc1ncccn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836115061 LBEAMOWFFMRTJQ-BBRMVZONSA-N 463.329 0.716 50 20 JCGD Cc1cccc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)[nH]c12 1836854456 IAQFWBPAPPMFNU-RUZDIDTESA-N 492.536 0.859 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)s3)C2)C1 1837456153 CZYLGIAWGSZOAG-FQEVSTJZSA-N 479.946 0.784 50 20 JCGD CC(F)(F)C(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456993 VCDXEHWMMCENOY-NRFANRHFSA-N 469.489 0.437 50 20 JCGD CC1=CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1 1837458823 FEVLKQNAEVSCNU-GAJHUEQPSA-N 457.531 0.502 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc4cccn4cn3)CC2)CC1 1837919194 PLYIMCJEGGWADI-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD CCOCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528415 WCTLFXVVAQABDG-OAQYLSRUSA-N 465.459 0.627 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)nc1 1839052255 QRANWJPMJUCAAO-IERDGZPVSA-N 455.939 0.604 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203715 UDTJKEGMCFACEK-DHSIGJKJSA-N 460.300 0.996 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(NC(C)=O)c(O)c3)CCO2)C1 1839473483 BIWDESYOZJQMAO-HRAATJIYSA-N 469.922 0.674 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3ccoc3c1)CCO2 1839537065 OKUCKPNDOOSILL-HSZRJFAPSA-N 458.515 0.876 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1839964966 JXICOHYWMLGIOO-IFXJQAMLSA-N 471.352 0.909 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H]3C[C@@]34C(=O)Nc3ccccc34)CCO2)C1 1840017989 PBKSAHOIWLYCQD-UOGRCSNTSA-N 477.945 0.607 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4[nH]ncc4c3)C2)C1 1840033414 CMGVLVPKLALBHO-XIKOKIGWSA-N 452.309 0.811 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1 1840153309 KBAKIOMARGTDHW-HRAATJIYSA-N 451.907 0.505 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(C(=O)OC)cc3)C2)C1 1840156591 WNYHFXGUWWQFQH-XMSQKQJNSA-N 468.934 0.726 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3Cl)C2)C1 1840183104 REZKIFCJFRHMBG-FQEVSTJZSA-N 453.927 0.178 50 20 JCGD CCOC(=O)N(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)Cc1ccco1 1840340492 NKPLDVJVMGCUAA-LAUBAEHRSA-N 487.937 0.294 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840912977 UOACKYQHDKAFEB-FHTPNYMGSA-N 487.981 0.512 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843011334 TUABYTQVAFOCHY-MJGOQNOKSA-N 489.353 0.779 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2Cc3[nH]nc(C(F)(F)F)c3C2)C1 1845858707 KVRYUIAHXYJQPR-LBPRGKRZSA-N 456.469 0.720 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)N1C(=O)OC(C)(C)C 1847216774 NZTZCFWYJYNSAW-KNTRFNDTSA-N 471.363 0.970 50 20 JCGD O=C1CNC(=O)N1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](Br)Cc1ccccc1 1848033928 HTJFXDNBVRPQTE-PMPSAXMXSA-N 463.332 0.746 50 20 JCGD COc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c([N+](=O)[O-])cc1OC 9487234 UPFGHWCEGYZUPB-KRWDZBQOSA-N 461.383 0.756 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1 14841865 BJPUHKHAEFVAMA-UHFFFAOYSA-N 461.475 0.878 50 20 JCGD COCCCNC(=S)N(C)NC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 726075966 QWALOMXFRGQSNH-UHFFFAOYSA-N 485.632 0.174 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl 728383428 QYOIHURZNCVVPF-MRVPVSSYSA-N 470.356 0.630 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1 729274972 IHVQPCNJVLIUKS-MCIONIFRSA-N 490.604 0.061 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)CNc2ccccc2)o1 729514248 UIGJVWYIIWKFIP-HNNXBMFYSA-N 464.500 0.869 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 873822211 YTCCQGXPGQGDPZ-YESZJQIVSA-N 496.611 0.605 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccncc3)CC2)o1 915059483 TZCFFYIYJPLTSY-UHFFFAOYSA-N 450.473 0.713 50 20 JCGD Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 916108744 XLYRWAONVUCJMD-SFHVURJKSA-N 475.506 0.616 50 20 JCGD CC(=NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(S(=O)(=O)NCC(=O)O)cc1 916306307 RKNOANMHWWOVCU-UHFFFAOYSA-N 482.540 0.454 50 20 JCGD COCC(=O)N1CCN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CC1 920852713 YFHAHNUZWPPQTB-AQTBWJFISA-N 480.525 0.658 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CCCC4=O)CCO2)C1 1779032018 KAGRBIGJMLIKEK-RUZDIDTESA-N 477.521 0.961 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032631 PLZXXPOODACRIS-JOCHJYFZSA-N 476.534 0.042 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCCO1)CCO2)NC(=O)NCc1ccccc1 1780968943 KQMRMXXHLZSAAC-RDPSFJRHSA-N 473.574 0.732 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1781236992 IKEUZCAECLHMAQ-XMMPIXPASA-N 465.315 0.065 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2)C1 1781340976 AEARHPHUBGIQEQ-NJSLBKSFSA-N 478.384 0.875 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(O)C(F)(F)F)C2 1782208935 CESCDTNEUDEHSQ-FSPWUOQZSA-N 452.474 0.187 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn(C)c1Cl)C2 1782212022 CASWSEVIMKYZFF-FOIQADDNSA-N 454.959 0.574 50 20 JCGD CN(C)[C@@H](C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1Cl 1782830101 BGVMVTAFEIOPCF-ZJSXRUAMSA-N 485.777 0.766 50 20 JCGD CC#C[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccc(O)cc1 1784018530 SCCCLSWYJIKDKH-IBVKSMDESA-N 476.338 0.713 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)CC1 1784095388 DSDPDLUYUMRDKT-FJIDUMEYSA-N 489.013 0.119 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786984635 XIPXYDRSVCKTJS-APTRMMRNSA-N 496.369 0.610 50 20 JCGD 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NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ccsc3)[C@H]2C1 1787019795 LATRBHKXYFDCGM-SNRMKQJTSA-N 457.556 0.973 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCC4)[C@H]2C1 1788414461 PWRSXMTXNMGSOX-AYOAJRLASA-N 467.530 0.557 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCCO4)C[C@@H]21 1788611262 QPDMKUXMSNYOFC-XJABCFGWSA-N 479.537 0.917 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)[C@H]2C1 1789768345 DAZAFBGIPFCBEN-UIRXRCQNSA-N 498.584 0.501 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COCCO)[C@H]2C1 1789914432 XAQWTLSIOUMSSF-VGWMRTNUSA-N 463.959 0.107 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc([N+](=O)[O-])cc1F 1790027615 RCFPKTKIOWWMAH-DCPHZVHLSA-N 471.250 0.321 50 20 JCGD CN[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1)C(=O)O 1790694215 GIZIFCIPAGUBQM-ANUKBMERSA-N 476.480 0.914 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4[C@@H]3O)C[C@@H]21 1791287894 AZNKGEZIEDJAHT-ZKEZPVKKSA-N 472.586 0.635 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)c1 1791294097 HJDIXTNBZRWSFU-BPNCWPANSA-N 450.344 0.882 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O 1792777380 IORJLCWBPZFRII-UKSCXKOUSA-N 496.402 0.786 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2 1792867145 YNLNUGJCRRZNER-RDRYKLJOSA-N 496.402 0.786 50 20 JCGD CC(C)(C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ncc(Br)cn1 1793124206 CTFQGBXQKDXYFP-ZMJPVWNMSA-N 475.771 0.706 50 20 JCGD Cc1csc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1794085028 RXPWOKGXCHINBA-YVWYUNDQSA-N 457.556 0.891 50 20 JCGD Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)cccc1=O 1794583936 DMUCOIFHCMGRMD-KRXQYRFLSA-N 482.965 0.721 50 20 JCGD CSc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1O 1795740355 WXOLHDWHRSCXRY-CCWDJLKJSA-N 456.329 0.311 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ncccc13)C2)c1cccc(B(O)O)c1 1795741211 PRCXREUTPIRKGF-OPMZPASUSA-N 462.315 0.079 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C[C@@H](F)C1 1797208706 OBPBVTUYLYXCIK-PFHJDOJBSA-N 477.961 0.771 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1=NNC(=O)C1 1797683492 FDMCVHUGPDSQBF-ODLYAQKHSA-N 486.326 0.822 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nnc(-c3ccccc3)o1)C2 1797751558 GEEZFLQHLUAGQE-JLVBRIDZSA-N 477.481 0.252 50 20 JCGD Cc1ocnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097497 MXMSOVNPMZWIDF-RMFSNUHRSA-N 470.530 0.532 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2c(c1)NC(=O)CS2 1800039466 WYUFMPYIBKLURA-ZWUHOBOKSA-N 454.936 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](CC1CC1)NC(=O)OC(C)(C)C 1800901593 BFLWSEYAAXPSBG-BMQTXXJKSA-N 495.621 0.642 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1[C@H]3CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C3)C2 1801422000 KDNOQPUHTLGQFW-GAGVYUBLSA-N 452.939 0.860 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807359527 ALTAXVXRIATCBE-KHZGNEAMSA-N 457.361 0.240 50 20 JCGD Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1 1807531549 ANENPJXCWZUMJV-DYESRHJHSA-N 465.344 0.484 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CNC(=O)[C@@H]2C[C@H](O)CN2)[C@@H]1c1cccnc1 1807704834 KYCSEZRKOHQRSF-UZSDIVCKSA-N 497.508 0.958 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1 1810054782 IPRVGDMUCDHZRR-IIBYNOLFSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)cn2)[C@@H]1c1cccnc1 1810299494 RCDJTUHZJLDLEJ-MGPUTAFESA-N 461.482 0.814 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810300018 WCEVQNRLNMOTSR-PLMTUMEDSA-N 476.541 0.933 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2c3c(nn2C)CCC3)[C@H]1c1cccnc1 1813073582 JYBMQRXSXXMCTB-JTSKRJEESA-N 467.574 0.996 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347631 HTRLNNXCTDMLPU-KDOFPFPSSA-N 492.366 0.867 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(=O)n1O)CC2 1817276685 AKTQHYYRSMKPIX-BUGPSZFBSA-N 483.510 0.902 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cn3cccnc3n2)[nH]n1)c1ccc(B(O)O)cc1 1817471894 VEGGTCUKOVDILT-GOSISDBHSA-N 459.275 0.752 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCc2ccc(O)nn2)[nH]n1)c1cccc(B(O)O)c1 1817477212 PLJQCSYQRISBJI-SFHVURJKSA-N 464.291 0.524 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1[nH]nc2ccncc12 1817908390 LJBABEAIDGVMJQ-SFHVURJKSA-N 459.275 0.981 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCCS2(=O)=O)n[nH]1 1821835678 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Cc1nccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)n1 1832549013 ASDWGLUKLLQEHZ-JTSKRJEESA-N 497.980 0.987 50 20 JCGD CN1CCC(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1833132250 UEWXUFCSCJOPPC-UHFFFAOYSA-N 470.423 0.284 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3C(N)=O)CCO2)C1 1833314878 COTNXMOTPIXSJN-KPZWWZAWSA-N 455.309 0.034 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834821279 FAUFBQKXVLGJCV-IFXJQAMLSA-N 494.383 0.113 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)CS(=O)(=O)N3CCCC3)CC2)CC1 1835116790 ZWCMVCSEMANUEG-UHFFFAOYSA-N 488.727 0.835 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](COC)NC(C)=O)CC2)CC1 1835844765 BNAQAOZHZLCPBX-ZWKOTPCHSA-N 475.428 0.883 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc(Cl)cn1 1835902771 PCTFLZCOLTYNBI-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)CC(N)=O)CC2)CC1 1836907260 GPDVJEHRQJOTIY-SXJXFNOXSA-N 474.562 0.631 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)c2c1 1836920968 HGEPTBVVBXXSMV-WIYYLYMNSA-N 451.907 0.846 50 20 JCGD CCOc1cnc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cn1 1837275950 YCPFORYWUMHXQL-UHFFFAOYSA-N 476.578 0.861 50 20 JCGD COc1nccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1F 1837919288 CDJJKSDSUKSOEV-UHFFFAOYSA-N 485.321 0.835 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)sc1C 1838411776 OQSXDGPFGFLXGS-HXUWFJFHSA-N 453.565 0.203 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c[nH]c4ccc(OC)nc34)CCO2)C1 1838488898 ALOVWPJAVZRIID-QVKFZJNVSA-N 466.922 0.895 50 20 JCGD Cc1[nH]ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054420 XZJIBUNHBDDFJX-RUZDIDTESA-N 498.584 0.739 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)C(=O)CC4)CCO2)C1 1839529045 VNGSDWRAUBTTKI-RUZDIDTESA-N 493.520 0.198 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)nn3)C2)C1 1839965941 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COCCn1ccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810301657 BIFWSTNLUZMYGG-UTKZUKDTSA-N 492.540 0.556 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1 1810305938 QTEKQTVKYFXOHK-OXJNMPFZSA-N 463.502 0.082 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1cccn1 1810306805 ARTHXMBPCOUWRM-MDYRTPRTSA-N 462.514 0.857 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)C#CC(=O)O)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1812877602 MHHSPHHQRHQEJP-GBXCKJPGSA-N 492.536 0.522 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)n[nH]1 1814799734 VLFMUFLWBOIPQZ-HOTGVXAUSA-N 495.581 0.660 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CCc3nc[nH]c3C1)CC2)c1cccc(B(O)O)c1 1815361752 QITFTQUAWPEMLL-ZFWWWQNUSA-N 465.344 0.577 50 20 JCGD Cc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c(=O)[nH]c1C 1817473117 GUBOCUZJTDJMDB-QGZVFWFLSA-N 464.291 0.409 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 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0.898 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@]3(F)CCCCC3(F)F)C2)C1 1835930344 GXESOPJVRWDDKW-RTWAWAEBSA-N 484.280 0.354 50 20 JCGD N#Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(C(F)(F)F)n1 1836320458 DKFBUQOMWGHBQT-KBXCAEBGSA-N 476.839 0.642 50 20 JCGD Cc1cnc2c(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](C)Br)C4)C3)cnn2c1 1836949902 HNVRNHOLOIDXCX-AUUYWEPGSA-N 466.336 0.891 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)n(C)n3)CC2)CC1 1837270030 ZBBODPDNBQZKQP-MFKUBSTISA-N 485.545 0.872 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3)C2)C1 1837457723 NKQBQLQCXYQONM-QHCPKHFHSA-N 471.489 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C4CC4)cc3)C2)C1 1837460256 YNIAVRWLQWDPPW-RUZDIDTESA-N 479.537 0.946 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(C)c1 1837460270 YZONEBPQLXWIMA-VWLOTQADSA-N 497.552 0.694 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)n3cncn3)CC2)CC1 1838102842 DRTSAOVPADWGSJ-AKBIMGJMSA-N 484.561 0.972 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CNC(=O)c3cc(C)on3)CC2)CC1 1838408955 ZQEBWPQEEHZNKU-QGZVFWFLSA-N 470.954 0.965 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)CCO2)C1 1838484064 XMODVNWZKCIQSP-UZUQRXQVSA-N 489.960 0.894 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)F)C2)C1 1838528395 UXSZBMYMIUJHRW-LJQANCHMSA-N 457.386 0.855 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cc[nH]c4cc3F)CCO2)C1 1838573851 GIMDLTJEPGZIQW-XMMPIXPASA-N 496.499 0.689 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CN3CCCCC3=O)CC2)CC1 1838781084 FHTIPPCUMVFKAW-UHFFFAOYSA-N 465.595 0.371 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839156199 GQOBCXAUGIJDCF-IPELMVKDSA-N 452.379 0.984 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)ccc1F 1839319809 IHDJYXBIJGSLCC-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1 1839390023 FZLKNUWOIPNVKR-CKMMYEAESA-N 484.347 0.996 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839620496 GWJMAMKBKUYLMP-IIBYNOLFSA-N 498.422 0.820 50 20 JCGD CCOC(=O)C1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)CC1 1839759229 HSVKBOKBKNENEL-RDTXWAMCSA-N 461.353 0.817 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(S(C)(=O)=O)c3)C2)C1 1840030774 WINRIKDIZMFFEV-IFXJQAMLSA-N 489.388 0.944 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4c(c3)CCO4)C2)C1 1840156274 PNYJBPWFSLTESZ-GCJKJVERSA-N 452.935 0.874 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013177 QDKOOWDLKDPFDI-UHFFFAOYSA-N 475.351 0.115 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cc2ccc(Br)nc2)C1 1844989783 IHUKYJAINLHDQN-UHFFFAOYSA-N 473.331 0.902 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2ccccc2C(N)=O)C1)NC(=O)NCc1ccccc1 1845401345 NNQRKYFNDKRLHE-UHFFFAOYSA-N 478.553 0.949 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847565414 PMHXOLPDSWIURT-CBBWQLFWSA-N 461.943 0.634 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)N1CCN(C)CC1 1848099447 LFHTWVWUZAYFIE-OWSLCNJRSA-N 472.030 0.956 50 20 JCGD CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1nn(-c2ccccc2)cc1O 10588896 CETVMOAHNJYMKP-UHFFFAOYSA-N 458.500 0.972 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)C3=NN(C)C(=O)CC3)c2)cc1 17396764 SUHBQLANVDHYFA-UHFFFAOYSA-N 459.484 0.865 50 20 JCGD O=C(Cn1nnc2ccccc2c1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 28196535 QYWYGSXFKPDUBG-UHFFFAOYSA-N 456.484 0.037 50 20 JCGD NC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)nc1 745491885 SEEWTSYGXDFZDL-UHFFFAOYSA-N 453.480 0.734 50 20 JCGD Cc1cc(C)c(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c(C)c1NS(C)(=O)=O 751282811 QDEFISFIKVKSRJ-UHFFFAOYSA-N 474.586 0.784 50 20 JCGD O=C(COC(=O)c1ccc(N2CCCS2(=O)=O)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 756833807 UAMGRDFPVKRNGG-SFHVURJKSA-N 475.479 0.371 50 20 JCGD Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)OCC(=O)NNC(=O)c1cccc(Cl)c1 760719304 PBWVOUJJQQXAGQ-UHFFFAOYSA-N 484.918 0.317 50 20 JCGD C=CCNS(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 787505933 WLDINLASHYPTJC-GOSISDBHSA-N 475.479 0.295 50 20 JCGD COC(=O)c1cccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 915807688 AXIFUUYNKOUWEH-UHFFFAOYSA-N 475.523 0.888 50 20 JCGD CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccccc1 915890971 BQYCJXHXMXNUCZ-HXUWFJFHSA-N 475.571 0.954 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cccc(Cl)c2)c2ccccc2c1=O 916295811 VKBOIXRZOQQEPU-UHFFFAOYSA-N 478.918 0.509 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)cc1 916391967 OPUWYEFUTXEVBK-UHFFFAOYSA-N 450.455 0.040 50 20 JCGD CCOC(=O)N[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)CC(C)C 916631171 LDJQYQDHSXVVOA-QGZVFWFLSA-N 499.590 0.812 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@H]1COc2ccccc2C1 916635908 IHCPDQDGWQKVOJ-LJQANCHMSA-N 488.566 0.974 50 20 JCGD CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)n[nH]c1C 917721734 GAWJLJQIPAKOKD-UHFFFAOYSA-N 462.488 0.809 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O)c1ccc2c(c1)OCO2 918550014 NRPONOQPQQMUCR-CQSZACIVSA-N 473.463 0.814 50 20 JCGD CCN(CC(=O)N[C@@H]1CCS(=O)(=O)C1)C(=O)CCC(=O)C(C#N)=C1N(C)c2ccccc2N1C 919703354 XQFOGQVJSIOOHS-MRXNPFEDSA-N 487.582 0.809 50 20 JCGD O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)c1ccc2c(c1)OCCO2 920341071 YANWFNRZHMFNTC-UHFFFAOYSA-N 450.429 0.496 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)C[C@@H](C)n1ccnc1)N(S(C)(=O)=O)CC2 920596049 DKKZDLTXYROOGM-RHSMWYFYSA-N 479.559 0.948 50 20 JCGD O=C(NNC(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1)N[C@H]1CCS(=O)(=O)C1 1318049159 NMNPDCFKDSDOFA-INIZCTEOSA-N 451.526 0.792 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1778253422 PFSDVZAGFJSZNV-XMMPIXPASA-N 465.315 0.011 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4cc(O)ccc4n3)CCO2)C1 1779029922 BNDBZDNHPJADQY-DEOSSOPVSA-N 476.493 0.696 50 20 JCGD CCC[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)n1cccc1 1779030444 QOZZYPPKOOHRLY-WMZHIEFXSA-N 454.531 0.972 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C1)CC2 1779034989 YUEJHRQJHOTCBZ-DWXRJYCRSA-N 493.564 0.942 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1nc2ccccc2o1 1781232858 OQLNAGDTSCHQIB-HYBUGGRVSA-N 463.299 0.949 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782214337 KRSDPLUDJKLLFB-UZUQRXQVSA-N 471.562 0.538 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783933684 VPGYKEREXNFGIV-HXOBKFHXSA-N 481.594 0.659 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785458169 KEZZWMJYUZYOQG-HYBUGGRVSA-N 491.564 0.076 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Br)CC)C[C@@H]21 1788475521 MABJDFPOMCOABF-MJDBTJCESA-N 450.330 0.204 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)[S@@](=O)c1ccccc1 1790599961 HTPUAYLUMCWJQH-PLONXWACSA-N 478.615 0.535 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)C[C@@H]21 1791253379 AYWMYFNKHGTUHX-FRMKIJSPSA-N 489.997 0.448 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2 1792868989 XOTDPLQPGFXLSM-QMHWVQJVSA-N 492.411 0.883 50 20 JCGD COCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr 1792872006 INZKUYDMZVFWCU-CUSZFKRNSA-N 465.385 0.677 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1COc2ccccc2O1 1793269499 VDLUMXWAXPRBGA-IPPNXFFKSA-N 460.531 0.179 50 20 JCGD CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1csc3c1c(=O)n(C)c(=O)n3C)C2 1793449325 YRHGAWZNWWYWAD-KRXQYRFLSA-N 497.017 0.838 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795112524 KXKCCEZOPVRQRH-FQLMCAECSA-N 478.384 0.901 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccc3)CC1)C2)c1cccc(B(O)O)c1 1795737643 FPIMZXJDVZHNAC-RUMRUAAYSA-N 477.370 0.486 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)n(-c2cccc(=O)n2C)n1 1796363583 SVJWSGZUBONPFV-GGNLRSJOSA-N 451.886 0.617 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)c2C1 1796366012 DMFNVJAZOPZBAW-LMWOUKEDSA-N 486.932 0.766 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(C(=O)O)ncn1)C2 1796890032 VPFCSOURGBIGGD-SIENDBQGSA-N 453.459 0.561 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccccc12 1797413221 PDWVICPOJCPLNW-DHMDNZFNSA-N 463.498 0.900 50 20 JCGD CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799098008 YXSCLUBAQPEBJM-AJYBTWMASA-N 465.982 0.940 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccccc1C(=O)OCCO)c1ccc(B(O)O)cc1 1799271512 BHRKIMGYCJTXBA-REPLKXPHSA-N 466.299 0.081 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(O)cc1F 1799563970 OTQBLPACWKBWLU-NXTZLTDHSA-N 457.462 0.869 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@@H](C)Br)C2 1800762565 VIXLBCYABLYDSV-LBKYZSNHSA-N 497.390 0.995 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1800919508 WICQUCPUFYKPBX-NYUBLWNDSA-N 497.637 0.746 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C 1802152355 YFUMNKWZGTTYAG-DGMCESFYSA-N 491.383 0.128 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1803791233 LQNDOQKLARFRNG-SIKLNZKXSA-N 461.331 0.745 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1807352509 GIBWNBJRWQJWRX-LESCRADOSA-N 477.974 0.592 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)n1cccc1C=O 1807388010 NMINCLJCHRMWNA-LLBVYWAGSA-N 474.326 0.956 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1808250178 IOGYWNJKDSRXHK-AOIWGVFYSA-N 456.996 0.835 50 20 JCGD Cc1cc2nnc(C(=O)NC[C@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)c(C)n2n1 1809188362 WNIPPJHWJFPWNA-AUSIDOKSSA-N 499.340 0.449 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1 1810293859 DXOYONVQSPTLFZ-AVRDEDQJSA-N 476.298 0.946 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(C)(C)C 1810294675 MCHGXSDROSIBDK-DZFGPLHGSA-N 495.584 0.951 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810300016 WCEVQNRLNMOTSR-HGHGUNKESA-N 476.541 0.933 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1810360633 UBNBVYLPOVHNNL-NHAYFPRASA-N 469.380 0.912 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1 1812864207 NWPYGKRZWUIRHA-NORZTCDRSA-N 474.319 0.916 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CCC(CO)CC1)CC2)c1cccc(B(O)O)c1 1815350302 OXKOBCHFDBNGSK-MQBCKMQZSA-N 457.361 0.847 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)sc2C1 1816980423 CZDRWKHQOXALGV-OCCSQVGLSA-N 498.606 0.314 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CC2 1819800510 PNZJVRUHBPOERA-IQDSPRDJSA-N 456.528 0.935 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nn[nH]c1C(F)(F)F 1820326407 UHWWXDUBXUXCNA-CYBMUJFWSA-N 477.212 0.846 50 20 JCGD NC(=O)c1ccccc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1821159436 KFPJPOGIEMTPFD-IBGZPJMESA-N 461.287 0.808 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1821684467 HXEGKGUXCAXDQZ-CXAGYDPISA-N 458.280 0.957 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1)N1CCN(C)CC1 1822415600 LVMVHJJJHIGWGO-SJLPKXTDSA-N 462.599 0.411 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824522910 LLOZYZPVSRDYGJ-DNVCBOLYSA-N 479.603 0.599 50 20 JCGD 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C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1837711812 RFBCBNGTPXEEGW-QFBILLFUSA-N 456.641 0.321 50 20 JCGD Cc1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920327 MRGVVKVRFVWPOT-UHFFFAOYSA-N 451.332 0.996 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)C(C)(C)C)C2)C1 1838526743 BFIZYOVBKIAGLT-XXBNENTESA-N 493.513 0.997 50 20 JCGD CN1CCN(C2(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(C)(C)CCl)C4)C3)CC2)CC1 1839106301 YAXTZRSDNQNCJW-OAQYLSRUSA-N 457.015 0.488 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(O)C(F)(F)F)C2)C1 1839150629 RTHCYYXTXLPZTO-RRFJBIMHSA-N 451.269 0.992 50 20 JCGD O=C(c1ccc2ncnn2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200000 BWXIGAKMBFZKDR-WMLDXEAASA-N 456.272 0.490 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1839210462 PZSDOIKFGOVYKY-QYWGDWMGSA-N 477.986 0.736 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CCO2 1839384987 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CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)[C@H]2C1 1846160769 LHWNDIYCUAKOJV-LVQVYYBASA-N 457.955 0.671 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC1 1848100000 JAQWGOXBPKTVCJ-BZSNNMDCSA-N 486.013 0.484 50 20 JCGD O=C(CNC(=O)c1ccc(F)cc1F)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 11331378 BKNDPLNIQQDCBY-UHFFFAOYSA-N 466.466 0.940 50 20 JCGD COCCCNC(=S)N(C)NC(=O)c1ccc(OC)c(S(=O)(=O)N2CCOCC2)c1 726076126 NGCQHRVUPCKLNE-UHFFFAOYSA-N 460.578 0.204 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)[C@@H]1COc2ccccc2O1 726764560 IELLVHJUVMYASR-KRWDZBQOSA-N 453.498 0.376 50 20 JCGD C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)NNC(=S)Nc1cccc(S(=O)(=O)N(C)C)c1 747725082 FJWUAOFYOYLXBO-RRFJBIMHSA-N 457.622 1.000 50 20 JCGD CCN1CCN(CC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C(=O)C1=O 747778346 FTWFZYFGRGKJTP-OAQYLSRUSA-N 463.538 0.452 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCCn1ccnc1C)N(S(C)(=O)=O)CC2 749215737 REVAVUSMUDPBPL-KRWDZBQOSA-N 494.574 0.488 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)NC1CCCCCC1)N[C@@H]1CCS(=O)(=O)C1 751363497 XIJZCEWQIUGAKX-CYBMUJFWSA-N 478.618 0.880 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1cc(S(=O)(=O)NC2CC2)ccc1Br 751618719 URWJFGWODUYEFI-UHFFFAOYSA-N 459.322 0.273 50 20 JCGD CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)C(=O)Nc2ccc(C)cc2)cc1OCC 798149413 FKRPCIWROBZEHM-UHFFFAOYSA-N 478.527 0.857 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1 831961090 TVNIUMRTKHHJHR-RXQFDZFGSA-N 475.479 0.107 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(F)c(S(=O)(=O)NC2CC2)c1 914880383 KHYZWQZJGUXOPF-UHFFFAOYSA-N 469.520 0.634 50 20 JCGD C[C@@H](CO)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 915485636 UMNGOLFMPGMELF-LBPRGKRZSA-N 469.903 0.617 50 20 JCGD CCN1CCC(NC(=O)NNC(=O)C[C@@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)CC1 915903470 SNZJRJHIICCROV-GOSISDBHSA-N 497.618 0.767 50 20 JCGD COCCNC(=S)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 916125687 SZCADPKTZCWMQM-AWEZNQCLSA-N 460.578 0.094 50 20 JCGD CNS(=O)(=O)c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)NC(C)C)cn2)s1 916233115 PUOJFIPAJMBZTL-UHFFFAOYSA-N 462.579 0.564 50 20 JCGD Cc1ccc(CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1 916515832 NHGHSIJBXGAGHC-UHFFFAOYSA-N 461.544 0.874 50 20 JCGD O=C(NCCCn1nc2n(c1=O)CCCC2)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 916649580 HMBUGPWGMMJXDO-UHFFFAOYSA-N 491.574 0.200 50 20 JCGD O=C(COC(=O)CNC(=O)c1ccc(Br)s1)NNC(=O)[C@@H]1COc2ccccc2O1 917317314 DAEBGKSFHFUDGT-LBPRGKRZSA-N 498.311 0.771 50 20 JCGD CO[C@@H](C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O 917706998 GPORQCDJMYLNMU-KRWDZBQOSA-N 490.520 0.639 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(C)c(C(=O)O)s2)cc1 917720628 KFXZMSXBNAPQQT-UHFFFAOYSA-N 461.543 0.693 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1O 917722159 RTDRLRFXXNZSJF-UHFFFAOYSA-N 483.524 0.587 50 20 JCGD COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)s1 917724845 BAKYSFYBSJZWIT-UHFFFAOYSA-N 453.907 0.459 50 20 JCGD COc1cccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1O 919958422 JYUFUSJDPUAYPM-UHFFFAOYSA-N 455.514 0.809 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)N[C@H](CC(=O)N(C)C)c3ccccc3)nc2)CC1 920046147 HYKBIWMMBTXOHQ-LJQANCHMSA-N 489.602 0.863 50 20 JCGD Cc1cc(/C=C(/C#N)C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c(C)n1C[C@@H]1CCCO1 921165420 IEBJNJNJPCEWGV-URBQWANRSA-N 463.604 0.884 50 20 JCGD Cn1c(=O)cc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c2ccccc21 1317875160 LNFRVPJQWQTMDW-UHFFFAOYSA-N 498.561 0.953 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCOC1=O)C2 1778091646 LBOVMQPTFQWNRI-JBQOLUAXSA-N 474.518 0.087 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ccccc3n2)C1 1778477430 WVJWVJDGFYXUIB-NTKDMRAZSA-N 477.525 0.774 50 20 JCGD CNC(=S)NCCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780774541 CTTSOQSCLRIBKY-AXAPSJFSSA-N 453.378 0.675 50 20 JCGD C[C@H](NC=O)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1781252404 NXFGTBPTIQWGIB-RIFZZMRRSA-N 452.349 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0.972 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839198274 BUVSPUSWHBOIOZ-UKRRQHHQSA-N 457.318 0.040 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(F)c1 1839292366 AGTFZMGGKQNKLJ-HSZRJFAPSA-N 487.488 0.217 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839880999 IOAHDMSXGMPITQ-WMWQNKLISA-N 476.480 0.853 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4cccnc34)C2)C1 1839965247 RVNUMTAVWZEESI-HNAYVOBHSA-N 466.336 0.973 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)c[nH]1)CCO2 1840066009 CFKPZUKLFHKQES-NFCNUSAFSA-N 460.466 0.358 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C#Cc3ccc(Cl)cc3)C2)C1 1840182858 WPXLOYDKZKMQNU-QHCPKHFHSA-N 476.961 0.521 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c2ccccc21 1840188438 JKCZUMBRCJYYMP-HXUWFJFHSA-N 471.341 0.600 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)CCO2 1840313221 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481.458 0.209 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(-n2nccn2)c1 1838629110 FTIGKOPESSRAGU-GHTZIAJQSA-N 463.922 0.245 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1 1838767893 XACPXSSGMZFOGB-OTYXRUKQSA-N 470.246 0.677 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)nn1 1838831083 ZRARYFCWKATKGL-FQEVSTJZSA-N 452.584 0.797 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1 1839390026 FZLKNUWOIPNVKR-ZZVZOJOMSA-N 484.347 0.996 50 20 JCGD O=C1CSc2ncc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Cl)C4)C3)cc2N1 1839578147 SNFLUPMXUPNLLM-KSSFIOAISA-N 458.899 0.730 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)C2)C1 1840153143 FWENKEJMBUYMMY-ORYQWCPZSA-N 467.906 0.431 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C2)C1 1840154146 MTYBFIJIAWHXIM-VBKZILBWSA-N 485.877 0.647 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)NC(=O)c3ccc(F)cc3)C2)C1 1840154313 RYULPGAOAMDPFA-FXCLAUTBSA-N 485.940 0.654 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ncc(Cl)cc3Cl)C2)C1 1840183315 XUIFNHJPZSJPCS-HXUWFJFHSA-N 488.372 0.831 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnnc4ccccc34)C2)C1 1840184512 RLOXJGVCJRBDFO-QHCPKHFHSA-N 470.530 0.073 50 20 JCGD CCOc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1O 1840185389 PTENTLLAVFDBSZ-HSZRJFAPSA-N 478.546 0.234 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)N(C)C(=O)OC(C)(C)C 1840185563 UETVHRKRZDZRPH-HXOBKFHXSA-N 499.609 0.071 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc(OC)c1C 1840187287 QPHGFGIZAATQBJ-DEOSSOPVSA-N 492.573 0.455 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)CC1 1840806243 NXPSRQBAIIFEDJ-UWJYYQICSA-N 492.976 0.530 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1 1841369674 MMTCPPDKSVGQEC-KRWDZBQOSA-N 479.603 0.238 50 20 JCGD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010358 HXZHKTGIGKJOFY-UHFFFAOYSA-N 462.271 0.747 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2ccc(Br)nc2)C1 1844989296 DAXZAFJETNQZGR-UHFFFAOYSA-N 458.121 0.584 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)[C@H]2C1 1846141885 WTETXBSDGDBCQS-HSALFYBXSA-N 499.373 0.065 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1)C2 1846385081 RJGUSUKROVBNHG-JOCHJYFZSA-N 469.558 0.912 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@]1(C)CN(C(=O)OC(C)(C)C)CC[C@H]1O 1847239479 VUROIAONBLOOML-KKFFFLSNSA-N 495.621 0.569 50 20 JCGD C[S@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847442440 GLOVLTGWVXEQSZ-NOYCXXBOSA-N 466.000 0.450 50 20 JCGD Cc1cc([N+](=O)[O-])cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1C 15243462 LIERJAQNNMONEY-UHFFFAOYSA-N 498.539 0.856 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1 15639531 BLYWGUUWPKCVRT-LZWOXQAQSA-N 487.600 0.558 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c1 16594272 LOCCNDPCPNCDKO-UHFFFAOYSA-N 490.510 0.345 50 20 JCGD CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)CC2)cc1 16785893 CCALRZPISPAPQW-KRWDZBQOSA-N 471.601 0.793 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1)c1ccccc1 104786337 JROWERBWSVKTMY-UHFFFAOYSA-N 474.539 0.619 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccc(S(=O)(=O)N2CCCCC2)cc1 725871029 FGCJCCZMASFGRG-UHFFFAOYSA-N 463.516 0.715 50 20 JCGD CN1CC(=O)N(CCCC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)C1=O 725908014 ZRUJWHBEKISKQX-UHFFFAOYSA-N 487.538 0.600 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(S(=O)(=O)N(C)C)c1 727609529 LCXIBBUVQYFCEH-CYBMUJFWSA-N 472.527 0.889 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=S)NC1CCOCC1 727780564 SHDWZTVDRBTQIQ-UHFFFAOYSA-N 456.590 0.314 50 20 JCGD C#CCNS(=O)(=O)c1cccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)c1 728214545 RJPXTUKQOJJTFM-UHFFFAOYSA-N 491.595 0.291 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(\C#N)C(=O)N2CCCN(C(N)=O)CC2)cc1 729361216 DILKGBZRGWOXHE-GHRIWEEISA-N 465.514 0.954 50 20 JCGD Cc1cccc(N2C(=O)N[C@@H](CCC(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2=O)c1 730768486 GZWPGLVYNCXRFF-HNNXBMFYSA-N 472.527 0.954 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H](C)N1[C@@H](C)CC[C@@H]1C)c(=O)n2Cc1ccccc1 750602667 INXSGDOBGWPEHQ-BZSNNMDCSA-N 495.584 0.837 50 20 JCGD CNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 811882487 IGRDIHDYGWTZPX-UHFFFAOYSA-N 460.921 0.279 50 20 JCGD COc1cc(Cl)ccc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCNC(=O)C2)cc1 914463207 SAWQYRADLXKPGJ-UHFFFAOYSA-N 466.903 0.544 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)NS(=O)(=O)c2cccs2)cc1OC 915023713 VWDBBXHUYMYSDR-LLVKDONJSA-N 471.513 0.437 50 20 JCGD O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cccc([N+](=O)[O-])c1 915921963 ROHAWVIFFZEFEF-UHFFFAOYSA-N 463.472 0.760 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1c(C)nc2c(C(N)=O)cnn2c1C 916734427 GGLYKLOZUVGVMN-UHFFFAOYSA-N 486.558 0.440 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)CC)C2)c1 918549215 HCRQOVJHYIKRJI-INIZCTEOSA-N 474.605 0.540 50 20 JCGD O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O 918552037 JVMHFPBFBFDXNM-KSSFIOAISA-N 487.490 0.611 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2cc(S(C)(=O)=O)ccc2F)c2ccccc2c1=O 921294901 DFBIVZHKFMIGJV-UHFFFAOYSA-N 482.515 0.972 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1778324672 OSZIMJIIDADGOD-JSNMRZPZSA-N 463.934 0.765 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1 1779032833 XLRCGSGWQVBCOT-QHCPKHFHSA-N 476.497 0.228 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034201 OTSGXFLNZZPWJL-WAIKUNEKSA-N 452.515 0.402 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4cccn4)cc3)CCO2)C1 1779037371 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CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1 1785513027 IQIMXRPMZSDHMH-KDLAUNOPSA-N 487.362 0.113 50 20 JCGD N#Cc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(Cl)c1 1786981759 KCQGGOLUDSWYGF-LRQRDZAKSA-N 467.718 0.799 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21 1788610815 VQAFYETYVLLFDQ-MVJPYGJCSA-N 453.499 0.012 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790577037 WDEUPMYLDGQCFL-PWZKMPOXSA-N 451.332 0.234 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(C)c(O)nc3=O)C[C@@H]21 1790963719 KUOLLCVNNBAQEB-AJNGGQMLSA-N 471.352 0.411 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(c3)CCNCC4)C[C@@H]21 1791257497 KGVRWRARGUVYAP-BOLBYERCSA-N 450.967 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(Cl)cncc1Cl 1792409866 OUYSDZUOHLAXRP-YQYWCBKUSA-N 479.324 0.904 50 20 JCGD 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)N(C)C(C)=O)C2 1798522372 RLISHBJBQMKGEK-ZIKOISBGSA-N 476.486 0.590 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]cc1[N+](=O)[O-])NC(=O)NCc1ccccc1 1798687469 YLERXZDLJLIOIR-BJWYYQGGSA-N 484.517 0.916 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1799758827 CMZFNHQMEUSECB-VTEUUUEMSA-N 465.482 0.619 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@](C)(O)CN1C(=O)OC(C)(C)C 1800824571 QASFFZQZWREDLH-KWCBCURJSA-N 489.997 0.590 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2 1800973893 ILECDFDMWCIBLA-QOIYZWAUSA-N 463.918 0.516 50 20 JCGD CC#C[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(O)cc1 1801054163 KRJQAHDARLOMMT-HULNYRCFSA-N 476.338 0.472 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)C(F)(F)F 1802375175 KXSUGKLIISUUFG-OHTJZTCPSA-N 456.425 0.437 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363836 PUHUMDUSFYPNJS-AVRDEDQJSA-N 488.309 0.561 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1807369717 SMYXOZPJXLKBIG-YLJYHZDGSA-N 465.294 0.576 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374689 HFVGCNPFNWFULX-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD Cc1nnsc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807376012 RAUCXUMVOFYLQB-AEFFLSMTSA-N 451.317 0.555 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC2(CCCN(C(=O)c3cnc(OCF)cn3)C2)CC1 1807644709 AUCYJXIGMHYKRF-UHFFFAOYSA-N 456.283 0.621 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C(=O)Cn2cnnn2)[C@H]1c1cccnc1 1811358478 GYJUMNCLNFELBA-IERDGZPVSA-N 494.468 0.921 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1812348754 PINYIKHGASLSFG-WCAVRKLYSA-N 495.584 0.674 50 20 JCGD CCCNC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815108958 HXXFXVXEXDXSPM-GOSISDBHSA-N 455.324 0.702 50 20 JCGD CC(C)n1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815340044 CEYAVMAZGFWMEF-CQSZACIVSA-N 454.321 0.535 50 20 JCGD COCCn1nccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354581 JXBMIPDHKLKYQY-HNNXBMFYSA-N 469.332 0.205 50 20 JCGD Cn1nc2c(c1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]1)CCC2 1817474507 DWSLONCRXVMEFW-IBGZPJMESA-N 462.319 0.931 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)n1ccccc1=O 1820125067 NQIRTLPYURRKJJ-CZUORRHYSA-N 466.328 0.472 50 20 JCGD COc1cc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)nn1C 1820376375 UPDQXUMENBETJX-MRXNPFEDSA-N 467.490 0.770 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1824549146 QLNBYTHVNAUSQK-XJKSGUPXSA-N 493.354 0.262 50 20 JCGD CN(C)CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828854592 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C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1833263035 GZCHLEKAZLPXTO-YWZLYKJASA-N 475.428 0.240 50 20 JCGD Cn1c(=O)c(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)nc2ccccc21 1833310349 RGGQREFRJDTVJP-LJQANCHMSA-N 475.977 0.718 50 20 JCGD CN1CCCn2nc(C(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)cc2C1 1833312197 LBLYVHSIQAUVHP-HXUWFJFHSA-N 467.014 0.504 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccn3)CC2)CC1 1834122994 RSZLRWIDAMSVIO-LQKURTRISA-N 466.546 0.796 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](N)c3ccccn3)CC2)CC1 1834723438 HCTDVHQISJKDJD-MMQHPSSSSA-N 494.600 0.787 50 20 JCGD CCc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797533 UXKMXOGAHYQYFJ-UHFFFAOYSA-N 464.375 0.823 50 20 JCGD CC(C)c1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n[nH]1 1834798290 CPSSXBCSPJSVMS-UHFFFAOYSA-N 467.379 0.712 50 20 JCGD Cc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)o1 1834800422 GTMZLCCGZXXNBD-UHFFFAOYSA-N 453.348 0.696 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)n1 1835250627 DPSJRPDORABPPJ-INIZCTEOSA-N 469.926 0.783 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835734899 WHQFKXCPPQKQBN-AWEZNQCLSA-N 495.422 0.901 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2 1837297366 SRDYJYYIHCRZGR-DQLDELGASA-N 467.906 0.431 50 20 JCGD CN1CCC[C@H](C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)C1 1837921261 REKSKHBBYUEDRM-IBGZPJMESA-N 457.380 0.320 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049611 MGQZDWJPTBLRNI-LIRRHRJNSA-N 466.336 0.512 50 20 JCGD O=C(/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)NCc1ccco1 1839200319 IPKLCPRNDUEXPQ-PABLAQFASA-N 488.310 0.599 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(C)C(=O)CC3)C2)C1 1839962674 NUAGVNPRIBCEPI-FZKQIMNGSA-N 459.341 0.225 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1839964078 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0.904 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1 921247903 NNJNCGBQKHYXGB-UHFFFAOYSA-N 465.488 0.845 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CC[C@@H]3O)C2)C1 1778087329 KTNSLIXUHUNQMC-VLMPBXDWSA-N 489.997 0.688 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(O)[nH]1)C2 1778092691 KXPQYRWPUGMMHV-BYAFEARCSA-N 457.491 0.377 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1O 1779028931 LBQWKGGUGPVVFG-QHCPKHFHSA-N 469.498 0.086 50 20 JCGD Cc1ccn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n1 1779371301 MURVGUIAPNMPTJ-XMSQKQJNSA-N 455.519 0.018 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3snnc3c1)C2 1779372407 HJORQOBWXIGEEN-VGOFRKELSA-N 496.553 0.526 50 20 JCGD CC(C)n1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)n1 1780208040 DXGPYHZNLXLXSY-AUSIDOKSSA-N 469.546 0.904 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]3CC[C@@H]1O3)CCO2)NC(=O)NCc1ccccc1 1780968251 HLELGUAVHCQOBX-HSGJQSDISA-N 485.585 0.730 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n(C)n1 1780969938 OQFGNGUTGQCZJY-DEOSSOPVSA-N 483.573 0.518 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)n1 1782214542 UXRCBDWCGSTVRX-AUSIDOKSSA-N 462.595 0.777 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1782671409 WHMKLPUSXANORK-YEWDVWPNSA-N 457.300 0.720 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)C1 1783348964 OYLWVXMEWQODKJ-NRVIRDBHSA-N 489.997 0.736 50 20 JCGD COC(=O)[C@@H]1CCC[C@@H](C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)C1 1783859603 NMIHJELLOIHPOJ-UWFSFTEZSA-N 487.557 0.930 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C[C@@H]2C[C@@H]21 1784104482 UOXSENMKLCBZTA-JMXUMUKBSA-N 471.982 0.964 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnsc3C3CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979794 HVAZGXGYERSCPM-XIRDDKMYSA-N 456.333 0.002 50 20 JCGD Cc1nc2ccccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1787848382 VMTFIVSYTIVGKZ-SNRMKQJTSA-N 477.525 0.548 50 20 JCGD Cc1nc2sccn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788439671 ILSXHLKATKOVRD-JQFCIGGWSA-N 483.554 0.610 50 20 JCGD CCCc1onc(C)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610350 NGEQCAFUQHZLQQ-FNHZYXHNSA-N 470.530 0.841 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1 1789519724 HIAHACCVJLWSCD-CQSZACIVSA-N 488.570 0.761 50 20 JCGD CC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)c1ccc(F)cc1 1789699441 LPYWFPUYVXDWOQ-QUZFRVLNSA-N 491.564 0.356 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)c(O)c(Cl)c3)[C@H]2C1 1790246007 CDXQUXWCHXHCHK-JDFRZJQESA-N 468.938 0.718 50 20 JCGD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1)N1CCN(C)CC1 1790438095 JFRRQYQZUGECAV-GOSISDBHSA-N 464.375 0.750 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791290802 NHGDEMCLBZYCCL-DZKIICNBSA-N 467.954 0.710 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1792243034 CWNWEOQYWNACNH-AFRXPDRBSA-N 479.298 0.581 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792973117 ZTHVOMJCWIRWBO-UNPPPGBBSA-N 487.981 0.059 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)(F)F)ccn1)C2)c1cccc(B(O)O)c1 1795740182 AXRWJQPDPVCGJU-ZSBFGKGUSA-N 463.221 0.297 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1csc2c1CCCO2 1796091804 LNMAVZWEVFKVES-CCWDJLKJSA-N 456.329 0.270 50 20 JCGD O=C1CSc2cc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)ccc2N1 1796189138 BIKJETJKUPXEOH-BCDXTJNWSA-N 465.340 0.976 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@H](F)Cl)=NO2)C1 1796370987 SDORULMZCGSYEW-NEBZKDRISA-N 474.917 0.876 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnn(C)c1)C2)NC(=O)NCc1ccccc1 1799095104 UGHLKVFDZQVHNT-RUMRUAAYSA-N 497.600 0.289 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799348596 LLYIWRFAWRJQKW-VGDATSSVSA-N 454.293 0.110 50 20 JCGD CC(C)C(=O)Nc1nc(O)c2ncn(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)c2n1 1800345185 JKPFIYSFYJVTIX-NDPMZMCLSA-N 497.915 0.250 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(F)c[nH]1)NC(=O)NCc1ccccc1 1800814719 UBSGPSKSAFQTFW-UPHUGPLXSA-N 472.521 0.703 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)C2 1800970989 NQRZXOHHZJGCKN-BPKGMFCQSA-N 475.970 0.466 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(-c3ccccc3)n1)C2 1801011795 FGGIAQPQAVEHJW-FAQVEIGNSA-N 454.531 0.449 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](c1ccccc1Cl)N(C)C)C2 1801013290 ZISCCVQJEQJAKE-KFVVBQDRSA-N 480.009 0.905 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc([N+](=O)[O-])o1 1802258370 DOYZSXUBAWRBSR-UZLBHIALSA-N 464.243 0.896 50 20 JCGD O=C(CN1CC(=O)NC1=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1 1804190232 JYBNHFMARJHYKF-GLQYFDAESA-N 456.272 0.330 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360598 LJBXVCVRYZIPQK-XMSQKQJNSA-N 459.315 0.538 50 20 JCGD Cc1nc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c(=O)[nH]c1C 1807362590 LFLOUKCCHASNIT-RXVVDRJESA-N 475.314 0.095 50 20 JCGD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc(O)n1 1807375870 QTPPNOVSXHKKNP-AVRDEDQJSA-N 460.299 0.804 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCn2cncn2)[C@H]1c1cccnc1 1813320016 ZWESVWXKCPYVPZ-OXQOHEQNSA-N 463.502 0.082 50 20 JCGD Cc1nc(N)sc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1815141825 LTLODACVONULAJ-LBPRGKRZSA-N 457.346 0.710 50 20 JCGD CN1CCC(CC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)CC1 1815347700 LEQAKSYHNXHERY-KRWDZBQOSA-N 456.377 0.781 50 20 JCGD O=C(CNC(=O)c1cccnc1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815784034 GHNRYBPNHBCNCA-IBGZPJMESA-N 476.302 0.220 50 20 JCGD COc1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n(C)n1 1816136222 TZSAEFVFHDJOOT-INIZCTEOSA-N 452.280 0.451 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)Cc2ccccc2)[nH]n1)c1ccc(B(O)O)cc1 1817474986 KQBQZABIYSPQBC-SFTDATJTSA-N 462.315 0.999 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2=NNC(=O)C2)n[nH]1 1819341078 GNCTUPZSJHQPAW-QHBIDGPYSA-N 453.463 0.412 50 20 JCGD Cc1cc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n[nH]1 1819403347 GFSQZYXYDAHQII-QGZVFWFLSA-N 451.491 0.988 50 20 JCGD O=C(/C=C/C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)NCc1ccco1 1819533545 ZNGZTIRVSHNXHA-CFGKVWFZSA-N 491.313 0.861 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1)N1CCN(C)CC1 1820787859 PFKGXTFRKWPRPX-BEFAXECRSA-N 483.577 0.350 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)sc2C1)c1cccc(B(O)O)c1 1822621926 GBNWTOYHDWKZFR-DJIMGWMZSA-N 482.371 0.450 50 20 JCGD CN(CC(=O)N1CCC([C@@H]2CCCCN2C(=O)Cn2cnnn2)CC1)NC(=O)NCc1ccccc1 1827196552 NQCROURPQLZQFF-NRFANRHFSA-N 497.604 0.639 50 20 JCGD CC(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828790553 RPGQSWWILRCHQD-LAUBAEHRSA-N 451.907 0.627 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1 1828926139 AFCNAXCTFKKXOZ-QGZVFWFLSA-N 469.502 0.433 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)CCO2 1830303826 LMPMBMAXBNKPNM-AVYPCKFXSA-N 463.959 0.610 50 20 JCGD CCNC(=S)NCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1831093811 PJYOVDJGALGENR-QGZVFWFLSA-N 454.641 0.463 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)nc1 1832989166 BECDQSQLNCHBRC-XMMPIXPASA-N 482.541 0.091 50 20 JCGD CCc1[nH]nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1F 1833738871 NATWNXRLBPTTMS-BBRMVZONSA-N 451.268 0.872 50 20 JCGD Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cs1 1834290974 OXGULSBEPDIEFF-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cn2cc(F)ccc2n1 1835565893 HORXTDKAJDRRPM-UHFFFAOYSA-N 493.348 0.652 50 20 JCGD N#Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1Cl 1835931715 YMHZZAYCPANBJS-QHCPKHFHSA-N 483.717 0.275 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3c(F)cncc3F)CC2)CC1 1835998523 QXSPQXHCPXELRG-UHFFFAOYSA-N 466.533 0.918 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1836474992 IVWRIWJMSYBJNC-YOEHRIQHSA-N 461.382 0.254 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837040664 QQHXUJFDBQWSPC-UHFFFAOYSA-N 474.562 0.166 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1837079484 OPPRLEHSHFKPGA-UHFFFAOYSA-N 489.711 0.567 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Nc1cnccn1)CCO2 1837476788 DMAVVGIGMZTYTA-CLCXKQKWSA-N 470.368 0.764 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)[C@H]1SC(=N)NC1=O 1837711426 HQKJZSZTMCRCKA-OHNRDTAOSA-N 472.640 0.097 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cccc(F)n3)CC2)CC1 1837919101 DSXBFANZROZKMJ-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD O=C(c1n[nH]cc1I)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1837963406 MXQNZCLDHOGIGB-SMDDNHRTSA-N 486.669 0.619 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3CN(C)C3)C2)C1 1838528287 OGMSMPVPNDPDKI-QFIPXVFZSA-N 476.486 0.152 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839152106 ODBFDLZBKBGCRH-PNHOKKKMSA-N 498.404 0.565 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839198446 DPSGSNISROSIPR-VEVIJQCQSA-N 498.346 0.019 50 20 JCGD Cc1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839314118 ROCDTVHUHHYHRA-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4ccc(F)cn34)CCO2)C1 1839592332 BBUHCWHTFQQCNT-FOIQADDNSA-N 454.886 0.797 50 20 JCGD CN(C)C(=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802039 KJVODNGQNKCIQQ-LAUBAEHRSA-N 482.375 0.537 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)n(C)n3)C2)C1 1839961613 CQRDFYWAXVYYTD-QFBILLFUSA-N 457.369 0.901 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnc4nc3O)C2)C1 1840155139 QWDJTXLDBKMUKH-HRAATJIYSA-N 464.906 0.659 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(C(C)(C)C)c3)C2)C1 1840183684 UDAOIYFEWICADM-JOCHJYFZSA-N 464.567 0.081 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C2)C1 1840184356 HXKAZMJLZPAPRD-HYBUGGRVSA-N 487.557 0.333 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(C)c1 1840785214 DZOBEPHPWCDPFF-DYESRHJHSA-N 454.907 0.451 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CC1 1841094048 ITQWCLVQEOXJRO-UHFFFAOYSA-N 457.336 0.488 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)CCNC(=O)c1ccc[nH]1)C2 1843415237 ANAVVPCUKMQNPF-CVKSISIWSA-N 453.503 0.472 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc3nnc(Br)n3c1)C2 1844264034 WYSHAWMMELTPNF-UHFFFAOYSA-N 499.329 0.621 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CC(=O)Nc2ccc(F)cc2)C1 1844991738 XMYOQBALVGMDPY-UHFFFAOYSA-N 454.462 0.670 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)COCCNC(=O)OC(C)(C)C)C1 1845154809 AIKCAJPURSRAJS-UHFFFAOYSA-N 455.556 0.104 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1845197866 UDPJOOJCLXKDBZ-SFHVURJKSA-N 479.342 0.746 50 20 JCGD CC(C)C[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CNC(=O)c1ccco1 725739297 BONBRNCEUBGWPZ-AWEZNQCLSA-N 461.500 0.310 50 20 JCGD COc1cc(CNC(=O)NNC(=O)CNC(=O)c2cccs2)ccc1OCC(=O)N(C)C 725873189 LLJAZHHGESWOPF-UHFFFAOYSA-N 463.516 0.484 50 20 JCGD CCOC(=O)c1ccc(N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)nc1 725873766 RASDQYPXQHIIQZ-UHFFFAOYSA-N 460.516 0.613 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCc2ccc([C@]3(C)NC(=O)NC3=O)cc2)nc1 726282365 MTSROHIGUGPQSC-NRFANRHFSA-N 489.558 0.993 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Nc1nc(C)c(C)o1)c(=O)n2Cc1ccccc1 726874952 CRGFRXJRQVNKRO-UHFFFAOYSA-N 480.485 0.886 50 20 JCGD CC(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 746972074 GOUVSKTWCALTTL-UHFFFAOYSA-N 489.601 0.821 50 20 JCGD CNS(=O)(=O)c1ccc(CCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 804142131 SQPQUHNODKSRIO-SFHVURJKSA-N 477.495 0.058 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C[C@@H](C)O1 912918651 AIRRVXJIZCZVJS-OKILXGFUSA-N 496.508 0.900 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(=O)Nc2ccc(F)c(F)c2)c1 915894353 KCKSKPABXRHYTI-UHFFFAOYSA-N 455.443 0.798 50 20 JCGD Cn1cc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c2ccccc21 916516249 HLQHBRYLTBAMLU-UHFFFAOYSA-N 485.570 0.669 50 20 JCGD CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 917724925 CSTXVCGJUKVORS-UHFFFAOYSA-N 474.948 0.289 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnn1C)C2 1778091552 VCJKYIHCNFBUOS-GULKHOJOSA-N 455.519 0.682 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn4cncc4c3)C2)C1 1778654408 BGPXTZADJWDGQT-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCC3(CC1)OCCO3)CCO2 1779037216 UBJFODQNPVRRBJ-JOCHJYFZSA-N 473.530 0.062 50 20 JCGD Cc1nccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n1 1779373414 PESCOYKCFLWPSV-XMSQKQJNSA-N 453.503 0.225 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)n1cccc1C=O 1779373537 YBZYDIWCVPKWLY-LZBHBKQYSA-N 482.541 0.688 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n1 1779374611 ADNFBCCQIHRZQM-HYBUGGRVSA-N 483.573 0.716 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cccs4)on3)C2)C1 1779565595 NKFKFTSJRLRGCY-QFIPXVFZSA-N 467.312 0.840 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1 1780130622 WSLMWKLZTLQVGS-QHCPKHFHSA-N 487.488 0.599 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@H](F)Br)C3)cc21 1780774644 FXWYCKRGFMEEQF-ZRGWGRIASA-N 486.342 0.835 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccn1)CCO2)NC(=O)NCc1ccccc1 1780970505 WTMCVJSGRICXEP-QHCPKHFHSA-N 467.530 0.266 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1 1781852694 GMHAQWXLOWPWIJ-VBHSOAQHSA-N 464.357 0.690 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1F 1782109010 IMYCVHLUEQXHCP-HSZRJFAPSA-N 473.285 0.468 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4cccnn4c3)C2)C1 1782383526 QMNBHNSPMAVVKH-LRULAXNGSA-N 463.498 0.912 50 20 JCGD COc1cc2c(O)cccc2cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1782390015 JXMTWVNYMNNVSR-SANMLTNESA-N 490.321 0.991 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CCO2 1783536670 HRIWMKRMWPBKFX-NVGCLXPQSA-N 450.330 0.443 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2)CC1 1783932775 FCOOLPIKXRHBIV-RUZDIDTESA-N 486.617 0.255 50 20 JCGD Cn1cc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)cn1 1784573770 IWFIDAXWROUEBO-HRAATJIYSA-N 469.970 0.925 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786980980 IBJNQUBCNSHBOE-QRTARXTBSA-N 480.252 0.026 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cn2cc(F)ccc2n1 1788341650 FJXTWODIRSRUIT-QSFXBCCZSA-N 466.278 0.060 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1789544840 CEVKRYHNUGYRGB-OAQYLSRUSA-N 482.298 0.609 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4ncnn4c3)[C@H]2C1 1789717199 KKYQVPONCBJOMW-WEMFUYDZSA-N 492.540 0.386 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]3C2)C1 1791296409 IFXPRDKIYVGTHT-RMEBNNNOSA-N 480.389 0.998 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3ncc[nH]3)[C@H]2C1)NC(=O)NCc1ccccc1 1791482084 YRTZPHLDNNPNLI-ACRUOGEOSA-N 497.600 0.668 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792981565 NEJGNAZNXILSNB-MTCCJSQRSA-N 463.934 0.525 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2)[C@H](O)CCl 1792984372 ZDMJLIZEFAYLRM-MLNQONBDSA-N 450.845 0.333 50 20 JCGD Cc1ccc(NCCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c(C)c1 1795739228 SXIAFAUVERSBOF-IRJINJETSA-N 465.359 0.689 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cncnc1)C2 1796439985 ARVOUHGRCSYOKO-KEMUROEHSA-N 453.503 0.133 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)n3ccnc3n1)C2 1796443722 DWZAJYGPFLXEMK-JRADWPLCSA-N 478.513 0.375 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc(-c3ccccc3)ns1)C2 1797750921 XKCOLZUFKYEIJZ-JLVBRIDZSA-N 493.549 0.721 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCS1(=O)=O)C2 1798522963 JCMNCEKCUPXHQJ-GTYSZEQSSA-N 495.510 0.301 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](Br)Cc1ccccc1 1800436813 OFOFIAUPRKQLQH-WPVAHCMFSA-N 496.402 0.733 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1800725218 OVFLBSCJFCRKBH-HJGLJVKWSA-N 471.982 0.964 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800737073 ZVLOGFMBSODBNV-BHLQKMAXSA-N 457.955 0.289 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(N(C)C)ccc1[N+](=O)[O-])C2 1801011844 KIIFODJFEMVYEJ-USGNIVHTSA-N 476.534 0.237 50 20 JCGD O=C(COc1cccnc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1804332899 HQCKFQYCPVCYDC-WMZHIEFXSA-N 460.299 0.555 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnn(-c2cccnc2)c1 1805073831 LWVBSCGHVFPIOJ-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C2=NN(C)C(=O)CC2)[C@@H]1c1cccnc1 1808408041 GLHKFSOLRFWILJ-LNRKUZHGSA-N 492.540 0.830 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)COc2cccnc2)[C@H]1c1cccnc1 1810294781 NIAHUUIREABWGY-VGSWGCGISA-N 475.509 0.874 50 20 JCGD O=C1Cc2cccc(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)c2N1 1812209016 WASRULOEOFADKR-NTKDMRAZSA-N 484.321 0.889 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H]2CCNC(=O)C2)[C@H]1c1cccnc1 1813134110 MCBLNHKPWDVMSN-VAMIKSONSA-N 479.541 0.748 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCOC2)[C@@H]1c1cccnc1 1814157410 PMDDHECFSBZDSE-HLIPFELVSA-N 452.515 0.826 50 20 JCGD COc1ccc([C@@H](O)C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1 1815335572 FPQICUBKTXZKRH-OXJNMPFZSA-N 481.339 0.791 50 20 JCGD O=C(CCc1cncnc1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354551 IHGXZGFHYCBJIT-INIZCTEOSA-N 451.317 0.472 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(C(=O)O)ncn1)CC2 1817276877 FGJHSFYVOQXNNK-PCMXRQBPSA-N 496.509 0.991 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cnn4cccnc34)sc2C1)c1ccc(B(O)O)cc1 1818987751 SQLRQKHJWAIFMR-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCO4)sc2C1 1819122095 IBRMYKGHOIWGLD-GFCCVEGCSA-N 461.548 0.721 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)nc4sccn34)sc2C1 1821157169 YQMWRXQMMCYMNZ-NSHDSACASA-N 489.583 0.811 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](N)Cc1cscn1)CC2 1826085057 BNNUUHOHPFZRGE-AAEUAGOBSA-N 465.605 0.455 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CSCC(=O)O)sc2C1 1826114504 UPLXFHRGGKBWMA-VIFPVBQESA-N 464.529 0.185 50 20 JCGD Cn1cc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)cn1 1826939657 SPVQMIGSYYFVFG-GFCCVEGCSA-N 454.516 0.344 50 20 JCGD CCOC(=O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1828210988 CSLUTLPRDKXXSR-LLVKDONJSA-N 474.543 0.957 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525602 SQKUBOWPWANNJK-IIBYNOLFSA-N 469.922 0.003 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1F 1831313771 NBMAKLWGQSRRRS-RUZDIDTESA-N 484.333 0.517 50 20 JCGD C[C@@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1831651320 SJDOQCQVEQMIND-RISCZKNCSA-N 466.340 0.829 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CC1 1831874712 USEGQXXMALLHAY-YLJYHZDGSA-N 483.610 0.822 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccnc1Cl 1833007924 VSFDVHQNDNVRIT-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833306489 UCODFJQQCYKAJD-IAGOWNOFSA-N 477.002 0.043 50 20 JCGD Cn1ncc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1C(F)(F)F 1833324303 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(O)[nH]3)C2)C1 1838528379 UJNYQLSZCLPBQC-OAQYLSRUSA-N 489.441 0.333 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1 1838767953 YIMFQBMBBMEHAQ-BONVTDFDSA-N 455.821 0.147 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@H]1C[C@@H]3CC[C@H]1C3)CCO2 1839916684 RMSCRCCODWMRAH-KCESLBEFSA-N 450.580 0.642 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1840152443 IFLQBQIUAUNWNN-AOMKIAJQSA-N 480.949 0.201 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccoc3)CCO2)C1 1840515081 SYZVXKIXHMQPDN-VAHWYXDJSA-N 471.514 0.803 50 20 JCGD Cc1nn2cc(CC(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)nc2s1 1841786849 VINCSPRLSVIGID-UHFFFAOYSA-N 454.516 0.157 50 20 JCGD O=C(c1cc(Br)ccc1O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014410 HQUXRLUQSOOADT-UHFFFAOYSA-N 459.105 0.965 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264498 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HZNQVJYCHUKDMH-KRWDZBQOSA-N 464.548 0.488 50 20 JCGD NC(=O)c1cn(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2ccccc12 917392249 VFVWJTYEVHMRBA-UHFFFAOYSA-N 469.523 0.986 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1C(=O)O 917723683 IXRJSGSVHUMLLW-UHFFFAOYSA-N 456.502 0.618 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CCn1cc(C)cn1)N(S(C)(=O)=O)CC2 918319253 MPDUFTAAWMPSIZ-QGZVFWFLSA-N 479.559 0.695 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NCc1cc(C)on1)N(S(C)(=O)=O)CC2 920235241 LIJIBSGUFBMZKE-INIZCTEOSA-N 481.531 0.780 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]cnc1C)C2 1778091167 PKBJZCBVZIOXPT-WPXOGLPSSA-N 455.519 0.980 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)COc1cccnn1)C2 1778094924 OYEDKRONSHMMLV-SJUPTTPXSA-N 483.529 0.503 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778114886 PBZXRAGBAIMNJZ-LJQANCHMSA-N 450.001 0.753 50 20 JCGD COC(=O)C12CCC(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)(CC1)CC2 1778303216 QEPXJVBKFZYETK-DDJHWDJXSA-N 484.358 0.324 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1Cc2ccccc2O1 1778836846 ONTPCMOZQAHANJ-SGIRGMQISA-N 464.327 0.498 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779033739 CPOLHQCGXWBJIK-XMMPIXPASA-N 481.509 0.158 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCO2)C1 1779035230 BIEXXALUXXMIJO-QFIPXVFZSA-N 486.460 0.419 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)N1CCOCC1)CCO2 1782865899 BIVUUGZRMMHIJG-BYOQUERRSA-N 476.480 0.352 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCS(C)(=O)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@H](F)Cl)CCO2)C1 1783835177 APFHZYZYGZYKAP-BIENJYKASA-N 499.989 0.679 50 20 JCGD CN[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21)C(=O)O 1786898812 QVNWMWXZOHFWIP-UHEFJODHSA-N 492.485 0.176 50 20 JCGD 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O=C(NC[C@@H]1CCN(C(=O)[C@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374523 LAHXQXWKAIQPBQ-LTMIRXACSA-N 473.342 0.609 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2cncnc2)[C@@H]1c1cccnc1 1807508433 LCIJJDNQPLMZNV-XXBNENTESA-N 453.547 0.883 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CCC(N)=O)[C@H]1c1cccnc1 1812627649 OXHLMNGJYVGXDF-CUVSIRLISA-N 453.503 0.487 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813072324 FRVFYLPDZLMKJC-XMSQKQJNSA-N 459.547 0.970 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360656 WKZFIHSDBGYGFV-BBRMVZONSA-N 493.354 0.262 50 20 JCGD O=C(CCc1cnccn1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815362005 XZXUGESKTHDJEJ-HNNXBMFYSA-N 451.317 0.472 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476120 GQYNMLYCSWTYPS-KDOFPFPSSA-N 463.307 0.686 50 20 JCGD C[C@H](CN)C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc2ccccc2)C1 1828550794 AZAUGISFNLZLSW-RADWXHQJSA-N 466.966 0.633 50 20 JCGD COC(=O)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829381210 DOFUTDMHZOWRFM-HTAPYJJXSA-N 496.948 0.394 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829715925 DQXYEAZYPBYEAB-QAPCUYQASA-N 464.426 0.665 50 20 JCGD COc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)cn1 1830537736 NEDJMRKNIYHJMW-UGSOOPFHSA-N 457.325 0.586 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1F 1830723878 SNBWYWOOFRZWEW-ODXCJYRJSA-N 478.876 0.652 50 20 JCGD O=C(c1cc(N2CCCC2)ccn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728755 XSQZKAPGXBCWEN-RXVVDRJESA-N 452.939 0.352 50 20 JCGD CC1(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CN(C(=O)OC(C)(C)C)C1 1830737116 AJGHAVNVVAZZJT-AOMKIAJQSA-N 489.997 0.690 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCCC1(F)F)CCO2 1831715222 HXMLGWLCPMXAAZ-NQIIRXRSSA-N 466.290 0.262 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1832840261 IYCWXANAXFAPLF-YADHBBJMSA-N 457.380 0.905 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(O)nn3)CC2)CC1 1834071510 AUAWBCSCOOGGFW-CVKSISIWSA-N 482.545 0.501 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834797557 YCUGUEPOLMNTAN-UHFFFAOYSA-N 467.379 0.065 50 20 JCGD Cc1n[nH]c(C)c1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798422 UFIRYLBMWLQOJF-UHFFFAOYSA-N 453.352 0.205 50 20 JCGD O=C(Cc1ccccc1Cl)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835011964 WLGGMXBWAUFQCO-QHCPKHFHSA-N 472.734 0.333 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CCOC[C@@]2(CN(C(=O)CN)CCO2)C1 1835554354 BTIFGEWFJOTEEA-RIMDVYMRSA-N 463.332 0.771 50 20 JCGD CC(=O)O[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(C)C 1835650630 SQLYDURZSVMXPV-NRFANRHFSA-N 488.589 0.458 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1835933737 BPRIRSZNOKJFIY-IQGLISFBSA-N 482.342 0.249 50 20 JCGD O=C(Cc1ccc(Cl)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934010 KDTNCPFXIWAZBV-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc(OC)c1C 1835941776 PFDVKMSTRYVLTD-RUZDIDTESA-N 498.341 0.076 50 20 JCGD O=C(/C=C/c1cccs1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1835963512 BUDGBLSNEBNDRQ-DORXLWPQSA-N 456.329 0.211 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836129877 CGCTVWRXJSEZJS-IFXJQAMLSA-N 472.336 0.639 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836716828 SJZQGJVANWYYOG-MSOLQXFVSA-N 491.029 0.827 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837461237 QMCCTFXNIVWDJT-BXKMTCNYSA-N 483.525 0.223 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](COC(C)=O)OC(C)=O)CCO2 1837497284 UDQVFKJBRFWLCV-ABSDTBQOSA-N 462.927 0.345 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838076543 LULBAIRENCODFL-BLLLJJGKSA-N 454.833 0.109 50 20 JCGD COc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)c1OC 1838841693 IVQOEUTYACQULY-ORAYPTAESA-N 472.336 0.952 50 20 JCGD COc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838876247 MLGXFKWOZHQTAI-QHCPKHFHSA-N 469.498 0.078 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1N(C)C 1839114174 IYIFGNGLMWTLEI-LAUBAEHRSA-N 455.939 0.431 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)no1 1839201276 TWFBRWKFHCKFGW-RDJZCZTQSA-N 477.287 0.459 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nc3ccc(F)cn3n1)CCO2 1839624284 CBGFGWDTXQJJDT-HXUWFJFHSA-N 465.558 0.790 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)Oc1ccccc1 1839746455 OFDIERLQCLAONP-UQBPGWFLSA-N 482.342 0.294 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)Oc1ccccc1 1839749129 ZLYIXDZKKJLTNM-CYFREDJKSA-N 476.574 0.673 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)cc(F)c3)C2)C1 1840184023 NUPJWQWRCNXKEB-QFIPXVFZSA-N 468.501 0.337 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4nc[nH]c34)C2)C1 1840184073 PZGDMCDEOUBCSE-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1 1840185459 QUFLBFFPCMMHIN-NRFANRHFSA-N 481.481 0.177 50 20 JCGD CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC[C@H]2C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841353955 ZQTUMGOZSGITCU-HOTGVXAUSA-N 499.008 0.553 50 20 JCGD Cc1cc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)nn1C 1842429322 IMIGBFBDFAILTA-UHFFFAOYSA-N 453.547 0.892 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1 1844265547 NUGOUGWNNSMDSB-UHFFFAOYSA-N 467.482 0.368 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1)C2 1846384148 KSVXJNMJDUDNPJ-UHFFFAOYSA-N 481.594 0.325 50 20 JCGD O=C(NNC(=O)c1c[nH]c2ccccc2c1=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 32605234 YGUTZBLQHQIBPN-UHFFFAOYSA-N 456.480 0.624 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1 726199330 BRQNJTGTSGAQHD-UHFFFAOYSA-N 477.543 0.442 50 20 JCGD CC(C)N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c1 729274769 CKSAWCLQZURXJN-SNVBAGLBSA-N 454.958 0.068 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@H]2CCN(c3ccc4c(c3)OCCO4)C2=O)c2ccccc2c1=O 730516371 GSMIFTXJUBICBB-MRXNPFEDSA-N 463.450 0.519 50 20 JCGD O=C(NCCS(=O)(=O)N1CCSCC1)NNC(=O)c1ccc(Br)s1 730579293 GHIHLBAYFPVOJW-UHFFFAOYSA-N 457.397 0.833 50 20 JCGD COC(=O)c1cn(CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c2ccccc12 746248937 YYKNRMQLHZDNTI-IBGZPJMESA-N 467.434 0.959 50 20 JCGD O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1Cl 751270609 JIDIDIPIHFXGFP-SNVBAGLBSA-N 469.925 0.263 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)N[C@]3(CCCC[C@@H]3C)C2=O)n1 760205685 YGWRFOSMDQXXIB-WLRWDXFRSA-N 451.505 0.185 50 20 JCGD O=C(COC(=O)CC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1cccc(Cl)c1 769243730 ZNEBMLKUCCOMDC-UHFFFAOYSA-N 464.887 0.773 50 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CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc[nH]n2)C1)NC(=O)NCc1ccccc1 1777774831 IBQMIABQVHKWME-WZONZLPQSA-N 484.561 0.278 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1snnc1C1CC1 1778364680 SOSYADWWOAALIT-VGOFRKELSA-N 470.360 0.537 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(CCN(C(=O)CO[Si](C)(C)C)C3)C2)n1 1779298928 QETIOUKRZSBPGW-NRFANRHFSA-N 450.612 0.968 50 20 JCGD CSc1cccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1O 1780153879 DHEBCHDRKZOXMQ-NRFANRHFSA-N 450.561 0.931 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1 1780185287 PEEDESOSVQCKMN-RUZDIDTESA-N 472.310 0.581 50 20 JCGD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1N(C)C 1780660191 WWTPVXMEFZFZON-ZEQKJWHPSA-N 495.385 0.882 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)C2)C1 1781116029 ZJNZUCNNHMFOEY-DSEONOSFSA-N 490.395 0.828 50 20 JCGD C[C@H](NC=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1781252406 NXFGTBPTIQWGIB-XAUMDUMWSA-N 452.349 0.957 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1781352672 FAEBIQYXUJNYLM-HRAATJIYSA-N 473.643 0.944 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1 1783707038 FRYKCVVZYZXJQV-QJKVCXGQSA-N 490.561 0.864 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(Cc3cccs3)C1)CCO2 1783933016 AIFCSTNJCHEISJ-HXOBKFHXSA-N 491.614 0.300 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1 1784089414 BFTIOOHHVDBBMC-DKIMLUQUSA-N 458.964 0.348 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1)n1cccn1 1784524012 JOQUEIYWRZZOST-DVECYGJZSA-N 483.573 0.620 50 20 JCGD O=C1CC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)=Cc2ccccc2N1 1786981215 YTVHJNIWMLNBRB-HARLFGEKSA-N 489.337 0.386 50 20 JCGD CC(C)(C)c1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1787174466 MYICQLVPNZKRCX-YYWHXJBOSA-N 465.359 0.966 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3nc[nH]n3)C[C@@H]21 1787508232 RHCRZYWVTBHZMZ-HVEJOWRVSA-N 474.547 0.011 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788140126 JEWBLIQJBBHXGS-OAHLLOKOSA-N 458.345 0.795 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(F)cc(F)c1F 1791992410 LJLCETHVXFYXCN-IXDGSTSKSA-N 462.233 0.691 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792983956 WCOUHYRXOYHGEP-CSFFLVESSA-N 455.914 0.062 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795115098 IJGXUMCZKKYSKP-ZMJPVWNMSA-N 450.330 0.204 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)C2)c1ccc(B(O)O)cc1 1795735287 VXWPDGYNQVZALF-VPTLXERWSA-N 470.281 0.580 50 20 JCGD N#Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c(Cl)c1 1795739911 PJRQETHSQAZOLP-CWPLJXCYSA-N 453.691 0.408 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccc3[nH]ccc13)C2 1796440293 KLXKPOFNBCLBNW-UTRJNVLQSA-N 463.498 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1C(C)C)C2 1796441682 POPBLLQDCMFENA-LLJCUJCISA-N 455.519 0.801 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)n1 1798440490 MKHMJJVXROQXFR-MUJYYYPQSA-N 467.530 0.237 50 20 JCGD COc1ccc2[nH]cc(/C=C/C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)c2c1 1799387305 VDKJGIPFOSXCRV-SQKWKTBVSA-N 489.337 0.773 50 20 JCGD CNC(=S)NCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F 1800333440 ULYFLMOKBFLHCI-AOWDBCOTSA-N 477.537 0.945 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803147732 GTLQUSTYIQVOSL-CVYDXHPNSA-N 497.980 0.456 50 20 JCGD CN1N=C(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCC1=O 1804121598 HLRNQVQEDOCAQE-MGPUTAFESA-N 478.513 0.008 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360589 LJBXVCVRYZIPQK-GCJKJVERSA-N 459.315 0.538 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1 1807361189 FFVRQEYTONGPRT-XXBNENTESA-N 473.342 0.856 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@H](CNC(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)c(C)n2n1 1807364300 TXIPFHLQUOOTJU-XXBNENTESA-N 499.340 0.449 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnc2[nH]ncc2c1 1809703363 KVNLPCVZZVTUTA-UTKZUKDTSA-N 470.298 0.666 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1 1810303294 PSSHXCDATDQRGD-IERDGZPVSA-N 485.508 0.756 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)n1ccccc1=O 1810518834 SUWZPGORGUAEFI-HFJQGTKSSA-N 468.558 0.883 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(O)nc2)[C@@H]1c1cccnc1 1811462271 YIZAMWROQDBKJK-QRWLVFNGSA-N 461.482 0.814 50 20 JCGD O=C(C/N=C/c1ccco1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356338 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467.526 0.388 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C(=O)c3cccn3C)CC2)CC1 1835118042 KXSDYVFMNNBRMA-OGLMXYFKSA-N 495.584 0.913 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(=O)n3C)CC2)CC1 1835118405 ZBTYKRMIZOSMFV-OGLMXYFKSA-N 495.584 0.705 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835847388 OHNOPRGSHASWCF-GOSISDBHSA-N 479.390 0.447 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)C34CCC(CC3)CC4)C2)C1 1835939839 KIVXJGVQIFDODS-FXLJNVFASA-N 456.348 0.407 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cnc2snnc2c1 1836100228 DPADGFOYQVBKFC-MRXNPFEDSA-N 452.968 0.871 50 20 JCGD CCc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1Br 1836281447 DIHVTSRHJHFGLT-FZKQIMNGSA-N 493.786 0.415 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1836919798 SWOYMKMLGLPOOA-OAHLLOKOSA-N 465.942 0.832 50 20 JCGD COc1ccsc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459144 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C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1 1840033286 ZWSDEFDITMBDJN-XIKOKIGWSA-N 452.309 0.811 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C2)C1 1840149894 ALZOVAFABOBQDG-LRXVAGHRSA-N 465.934 0.890 50 20 JCGD CN1CCC(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)CC1 1841097132 JQUGHNKHKOBMIJ-UHFFFAOYSA-N 456.591 0.878 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1)C(C)C 1841352651 CPZRVHZXCFABGU-XHSDSOJGSA-N 472.970 0.161 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)CCN1C(=O)C=CC1=O)C2 1841923909 DAMJHYHAVWUMQM-AWEZNQCLSA-N 468.938 0.637 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@]2(C)CCN(C(=O)OC(C)(C)C)C[C@H]2O)C1 1843984049 VGPVIAVTNLRLAJ-HXOBKFHXSA-N 495.621 0.571 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCNC3=O)C1 1843998143 QTYPDXNSTOOCHU-HNNXBMFYSA-N 494.980 0.966 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844263474 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C[C@@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782210060 CIAKZGKUPNEUQJ-QMTMVMCOSA-N 461.401 0.904 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1784287728 NCZQSVAKOSOBMA-HJPURHCSSA-N 452.515 0.402 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1F 1786984895 WBHWGLJRZNVGNN-NDXORKPFSA-N 498.316 0.589 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCOCC4)cc3)C[C@@H]21 1791291270 QIZQMTCOOSWXBF-BVSLBCMMSA-N 487.601 0.490 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3cccn3)[C@H]2C1 1791641777 VLVOLRUKUYJAHX-MMBSPWHRSA-N 455.519 0.558 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C[C@@H]2C[C@@H]21 1792974855 FGHUILVPRAPYDU-ZUKRZWFUSA-N 457.955 0.574 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n(C)n1 1793878173 BFEKAPCVROLNMX-LOUJCGABSA-N 485.969 0.764 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1CS(C)(=O)=O 1794403474 MNXNKWFWMWXTCQ-ZJOBFFGXSA-N 488.404 0.860 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCOCC2)cn1 1794767637 IMVXRMGSAFFXQP-BJWYYQGGSA-N 479.541 0.482 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2cc(Cl)ccn12 1796059227 NTJYEDNFKHPABE-VTEUUUEMSA-N 462.938 0.564 50 20 JCGD Cn1ncc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)ccc21 1797750883 UIXHFSFGBHAIPS-CWPLJXCYSA-N 463.498 0.089 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cocn1)C2)NC(=O)NCc1ccccc1 1799094626 AFRHBGUHMLWWAC-XEMDLRDOSA-N 456.503 0.224 50 20 JCGD COc1c(C)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1C 1799692054 DVIJDIYKIXCAJM-CEQLMSFQSA-N 452.316 0.509 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc(C)c1C(=O)O 1799869025 JXPVNECDUBIJMB-RMFSNUHRSA-N 466.299 0.198 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1800200651 SMNYMMCYNFNACJ-ZJOBFFGXSA-N 453.337 0.575 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc3ccccc3n1C)C2 1801009014 MICIZDLOZWIJMR-MRSFGVLCSA-N 455.559 0.683 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CO[Si](C)(C)C)C3)C1 1801052487 QGHIHWMNJABDBR-UTAOTPEMSA-N 485.654 0.799 50 20 JCGD CSc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1801177303 GZCLLWCBFBLJDK-OPMZPASUSA-N 454.357 0.534 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)c1ccccn1 1801466703 BJYMFRLJJOKBIY-XAKVRMBRSA-N 452.515 0.909 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)c1 1803141461 OEFTWBBJZGOXDS-ZTFGCOKTSA-N 466.947 0.799 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cc2cncnc2)[C@H]1c1cccnc1 1804647823 SXHJFHGUAFARQE-DYESRHJHSA-N 460.498 0.432 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372345 DNNKQRUOSDZOTL-LAUBAEHRSA-N 488.288 0.577 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccnc(Cl)n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375468 PEIAOENLJKGSBU-QFBILLFUSA-N 465.706 0.838 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302568 LEFGGCIUKJZONW-IERDGZPVSA-N 475.509 0.412 50 20 JCGD CC(=O)N/C(C)=C/C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1812319580 GVZBQDIVBGYZEH-KTIZVAHXSA-N 465.514 0.440 50 20 JCGD COC(=O)C12CC(C(=O)N[C@@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)(C1)C2 1815348361 LDKRCACKQHQISQ-XWIYTBAMSA-N 469.328 0.392 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)c3nc[nH]n3)sc2C1)NC(=O)NCc1ccccc1 1816032585 SDPNOCMDCZYMFC-CQSZACIVSA-N 483.558 0.833 50 20 JCGD N[C@@H](CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)c1cccnc1 1817474488 HBWYGHHLBTXDHZ-ICSRJNTNSA-N 462.319 0.881 50 20 JCGD CCCNC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793732 SBIOFRZACMGIIT-LBPRGKRZSA-N 473.559 0.674 50 20 JCGD CC(C)(NCCC#N)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819796131 ZWWLHNGTOYDJJI-GFCCVEGCSA-N 470.559 0.649 50 20 JCGD CCOc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)nn1 1826088997 SWOYKYWIVDRAHP-LBPRGKRZSA-N 461.548 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)COc3cccnn3)sc2C1 1826762689 ZEPWTGMXUZESBK-LLVKDONJSA-N 468.499 0.236 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826842005 SQTASHCFOPACJC-MRXNPFEDSA-N 467.360 0.642 50 20 JCGD O=C(Cn1cnnn1)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc1ccccc1 1829359851 JAFRXTGXXRKPOQ-HXUWFJFHSA-N 496.355 0.929 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)CC1 1830156722 GHYAQZPTGUGUTN-JOCHJYFZSA-N 475.358 0.885 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830533516 PINGEORQGLYQSE-KXBFYZLASA-N 462.385 0.780 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c[nH]c1C 1830720105 SZCNJTBDTDYMDO-VGOFRKELSA-N 485.965 0.489 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c2cc(O)ccc2n1 1830732162 VLIIMVHDCQBZAH-SIKLNZKXSA-N 463.918 0.919 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)n1 1832769125 IAHGGHBNIVUVNK-OAQYLSRUSA-N 451.596 0.941 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833310767 RJJZOGWAFWOGPD-MJDKSPQASA-N 466.970 0.292 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCc4ccoc4C3)CC2)CC1)c1ccc(B(O)O)cc1 1834797725 ABCJQDLEQBSYBE-FQEVSTJZSA-N 479.386 0.950 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738337 XLFDCBMUSBKBNV-ZDUSSCGKSA-N 481.395 0.654 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1 1835755908 UOUSDDSYBAJRKD-FQEVSTJZSA-N 485.654 0.904 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1F 1835927260 NCYYCSUZISMXGR-RUZDIDTESA-N 484.333 0.517 50 20 JCGD COc1c(Cl)cccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934387 RGSHEYBGYSKPHE-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C3(c4cccc(Cl)c4)CC3)C2)C1 1835937120 PKVDDEZIXRDKPZ-DEOSSOPVSA-N 498.772 0.822 50 20 JCGD C[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1836344051 UCKIPAIIRMUZKF-GOSISDBHSA-N 474.606 0.285 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(F)c1 1836689733 PGZSPQOSJFLMGZ-GHTZIAJQSA-N 458.914 0.823 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@](C)(O)C(F)(F)F)CC2)CC1 1837018785 PRTAZLAFHSTLJK-LJQANCHMSA-N 466.501 0.671 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)n1 1837658977 JBRVDJUVEXQKGA-IBGZPJMESA-N 461.346 0.547 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)n1ccccc1=O 1837689081 MZQXQMFUVGIIFG-DDUZABMNSA-N 460.300 0.556 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)nc1Cl)CCO2 1837827460 IUVGIEJYPXGRRX-FQEVSTJZSA-N 488.372 0.831 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnc(N)s3)CC2)CC1 1837900959 RREUTWHPOZFWSF-UHFFFAOYSA-N 473.559 0.650 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)CCO2)C1 1838628698 QXYFZHBJNBDXFG-VLIAUNLRSA-N 485.877 0.647 50 20 JCGD CC(C)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1838979474 UWSBIIRZEFJCIR-RUZDIDTESA-N 466.343 0.874 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839019220 KRZZRONGYIFTIZ-XMMPIXPASA-N 483.525 0.468 50 20 JCGD O=C(c1ccc2nc(CO)[nH]c2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200971 PQAMDCODFZAOFN-APWZRJJASA-N 485.310 0.816 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184152 AFWRHLDCOOPQEJ-DEOSSOPVSA-N 484.557 0.381 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1 1840187360 VKDGHNDQORMZIB-XMMPIXPASA-N 490.557 0.225 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843015773 YTLWRMZUCOROBF-UHFFFAOYSA-N 457.336 0.440 50 20 JCGD Cc1c(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)ccc2c1OCCO2 1843295735 GIEBMNYMQBKICW-UHFFFAOYSA-N 451.483 0.896 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](C)[C@@H]2SC(=N)NC2=O)C1 1843405350 QTUKXRANZWCEMN-JVPJOIETSA-N 459.532 0.126 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)[C@H](C)NC(=O)c2cnccn2)C1 1844332882 OBNFPFHPZWPQFA-AWEZNQCLSA-N 496.480 0.946 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1 16785965 OUHYTEVVCLSQCL-ZDUSSCGKSA-N 497.517 0.688 50 20 JCGD COCCCNC(=S)N(C)NC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)O[C@@H](C)C2)c1 726077540 YXDFBBDHTPZCBG-GJZGRUSLSA-N 458.606 0.972 50 20 JCGD CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 727609350 JVOVDUYOONMNEQ-LBPRGKRZSA-N 468.561 0.593 50 20 JCGD Cc1ccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)cc1 728203642 YGTQBTCVLQSKQS-UHFFFAOYSA-N 475.571 0.955 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@H](C)NC(=O)c2n[nH]c3ccccc23)cc1OC 728365252 JHDXXYWPPLHFCS-LBPRGKRZSA-N 469.454 0.703 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)[C@H](C)NS(C)(=O)=O)c1 728449714 MAURSMHVVHJWGF-LBPRGKRZSA-N 465.623 0.281 50 20 JCGD CC(=O)Nc1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1 729059475 WTYBTLIQOSWEIC-UHFFFAOYSA-N 475.575 0.845 50 20 JCGD CCOc1cc(Br)c(CC(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1OCC 729274690 AEPIZGCDCWYOTN-JTQLQIEISA-N 466.354 0.874 50 20 JCGD O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 730513248 YOPAIZKXMCPWSZ-UHFFFAOYSA-N 481.494 0.011 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)COc1ccccc1O 730779264 ZZFVRKBWNPXMFS-HNNXBMFYSA-N 483.930 0.805 50 20 JCGD O=C(COC(=O)[C@@H](c1ccccc1)N1CCC(O)CC1)NNC(=O)[C@@H]1COc2ccccc2O1 731247384 DPXYEDYIJRMBMW-RBBKRZOGSA-N 469.494 0.715 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1 745837590 BUTKPDKEUDLRFP-LJQANCHMSA-N 451.483 0.172 50 20 JCGD C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 750281746 XRDAFUZAVVJXNJ-ZJOBFFGXSA-N 459.455 0.081 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)cc1OC 789986931 LYHJVMSJJOLQOG-UHFFFAOYSA-N 455.514 0.861 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cnn2cccnc12 896289402 RWCNIBFJOWSYIJ-UHFFFAOYSA-N 458.500 0.144 50 20 JCGD C/C=C/C=C/C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CCOC)n(Cc2ccccc2)c1=O 901414852 ALXMDUJIVCDBQU-HFBSYCRKSA-N 466.498 0.334 50 20 JCGD CC(C)C[C@H](C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1)N1C(=O)[C@H]2CC=CC[C@@H]2C1=O 913155894 AGOLZPKVYKTFCR-OKZBNKHCSA-N 451.487 0.789 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(CC(F)(F)F)C2)c1 914748449 FGQVILBBLZLLTA-CYBMUJFWSA-N 464.466 0.889 50 20 JCGD CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)s1 916233228 SRIDVMBEBBNQGY-UHFFFAOYSA-N 474.590 0.402 50 20 JCGD COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(CC(=O)NNC(=O)c2ccc(F)cc2)CC1 917107157 WZZMGFGZAHKFHW-UHFFFAOYSA-N 496.517 0.590 50 20 JCGD CN1C(=O)N(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C(=O)C12CCCCC2 917241240 ABNNOZPYZGOPGL-MRXNPFEDSA-N 474.470 0.114 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)N[C@H]2CCCN(S(C)(=O)=O)C2)c2ccccc2c1=O 920238732 JPUQYJATJKRSFH-ZDUSSCGKSA-N 450.521 0.345 50 20 JCGD COCCN1C(=O)/C(=C\NNC(=O)CSc2nc3ccccc3s2)C(=O)NC1=S 920977575 CUELPXSPIQEGBF-NTMALXAHSA-N 451.555 0.783 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1C 921247264 CNFKKGWJXMMSQZ-UHFFFAOYSA-N 465.488 0.899 50 20 JCGD COc1ccc2nc(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)ccc2c1 1777894174 KZOLIXAWTNJXPN-RUZDIDTESA-N 475.310 0.681 50 20 JCGD CC(=O)N1CCN(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C3)CC1 1778911726 NVVZBVJUAZQSFU-DUXKGJEZSA-N 477.433 0.901 50 20 JCGD Cc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1779028956 PXSXSAGIXYGAHL-HSZRJFAPSA-N 452.515 0.465 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ncccc1C(F)(F)F)CCO2 1779032483 LJFZASZWFYJZBE-FQEVSTJZSA-N 478.431 0.856 50 20 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O=C(CN(CCO)CCO)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1 1812717750 WBIVGGWIODNRDL-UAGQMJEPSA-N 461.332 0.065 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1814132307 UDUGBJQFDATARF-DXIQSLLYSA-N 460.579 0.765 50 20 JCGD O=C(Cn1cc(Cl)cn1)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339800 PHCWDVXUUNONCI-CQSZACIVSA-N 459.724 0.599 50 20 JCGD CN1CCN(C2(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3cnccc3C(=O)NN)CC4)CC2)CC1 1822714991 FQMARYPSIDNDMM-AWEZNQCLSA-N 498.613 0.147 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822790848 HBQMSNMIFGBLBC-FQEVSTJZSA-N 464.335 0.988 50 20 JCGD O=C(c1cccc(=O)n1O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055808 GIZLMTUKPIMXEE-IBGZPJMESA-N 453.304 0.313 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](C)NC=O)C2)C1 1829340829 PUGTZVAZJPDBDZ-LTMIRXACSA-N 494.976 0.827 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1 1830719867 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1O)CCO2 1833754604 GUNFGOSJFPOFOZ-DZQSVEARSA-N 469.498 0.596 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1ccc(B(O)O)cc1 1834798089 ZEYNGHKZBTZBLS-UHFFFAOYSA-N 466.185 0.337 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3ccncn3)CC2)CC1 1835144443 AFUZSUYIKUCPTG-LQKURTRISA-N 466.546 0.796 50 20 JCGD C=C(C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)C(F)(F)F 1835738324 WQHJXFJLXKUKGS-UHFFFAOYSA-N 468.480 0.989 50 20 JCGD CC[C@@H](C)[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836890869 DNSWIOAOBWLMKZ-QRWLVFNGSA-N 461.563 0.704 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)s1 1837456901 PPOIXWKJIXBPLP-NRFANRHFSA-N 459.528 0.439 50 20 JCGD O=C(c1csc(C(F)(F)F)n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838185763 DKPHJAGJSKKLPQ-XHDPSFHLSA-N 457.858 0.832 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncnn3C)C2)C1 1838526725 AFXCHLRAYSOIPS-OAQYLSRUSA-N 488.457 0.032 50 20 JCGD C#CCO[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838527144 JNOSFFRTLIPFJX-MWTRTKDXSA-N 489.481 0.628 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839518975 OTWQKKAFZQPQTG-FZKQIMNGSA-N 457.325 0.519 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1840034400 JTTRXFJUEPFGIA-LPHOPBHVSA-N 473.412 0.006 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)s1 1840182627 OPQFHEMAXRBECJ-JOCHJYFZSA-N 466.604 0.819 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)CCO2)C1 1840772203 GIXGYIBHGVTCKY-YWZLYKJASA-N 492.953 0.553 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1840787790 QQHAZQZRVNQCGW-LAUBAEHRSA-N 453.923 0.058 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1841520503 VFOZYCFFEOYLAV-UHFFFAOYSA-N 455.320 0.361 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)cc2)CC1 1843009759 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728216183 UPNIIMMZTKOJIZ-UHFFFAOYSA-N 492.583 0.431 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1cc(F)ccc1Br 728549460 MNCGUVUILZFNJZ-MWLCHTKSSA-N 462.297 0.385 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CNC(=O)c2c(F)cccc2Cl)ccc1Cl 730585529 WYKHKNIPXOXOJH-UHFFFAOYSA-N 463.274 0.971 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)COc3ccccc3O)c2)CC1 730781022 CEWINJHJLLNFIM-UHFFFAOYSA-N 476.511 0.085 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)CCn2cc(S(N)(=O)=O)cn2)c2ccccc2c1=O 749404319 ZNAZIMOHXZTMMD-UHFFFAOYSA-N 475.531 0.282 50 20 JCGD CC(C)(C)N1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1=O 914710051 GWKHSTRCYPNLIV-OAHLLOKOSA-N 452.533 0.116 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)c1ccc(S(=O)(=O)N(C)C)cc1 918105109 OOFQAUURXKRVMU-CQSZACIVSA-N 497.599 0.892 50 20 JCGD COCCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCCCC1 920862411 CIFDWTAASNIOEY-UHFFFAOYSA-N 483.591 0.678 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)s1 1779373445 SDQUARYEBFDQOM-IIBYNOLFSA-N 473.559 0.215 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc[n+]([O-])cc1)CCO2)NC(=O)NCc1ccccc1 1780968183 GIKYFHAPVRHJCR-XMMPIXPASA-N 482.541 0.110 50 20 JCGD COCc1c[nH]c(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)c1 1780969023 SFIWCPBZLDDIGP-VWLOTQADSA-N 498.584 0.951 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1 1781717433 YYOVZIFELLCKLL-XMMPIXPASA-N 460.299 0.309 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1782051776 MVQABGZIDZPETM-QHCPKHFHSA-N 497.512 0.417 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782788384 VCBKMUROGFBENB-ZWKOTPCHSA-N 461.302 0.823 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)CC2=O)c1 1783445611 JSQGHUXPGQHPSW-GYWCDFCBSA-N 479.961 0.628 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)CCO2 1783868601 IXLPOEURZLIXNN-VIRVFLBCSA-N 467.950 0.250 50 20 JCGD Cc1cccc(C)c1N1C[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1=O 1783933253 FYCAWXPEVBFQPG-FNZWTVRRSA-N 499.612 0.859 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(C(=O)N(C)C)c1)CCO2 1783938064 REWXBPBBFPVEGP-HSZRJFAPSA-N 459.547 0.205 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)C3(c4ccccc4F)CC3)C2)C1 1785461314 QGGBALRYJBMDEV-HSZRJFAPSA-N 467.501 1.000 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CS[C@@H]3CCCCO3)C[C@@H]21)c1cccc(B(O)O)c1 1786983964 ICVGXAXZDBIPPZ-MCNSAMFCSA-N 462.377 0.220 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(C(C)(C)C)cn3)[C@H]2C1 1787787919 DCKGQSCNTHCYOP-BQFCYCMXSA-N 460.579 0.740 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc2c(c1)CCCC2=O 1788001131 ZCCUJTBGOPEYRR-APTRMMRNSA-N 476.338 0.793 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccn(-c2ccccc2)n1 1789348485 VZOJQCIIQAVKLJ-HARLFGEKSA-N 474.326 0.459 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1790962930 WUEUTWAPDDZTFW-RVMXOQNASA-N 478.434 1.000 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1791254457 UPLNSYUAOJODSQ-HAGHYFMRSA-N 496.008 0.566 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc(C)c(O)nc3=O)[C@H]2C1 1792132482 UXKHIWCISYLWPD-AJNGGQMLSA-N 471.352 0.411 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H](F)CN1C(=O)OCc1ccccc1)C2)[C@H](O)CCl 1792980088 LJTWEJOCNMDVAX-APNJTCTJSA-N 497.951 0.925 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN1C 1793639813 AFDBNTUEYRYXME-ZDUSMZPESA-N 460.487 0.818 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSC(=N)N 1795505603 SVCASMSSESNSAD-DPIQGUFMSA-N 465.488 0.350 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(F)F)no1 1795913989 IDGLZTSIPZZVAK-KEODLESXSA-N 450.402 0.128 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C=O)s1)C2 1796440220 JAIAPSDWSALLFA-GBQKICQVSA-N 457.512 0.898 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)n1 1797908721 GHFHASJBSSESLE-AYRXBEOTSA-N 459.316 0.567 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(=O)Nc1cccnc1 1798564743 BVJODZCUHNKJTN-AUHJYUKYSA-N 451.487 0.792 50 20 JCGD CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1csc2c1c(=O)n(C)c(=O)n2C 1799064575 RFPLDZMXSWRDPS-BASYENTBSA-N 497.017 0.838 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799075591 HZQNXMSJXWNKCQ-USGNIVHTSA-N 482.733 0.342 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn1C)C2)NC(=O)NCc1ccccc1 1799094706 GHEWKFDCOJRVQQ-HATOLVCRSA-N 468.558 0.575 50 20 JCGD COc1cc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(C)c1 1799720230 CMCZZBQQZBSWPP-OPMZPASUSA-N 452.316 0.509 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccncc1=O)C2)[C@H](Br)Cc1ccccc1 1800436955 QRKAQUFYFDVVRW-BMQTXXJKSA-N 489.370 0.839 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H]2C[C@H]2N1C(=O)OC(C)(C)C 1802137247 FASBHKSUQUSLSP-ARCNBWKDSA-N 493.605 0.347 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1 1802235002 BUXHGKBVSYHBDA-NNXHMXCWSA-N 475.970 0.466 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnc(Cl)nc1 1802295215 AFYUBCXDWNJSAK-VQIMIIECSA-N 465.706 0.838 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc([N+](=O)[O-])c3c1OCO3)C2 1802336292 IYUCZGBLCSIILC-BTTYYORXSA-N 461.475 0.948 50 20 JCGD O=C(CC1CCOCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1806934677 XNEGKEKTBCTGFV-NZQKXSOJSA-N 451.332 0.898 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(-n3cccn3)nc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362958 XSQNELWDKVLUPM-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375486 PIZLMYAAOKVBEA-WIYYLYMNSA-N 470.298 0.438 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1808302609 HXPVLCMZULIBAQ-PEELUZDISA-N 479.328 0.764 50 20 JCGD COCCn1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1808659518 LJOQZONWZZAZEV-XMSQKQJNSA-N 471.562 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(O)n2)[C@@H]1c1cccnc1 1810300349 XNNRJQJSADGUEE-MGPUTAFESA-N 461.482 0.814 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3c3cccnc3)(C1)C2 1810305010 IOJJVASFOJGPEQ-TWLZIOCDSA-N 492.536 0.743 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1810354643 UFDUJLOFFAPHHW-LMNJBCLMSA-N 450.612 0.590 50 20 JCGD C[C@H](CBr)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1 1810489209 JLHCJPWFQRJNFJ-GFCCVEGCSA-N 466.340 0.688 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813071922 YWOJDLZIKXQKKA-YQPWQLKSSA-N 496.572 0.594 50 20 JCGD COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1 1815350574 YFXSKIIVSLNCDB-OAHLLOKOSA-N 452.301 0.766 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)N2CCOCC2)n[nH]1 1819445413 XWJSQDJTSSXSTN-QACWDQBZSA-N 486.533 0.186 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1823576002 WQSQWACFLODFNG-JJBLJPBOSA-N 494.338 0.819 50 20 JCGD O=C(c1nc2ccccn2n1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052849 JXQAEILZNJONOA-HXUWFJFHSA-N 461.331 0.956 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725733 RJFXWPSEUBKDPT-VGOFRKELSA-N 478.933 0.556 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CSC3CCCC3)CCO2)C1 1831361981 LRFICSZDHKNTDG-QFIPXVFZSA-N 477.587 0.431 50 20 JCGD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832172884 ZQQPIZMXXLKEGM-XLIONFOSSA-N 455.895 0.584 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cocn3)C2)C1 1832549699 YFLSIXGBJKJVPF-XOBRGWDASA-N 472.926 0.877 50 20 JCGD Cc1cccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1832614954 JXAACQWIEAUMIF-XMMPIXPASA-N 482.541 0.091 50 20 JCGD CC(C)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CNCP(=O)(O)O)CC2)CC1 1834663467 NLEQBQRWWICAGS-UHFFFAOYSA-N 452.920 0.548 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1834797365 GMEKFLAHJSGSAX-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CCC(F)(F)C3)CC2)CC1)c1ccc(B(O)O)cc1 1834797779 FGGKSDCDBSWBJZ-KRWDZBQOSA-N 463.334 0.987 50 20 JCGD N#Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1834798390 OVVGPJCYFVSVHB-UHFFFAOYSA-N 460.343 0.737 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cn4cccnc4n3)CC2)CC1 1835547340 APFRSTFGIDRNOD-UHFFFAOYSA-N 470.578 0.288 50 20 JCGD CNc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1835607027 VSYMCILYGOSYNH-HSZRJFAPSA-N 468.514 0.111 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnn4c3OCCC4)CC2)CC1 1835738242 ONUZMOCQJBKNHH-UHFFFAOYSA-N 496.572 0.163 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835933975 IVEWBHPDEIXSKM-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD CC(C)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1836623515 MSHVNCNUYXCGKL-UHFFFAOYSA-N 453.904 0.975 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4=O)CCO2)C1 1837139743 GWKWODIIMFVJOQ-VFNWGFHPSA-N 465.890 0.145 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1 1837459307 CEJKKLOCPNQZBZ-QFIPXVFZSA-N 475.452 0.347 50 20 JCGD O=C(CN1CCCCC1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837798244 WTGWOYYOXNGPCC-UHFFFAOYSA-N 457.380 0.465 50 20 JCGD O=C(c1n[nH]cc1I)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1837963404 MXQNZCLDHOGIGB-FZMZJTMJSA-N 486.669 0.619 50 20 JCGD CN(C)C(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839743249 GFFGHKWEFCZKDP-NAVGAYGYSA-N 462.453 0.416 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C3CC3)C2)C1 1840152690 PVUBLSMCHAXHOV-HYFFOGBASA-N 489.997 1.000 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C=O)s3)C2)C1 1840184119 TUDCDNVQVRZLDS-FQEVSTJZSA-N 452.533 0.004 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(-c4cnco4)c3)C2)C1 1840185217 NQVIEOOLGDYZGP-XMMPIXPASA-N 485.541 0.785 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccccc4F)CC3)C2)C1 1840187326 SKGUXKGULJJMFA-QHCPKHFHSA-N 476.549 0.687 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3c1CCCC3)CCO2 1840721040 CAKGRWJURWIEII-SANMLTNESA-N 493.564 0.948 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)cc1 1840905531 GHWQETQCPZXJHB-XLIONFOSSA-N 486.338 0.872 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCN(C(=O)OC(C)(C)C)C[C@H]2O)C1 1841028218 WFPSCDSWDLWNEW-IAGOWNOFSA-N 481.594 0.181 50 20 JCGD Cc1cccc(C)c1N1C[C@@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1=O 1841915911 TUBLWQVCVXOXEE-FQEVSTJZSA-N 475.354 0.853 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cc(=O)nc3sccn13)C2 1843416519 UBCMTFPNSHLNIZ-ZMOGYAJESA-N 467.511 0.707 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844230669 YFYRTJLPTRUBOG-QGZVFWFLSA-N 473.578 0.244 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1=Cc3ccccc3NC(=O)C1)C2 1844264537 FCDYUTZHZPGKHU-UHFFFAOYSA-N 460.494 0.928 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844265270 MONMLZCZZDPTSI-KRWDZBQOSA-N 484.557 0.759 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)c2cc(S(C)(=O)=O)ccc2Cl)C1 1846924858 BGWSQKYGFLRQPN-UHFFFAOYSA-N 470.979 0.934 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)s2)c2ccccc2c1=O 17190740 QKYLCNOFSIINNH-UHFFFAOYSA-N 463.541 0.644 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CN3C(=O)CN(C)C3=O)c2)cc1 725896834 PDBZSIBTYYNFOP-UHFFFAOYSA-N 475.483 0.151 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)n1 728722221 BFEJVKFUXKSZDA-UHFFFAOYSA-N 466.541 0.687 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@H]1CC(=O)N(Cc2cccc(C(F)(F)F)c2)C1 729273927 BFMNETLFRQIHKE-JQWIXIFHSA-N 450.439 0.139 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(Cl)c(S(=O)(=O)NCc2ccccc2)c1 729275045 JUYHRSYMAIOCEA-LBPRGKRZSA-N 488.975 0.517 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CNC(=O)c2cccs2)ccc1OC 751209078 KEKXKOJDCCUYAE-UHFFFAOYSA-N 468.557 0.978 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)cc1 761736385 WPCJYNZVKMUGFN-OAHLLOKOSA-N 463.516 0.787 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c1C 768750358 XBPBOELYVIOYPA-TUTDSIAXSA-N 457.487 0.625 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cc(S(N)(=O)=O)ccc2F)cc1OC 825151042 PJRSUNFHVHATKG-UHFFFAOYSA-N 455.420 0.108 50 20 JCGD O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)[C@H]1COc2ccccc2O1 913416476 FJQCDYFTKMOUGK-OAHLLOKOSA-N 470.301 0.715 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)N3CCCC3)c2)c2ccccc2c1=O 914602719 NEQJSBAPBCLIKC-UHFFFAOYSA-N 473.486 0.932 50 20 JCGD COc1ccc(C=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1OCc1cccnc1 915048809 KMTITWXTOFBBMX-UHFFFAOYSA-N 470.511 0.704 50 20 JCGD C[C@H]1CCCC[C@@]12NC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C2=O 915789007 AKQPSDAHACGZFW-XTZNXHDOSA-N 471.923 0.249 50 20 JCGD C[C@@H]1CN(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C[C@@H](C)O1 916250200 WNQCRBVCOFUKTK-IAGOWNOFSA-N 467.592 0.914 50 20 JCGD O=C(COc1ccccc1[N+](=O)[O-])NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1 916295866 XKRBKEZXMONXKK-UHFFFAOYSA-N 471.879 0.936 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CN1CCCCC1=O)N(S(C)(=O)=O)CC2 920436491 OYINUMPJENCPRX-MRXNPFEDSA-N 482.559 0.113 50 20 JCGD COc1ccc(S(=O)(=O)CCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1 1248403903 OVYZWTUUYGPGKN-UHFFFAOYSA-N 454.530 0.613 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)no1 1779120704 RGJONRQRBNGLQA-XIKOKIGWSA-N 457.325 0.574 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(Cl)c3nncn3c2)C1 1779318546 HURUMNKHEMCYOJ-VGOFRKELSA-N 491.980 0.883 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779376136 YPCCKTUJRMVLCQ-MHDHIAOQSA-N 499.568 0.568 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1780327509 YPFVZCOOYWYGMG-NRFANRHFSA-N 459.695 0.181 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1781229554 ISYVWQIAIDDFAW-IRXDYDNUSA-N 456.392 0.478 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781333230 FFNFSRGNHDOJOQ-SUMWQHHRSA-N 475.340 0.412 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)N1CCOCC1)C2 1781901266 KAQFNPBUTBLUKW-FXRXJOCMSA-N 462.385 0.324 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1782974609 JQNFMTIOTALJQK-QHCPKHFHSA-N 472.734 0.715 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783934722 LDOCIXYHFACDID-OAQYLSRUSA-N 463.491 0.425 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc(O)c3ccn(C)c13)CCO2 1783934846 IGCMINUNUHNPQJ-QFIPXVFZSA-N 458.519 0.095 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C[C@@H]2C[C@@H]21 1784104481 UOXSENMKLCBZTA-GOMYCMKKSA-N 471.982 0.964 50 20 JCGD CCOC(=O)N(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)Cc1ccco1 1784302416 KEKIKCGAOFDQQA-OXQOHEQNSA-N 457.911 0.668 50 20 JCGD CC(C)c1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)no1 1785210910 KTBGTTISWFIDIX-JQFCIGGWSA-N 471.518 0.028 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(C)(C)NCCC#N)[C@H]2C1 1786858231 MXRJPGBXEZNXBU-WSGMMUAFSA-N 471.562 0.382 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3Cl)C[C@@H]21)c1cccc(B(O)O)c1 1786984432 LQRPECVRWLZSOM-JVPBZIDWSA-N 482.733 0.755 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4cc(Cl)ccn34)C[C@@H]21)c1cccc(B(O)O)c1 1786984618 WBQFBROGABYUQS-QSFXBCCZSA-N 482.733 0.575 50 20 JCGD CC(C)(C)c1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cn1 1787784832 BAGRZDZCIZYTMQ-QRFRQXIXSA-N 466.347 0.361 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CC3(F)F)[C@H]2C1)NC(=O)NCc1ccccc1 1788128969 FKHFGFJLSQEMKN-VJANTYMQSA-N 479.528 0.968 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cc(C)on3)[C@H]2C1 1788671311 ADGULGGOQYVRTF-AYDFFVQHSA-N 471.352 0.866 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(Cl)cccc4n3)C[C@@H]21 1791290814 AKRWXRCUBIOVPB-ZOBUZTSGSA-N 476.965 0.954 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl 1793116695 QWHAYBHXCKEISG-XFIYOXNOSA-N 496.026 0.552 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794383979 BODLDLUMIQVGKH-YSHSJQKQSA-N 495.540 0.765 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1nccn(Cc2ccc(F)cc2)c1=O 1794406427 FGTHATOFZNFLFH-MVJTYMMSSA-N 478.908 0.234 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccnc1OCC1CC1 1794448089 YZLWOKMXCDTSOS-CWPLJXCYSA-N 480.525 0.386 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnnc1 1794671795 GXRXOSJWHNOPGM-CCWDJLKJSA-N 455.427 0.827 50 20 JCGD Cc1ccc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)ccc2n1 1795734497 QTSCNPAUVGLZPK-JHDGKUDLSA-N 459.311 0.740 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2c(Cl)cccn12 1796064974 WVTPRWSBCBKZFG-IVWMJMPLSA-N 483.916 0.503 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1ccccc1)C2 1796444499 WHVOUPSBMNRFBK-GTVZHTDVSA-N 494.552 0.529 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(-c2ccc(Cl)cc2)[nH]n1 1798672651 SMVWXPLJOHVSGI-FAQVEIGNSA-N 494.744 0.927 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC1(OC)CN(C(=O)OC(C)(C)C)C1)C2 1800977774 FRSGYTJQWDNXJX-DFGXFYAUSA-N 489.997 0.856 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)C(=O)C1 1802188703 PEGVURHLPYBJMP-YWVIFJGQSA-N 493.388 0.459 50 20 JCGD Nc1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cs1 1807233781 ZNOGFINJNLBVOI-YJBOKZPZSA-N 451.317 0.434 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365107 VTJPMGOZYNWZAX-CVDCTZTESA-N 473.342 0.928 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2Cc3ccccc3CN2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365509 XMIDOEKLFMNYDQ-CAOCKLPOSA-N 484.365 0.796 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)NC=O)[C@@H]1c1cccnc1 1808362296 WVDRWLMLHUQOCG-KGFIZNRPSA-N 453.503 0.356 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cc4n(n3)CCNC4=O)C2)CC1 1808818328 MPELDLWKDSQARU-JVWAILMASA-N 494.556 0.605 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1810490308 STHKZEXKHZDPAB-AUSIDOKSSA-N 497.600 0.761 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1 1810640961 XJAVDXDIDPCLQI-ACJLOTCBSA-N 479.457 0.345 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(C(N)=O)cc2)[C@H]1c1cccnc1 1813738122 NWPDPAAJZQIJRN-GHTZIAJQSA-N 487.520 0.812 50 20 JCGD O=C(CSc1ncccn1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1815627683 DHLKOIURXZOTOT-AWEZNQCLSA-N 469.357 0.631 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](C)CC(N)=O)CC2 1817275771 CRIWSJWVYBWUTO-OVHQJAKWSA-N 459.532 0.701 50 20 JCGD Cc1nn(C)c(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1F 1817471101 RRSGYXIWYZYRDN-MRXNPFEDSA-N 454.271 0.890 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)C1=O 1817472162 LWJALZHGYHJEIZ-GOSISDBHSA-N 487.281 0.844 50 20 JCGD COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCNC4=O)sc2C1 1818916073 HKMZRFSHHLCHHY-QWRGUYRKSA-N 466.951 0.953 50 20 JCGD O=C(CCc1ccc(O)nn1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1821637402 IVLDGPSAMBKDDP-GOSISDBHSA-N 464.291 0.524 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1829093717 NMXBKGNXKILPKC-DNVCBOLYSA-N 456.547 0.609 50 20 JCGD O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731791 MOSODOKKOCVFFG-OXQOHEQNSA-N 469.878 0.199 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c[nH]c1C 1830940864 CYPJCEWZNHWDDQ-JTSKRJEESA-N 485.965 0.489 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898256 IHCANRHELJFDIL-GOSISDBHSA-N 489.428 0.460 50 20 JCGD Cc1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)s1 1833147381 HHMGFWWNJRNFRW-JOCHJYFZSA-N 488.570 0.071 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1 1833264704 IGSAWEVHFVLMSV-ZDUSSCGKSA-N 472.384 0.141 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccnc3OC)CCO2)C1 1833508099 BEPHCJPICKUXEI-SCLBCKFNSA-N 457.325 0.729 50 20 JCGD Cc1cccnc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833575130 IFDAXIJMZKRYQY-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)COc3cccnc3)CC2)CC1 1833758568 WNNOPMQXDFDJHG-UHFFFAOYSA-N 481.557 0.344 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)c3ccccn3)CC2)CC1 1834725763 HWXMYNDMBIQCOV-QFIPXVFZSA-N 459.595 0.026 50 20 JCGD CN1CCc2cc(C(=O)NC3CCN(C4CCN(C(=O)c5cccc(B(O)O)c5)CC4)CC3)ccc21 1835381154 RVQPUJXPIQUAJN-UHFFFAOYSA-N 490.413 0.858 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccc(Cl)cc4[nH]3)C2)C1 1835933569 BZXVRWVMNWKEDB-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nccc3occc13)CCO2 1836291629 BOGKSFXOHJVESF-HSZRJFAPSA-N 480.481 0.210 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)CCO2 1836687540 LOOJIXSFRJRREX-AWRGLXIESA-N 496.004 0.598 50 20 JCGD CCOc1ccccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460089 UCTRBUNECNENKP-DEOSSOPVSA-N 483.525 0.468 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920810 HQHZAOMQTBDJNF-SFHVURJKSA-N 481.358 0.841 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2)C1 1839145033 RCXDOCLDXIBXPO-ZOCZFRKYSA-N 477.986 1.000 50 20 JCGD CN(C)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839197843 JTTBEVZRDOHFSH-YJBOKZPZSA-N 459.316 0.908 50 20 JCGD Cn1ncc(Br)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201414 XEQVDKRMEZVCEQ-DOMZBBRYSA-N 498.147 0.943 50 20 JCGD COc1ccccc1CC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839954172 VIOFIMRODDNYPD-RPUKTSEFSA-N 497.552 0.828 50 20 JCGD CCc1[nH]nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1Cl 1840184123 UDXMCYMCHFAWIU-FQEVSTJZSA-N 470.958 0.069 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3ccccc3F)C2)C1 1840185052 KKGYMFBOCBGLJG-QHCPKHFHSA-N 464.538 0.588 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1 1840187238 OSEKXOYPAHHKCX-SFHVURJKSA-N 465.355 0.964 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc(F)c1F 1840705655 ZVZONJDWAXKERM-QFIPXVFZSA-N 468.501 0.716 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843013936 GMCPYZKLQOTJRW-HSZRJFAPSA-N 475.326 0.533 50 20 JCGD CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1843322300 NQZGEJKYKDOBLD-SFHVURJKSA-N 491.419 0.830 50 20 JCGD CCOC(=O)N(CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)Cc1ccco1 1846530357 WBFGDNSGADYWIA-UHFFFAOYSA-N 469.303 0.435 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CCN1C(=O)OC(C)(C)C 1847157505 WPOGXKHXWDKYHY-LPHOPBHVSA-N 471.363 0.829 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](O)CCl)C1 1847565514 SQGZGCOZCDIVBZ-UTQGOSHXSA-N 457.955 0.812 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)CCc2c(C)nc(N3CCOCC3)[nH]c2=O)cc1OC 10287589 VWAWFCUHOODJBF-UHFFFAOYSA-N 459.503 0.716 50 20 JCGD O=C(NNS(=O)(=O)c1ccc2c(c1)CCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1 104796147 FGOMXHXFIAJLBH-UHFFFAOYSA-N 467.525 0.266 50 20 JCGD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)c3cnccn3)cc2)C1 728261116 XRVANIYTGFQFJJ-ZIAGYGMSSA-N 453.546 0.767 50 20 JCGD CC[C@H]1Nc2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cc2NC1=O 729717661 IFOPTNMFPBCPQH-ACJLOTCBSA-N 454.439 0.973 50 20 JCGD O=C(NCCCN1C(=O)CNC1=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 731118778 VKHUBURWQQSGHS-UHFFFAOYSA-N 477.481 0.331 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1)C(=O)N1CCCC1 748344165 XOAUXXHOXZOUGV-UHFFFAOYSA-N 460.468 0.600 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(-n2cnnn2)cc1 748464576 FVOODYRHAMYHLH-UHFFFAOYSA-N 463.502 0.345 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)n1 761045930 SRCNXBRKUMJRIY-UHFFFAOYSA-N 476.536 0.816 50 20 JCGD O=C(NNC(=O)[C@@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1csc(N2CCOCC2)n1 892845710 FSSOUZWDRXFHKV-HOCLYGCPSA-N 479.559 0.723 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1 912764873 DSPHFBQETGFIJU-UHFFFAOYSA-N 464.456 0.886 50 20 JCGD COCCNS(=O)(=O)c1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1 913055130 IKDNJFKWHGIOCS-UHFFFAOYSA-N 489.598 0.585 50 20 JCGD CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1 913445798 PXGLDBBZCKJURO-UHFFFAOYSA-N 460.541 0.815 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1 913500041 FHWIXRLJGIMECT-IAGOWNOFSA-N 464.544 0.328 50 20 JCGD CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1 916383967 YEBHDLNKUMREHQ-UHFFFAOYSA-N 480.635 0.733 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1C(=O)O 917721664 CGNXIGFCTDABEM-UHFFFAOYSA-N 483.524 0.801 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)COc2ccccc2F)CC1 918002251 XEOPIWBNJVYMTK-UHFFFAOYSA-N 453.471 0.614 50 20 JCGD Cc1cc(/C=C(\C#N)C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1C[C@H]1CCCO1 920290097 FFJGZSIQMVHGQX-ZFKGOZSASA-N 462.572 0.953 50 20 JCGD COC(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)c1 921017607 OZZSMMUXBAMWBL-WTKPLQERSA-N 488.482 0.489 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1 1779035279 CRWOJTZIHZWLGA-DEOSSOPVSA-N 481.509 0.537 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1O 1779037091 NKTPWPOTTXAPNQ-QHCPKHFHSA-N 482.497 0.106 50 20 JCGD COc1ccc2[nH]cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)c2n1 1780031239 DKWWTSCZLGOVHQ-CJFMBICVSA-N 492.341 0.693 50 20 JCGD CCCOc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1780836466 KYBZODAJIGEMKH-XMMPIXPASA-N 452.316 0.913 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cccc4nscc34)C2)C1 1782414446 LCYDXNGZEUVWPA-QFIPXVFZSA-N 451.313 0.733 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)C1 1784080291 BZTYLBGDIPNHMK-HHHYNPJLSA-N 487.557 0.689 50 20 JCGD CN1CCN(C2(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCBr)[C@H]4C3)CC2)CC1 1786408920 LQDSHFUWUWKWMX-ULQDDVLXSA-N 457.413 0.531 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)c4ccccc4o3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978828 ZYKVCKRAEJPVON-NVVBAYIOSA-N 476.294 0.380 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786980880 CFHGMMMOIGVTPN-QRFRQXIXSA-N 491.313 0.027 50 20 JCGD C[C@@H](C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1)[C@@H]1SC(=N)NC1=O 1788143958 ZOBQIEZISDRODL-ACJLOTCBSA-N 480.355 0.917 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc[nH]3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724636 GBRGPELVPXYYDJ-BVSLBCMMSA-N 497.600 0.668 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3C[C@H]3F)[C@H]2C1)NC(=O)NCc1ccccc1 1789793148 QCNHNMLFMQSHRF-FSGKZVOOSA-N 461.538 0.670 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1792129486 VHPVZWXFJIRWBX-XSLAGTTESA-N 483.610 0.642 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1792206495 JJWQOCHMBLAQGJ-NYVOZVTQSA-N 476.342 0.469 50 20 JCGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc(Cl)cc1[N+](=O)[O-] 1795736234 PHFSWTHUJHCOTJ-YVWYUNDQSA-N 487.705 0.753 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1COc3ccccc3O1)C2 1796439555 KVFBXSFTGVAJOH-XNUXWRHASA-N 481.509 0.550 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2cccnn12 1798500446 KSWULFDCIBTSJS-LKQDWFRTSA-N 464.320 0.466 50 20 JCGD CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1csc2c1c(=O)n(C)c(=O)n2C 1799064578 RFPLDZMXSWRDPS-KRXQYRFLSA-N 497.017 0.838 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnc(Cl)nc1 1802295214 AFYUBCXDWNJSAK-QFBILLFUSA-N 465.706 0.838 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1804183429 NTHXSZBTNCSTNJ-MRRJBJDNSA-N 466.336 0.670 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H](N)c2ccccn2)[C@@H]1c1cccnc1 1807170886 XHSJUDCMYDOSKA-HBGVWJBISA-N 474.525 0.495 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C[C@@H](N)c2cccnc2)[C@@H]1c1cccnc1 1807267591 RZXBKVFKGQBBMP-REHUZNOOSA-N 467.574 0.946 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366287 YEJCHOHLUFVVKP-PZJWPPBQSA-N 463.347 0.363 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375036 MHNGWYFKNTZSIV-GCJKJVERSA-N 470.298 0.438 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1 1807375087 LHEPZPTVXFLDKS-REWPJTCUSA-N 487.325 0.748 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807376685 XEUKDCRSRMJLIE-PBEJRMEISA-N 462.319 0.009 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807377284 ZZBFCAABCTWNNT-YLJYHZDGSA-N 486.297 0.143 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1 1807412539 HVFYCQVORTYLNF-MGPUTAFESA-N 482.932 0.950 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1 1808323597 NMPOFVIYTZDJDG-QLBJFCOMSA-N 484.365 0.796 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1808714853 HYNWVUCWQLBUOY-AZUAARDMSA-N 462.319 0.567 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)ccn1 1808918892 RANFDDVXLWZTCP-NZQKXSOJSA-N 487.325 0.748 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1 1809863531 YNQFREGSVVXWLO-HRAATJIYSA-N 490.524 0.693 50 20 JCGD Cn1ccc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810303691 UUTXJIZLSKOLJU-IERDGZPVSA-N 462.514 0.376 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1812348753 PINYIKHGASLSFG-LTMIRXACSA-N 495.584 0.674 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CSCC(=O)O)[C@@H]1c1cccnc1 1813085940 FJGUCFYTVOCXDE-LIRRHRJNSA-N 472.527 0.218 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1 1814795242 IVDNQEFLMJVIMA-MJBXVCDLSA-N 459.931 0.887 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347630 HTRLNNXCTDMLPU-KBXCAEBGSA-N 492.366 0.867 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350373 TUXXJOYNFFVKFY-HNNXBMFYSA-N 458.349 0.211 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361933 UXQXTLSHSPOEHF-JOYOIKCWSA-N 452.139 0.832 50 20 JCGD O=C1CCc2ccc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3ccc(B(O)O)cc3)CC4)nc2N1 1816663055 RGVLLRZVVZIJSZ-OAHLLOKOSA-N 491.338 0.642 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3ncn(-c4ccccc4)n3)sc2C1)c1cccc(B(O)O)c1 1817490357 GMINTNXLPHFIOB-INIZCTEOSA-N 488.338 0.943 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc2nncn2c1 1819175226 KDZINUUUWWUNAZ-HNNXBMFYSA-N 462.300 0.405 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1819828674 QZSVXJXYIDUOBB-SWLSCSKDSA-N 466.332 0.339 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1821659832 HGPJRZQGEFVCEG-YWZLYKJASA-N 490.329 0.609 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnc2c(c1)CCNCC2 1821701426 VSPPGINOBPQZBG-QFIPXVFZSA-N 488.357 0.792 50 20 JCGD COCCn1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)n1 1827824764 GJDHSPRJZRTXHX-JOCHJYFZSA-N 468.363 0.756 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)nc3sccn23)CC1 1829561563 OGWWWUHSAPXFQU-IBGZPJMESA-N 494.382 0.983 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc[nH]n3)CCO2)C1 1831763549 FNGXQKBHUCXPKC-NRFANRHFSA-N 473.442 0.627 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832246428 FOZBXQZCXGNPAR-QMTHXVAHSA-N 493.248 0.829 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc[n+]([O-])cc3)C2)C1 1832549474 QKHJNFMFBXRENS-HTAPYJJXSA-N 498.964 0.522 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n1 1832768918 FIONLFNZBLVRMY-KUHUBIRLSA-N 456.337 0.873 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(F)s3)CCO2)C1 1833216343 WWSNXOFLCRZMLO-HXUWFJFHSA-N 463.491 0.270 50 20 JCGD CC(C)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1834734930 LMBZHVUVLGXSSP-QHCPKHFHSA-N 461.563 0.445 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc(O)n1 1834799978 KSQUBTGJBBQUGW-UHFFFAOYSA-N 466.347 0.274 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccc(F)cc3)CC2)CC1)c1cccc(B(O)O)c1 1834801237 VLVLRHVHQDXPSX-UHFFFAOYSA-N 467.350 0.933 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1 1834826582 RBBBSZSADJIKMG-OAQYLSRUSA-N 482.375 0.966 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1 1835738349 YOCKLEIICWLMCC-UHFFFAOYSA-N 457.362 0.674 50 20 JCGD Cc1ccc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3ccc(B(O)O)cc3)CCO4)ccc2n1 1835930600 PASQBSJCIWGLAS-AREMUKBSSA-N 489.337 0.607 50 20 JCGD O=C([C@@H]1CN(Cc2ccccc2)CCO1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1836687586 MHUTUSGEBPMLFR-CNNODRBYSA-N 469.941 0.878 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnncc3C(=O)O)CC2)CC1 1838394173 ZLHZCKMRPVQLSO-UHFFFAOYSA-N 497.512 0.099 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1 1838621629 NEZXVILZQXCFFR-OALUTQOASA-N 491.633 0.759 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(C(F)(F)F)c1)CCO2 1838935739 LDPHGQMUIDXSNW-JOCHJYFZSA-N 492.259 0.769 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC3)C2)C1)NC(=O)NCc1ccccc1 1839054225 MGNIWRAEHXQMNM-XMMPIXPASA-N 473.574 0.589 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1839144489 BQAQCVILMDUOJN-KSFYIVLOSA-N 464.950 0.814 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1 1839477157 ZQKCPGOKYPZOMV-OXQOHEQNSA-N 492.953 0.553 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839652273 WHNRCYIZRAHRJR-RTBURBONSA-N 461.346 0.808 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1F)CCO2)NC(=O)NCc1ccccc1 1839770567 FVBVSVQKSIIDMH-YDHSSHFGSA-N 477.537 0.147 50 20 JCGD O=C(COCCO)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802130 MOVCTRLXNRJODJ-GHTZIAJQSA-N 485.375 0.458 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)cc1 1840185605 SVDRXRWBBYPJJN-DEOSSOPVSA-N 460.575 0.757 50 20 JCGD O=C(CC1Cc2ccccc2C1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840931705 XSWKNBVIYLAKSF-AREMUKBSSA-N 478.354 0.242 50 20 JCGD Cc1noc(CC(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)n1 1843059771 WLFHTKOTIVZSMJ-UHFFFAOYSA-N 455.519 0.470 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)ccc12 1843124524 BKBYEZQNRSZFOQ-UHFFFAOYSA-N 491.508 0.640 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)s1 1845000314 OWDQUVDKMCKRMQ-UHFFFAOYSA-N 457.512 0.593 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@@H](O)c1ccco1)C2)NC(=O)NCc1ccccc1 1845038186 BTRGRVFEMJVANF-FQEVSTJZSA-N 455.515 0.863 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038267 LEEXIUPJWLQOEK-KRWDZBQOSA-N 458.563 0.451 50 20 JCGD CCCCn1c(CCC(=O)NNC(=O)C(=O)NC2CC2)nc2cc(S(=O)(=O)N(C)C)ccc21 9889510 LLQWINWKTWWSAK-UHFFFAOYSA-N 478.575 0.445 50 20 JCGD CC(C)n1nc(C(=O)NNS(=O)(=O)c2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 18995343 VLGZKYNMDCFCJI-UHFFFAOYSA-N 465.513 0.248 50 20 JCGD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)[C@H]3COc4ccccc4O3)C2=O)cc1 21191025 IKLCYTMZANPYEF-VGSWGCGISA-N 454.439 0.450 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)COc3ccccc3F)cnc21 727098904 JQFQUBRZTQLETD-UHFFFAOYSA-N 453.228 0.258 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cccc(C#N)c3)c2)CC1 728827114 IGZHFVODTNXIJY-UHFFFAOYSA-N 455.496 0.486 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2nnnn2-c2ccccc2)c1 730673566 XNVNVHMRKZGEDC-UHFFFAOYSA-N 472.531 0.837 50 20 JCGD C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)C1=O 748569436 SSFNDXACXUHOGC-HXUWFJFHSA-N 475.505 0.738 50 20 JCGD Cc1nc(S(=O)(=O)NCC(=O)OCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)cn1C 750617977 BOTJMCZTMINVPO-UHFFFAOYSA-N 458.500 0.441 50 20 JCGD O=C(CNC(=O)c1cccs1)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 751280206 PQIQVQWBKJGTNV-UHFFFAOYSA-N 472.570 0.272 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)cc1OC 785980775 NJTMFGMMEQRHIC-MCMMXHMISA-N 476.486 0.509 50 20 JCGD COC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 912522400 RUNWKOZAMDIXFW-UHFFFAOYSA-N 482.478 0.578 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3ccccc3)C2)c2ccccc2c1=O 915190910 RWFVGAKXMBHPKD-HNNXBMFYSA-N 469.523 0.795 50 20 JCGD COc1cc(CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1OCC(=O)N(C)C 916641617 XTDLXASFBKYVSV-LJQANCHMSA-N 458.471 0.833 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1 918001989 KZXCXHVXAZTWQJ-UHFFFAOYSA-N 467.511 0.764 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 918540568 JWBWQEBJCUHGAI-GOSISDBHSA-N 486.616 0.826 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)CCc2nc3c(O)nc(=O)n(C)c3[nH]2)c2ccccc2c1=O 920275346 UPIQXDDKPXCJTH-UHFFFAOYSA-N 494.512 0.656 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H](C(C)C)N2C[C@H](C)O[C@H](C)C2)cc1 921203005 OLRVUEOIXGOLIF-FUHIMQAGSA-N 454.593 0.897 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCSCC2)c1 921281207 NEBDEPPZOVIBJK-UHFFFAOYSA-N 489.622 0.964 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1nnsc1C1CC1 1778292063 RJWPBIXPTMEULQ-VGOFRKELSA-N 470.360 0.537 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)C#Cc3ccc(Cl)cc3)CCO2)C1 1779028279 BLLWLMNNFHJYLU-HSZRJFAPSA-N 467.913 0.834 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2 1779034042 JOOBMVDPFUISFJ-YKSBVNFPSA-N 465.510 0.522 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097726 GORZOAGVAFBTGE-PEBXRYMYSA-N 491.501 0.671 50 20 JCGD COc1cccc(OC)c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1780308842 FHUXIDXSOAHSFK-PXDATVDWSA-N 482.342 0.825 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)nc3cccnn13)C2)[C@@H](F)Br 1780773504 FZFSFBHLGARKEA-VVFCZOMOSA-N 482.310 0.908 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1780891931 HCQPREWQJAGVRY-RUZDIDTESA-N 490.325 0.493 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@](C)(O)CN1C(=O)OC(C)(C)C)CCO2 1783878696 IUSZQZMFOAKLPQ-RZTYQLBFSA-N 489.997 0.831 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CC(=O)N(Cc4cccs4)C3)C[C@@H]21)[C@@H](O)CCl 1784086094 SSDQQWRZOSLJFD-YFUQURRKSA-N 469.991 0.676 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784093651 CYRQIZYSTHEQSN-VIQHNZTISA-N 459.971 0.965 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1785287031 VLCCDEYLGWCLRG-CRAIPNDOSA-N 465.355 0.787 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(F)c1 1785738212 XTBRBDPAVUGHKK-IWEFOYFVSA-N 472.477 0.135 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4ccc(Cl)cc4n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979898 YEMZLJIGSIIWDR-QSFXBCCZSA-N 482.733 0.575 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cnc4ccccc43)C[C@@H]21)c1ccc(B(O)O)cc1 1786983711 RBLACOAJYVGXEA-JLMWRMLUSA-N 462.315 0.010 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4ncccc34)C[C@@H]21)c1cccc(B(O)O)c1 1786985268 XKKVPFIRWXRPKS-NDXORKPFSA-N 460.299 0.217 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)[C@H]3CCCS3(=O)=O)CCC2)cc1)c1cccc(B(O)O)c1 1788149316 JAQFBPIIHKGXDW-LJQANCHMSA-N 456.329 0.691 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)nc4cccnn34)[C@H]2C1 1789201463 LNMVMBWKBMCDAA-YXWQFLTLSA-N 478.347 0.856 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1789220730 IASHTYGFGVBUAI-RPZXMPESSA-N 469.878 0.713 50 20 JCGD CC[C@@H](C)[C@H](N)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726697 NMJYOLFXSFJURS-JJSQAQTOSA-N 488.633 0.686 50 20 JCGD O=C(NC1(c2ccc(NC(=O)[C@@H]3CCCS3(=O)=O)cc2)CCC1)c1ccc(B(O)O)cc1 1791179233 ZWKBEQPGBJTJSI-IBGZPJMESA-N 456.329 0.691 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c(O)cc3O)C[C@@H]21 1791293711 CYILLIYNCLMGGR-YEWDVWPNSA-N 468.938 0.718 50 20 JCGD COc1ccc(F)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791953651 RCCRMOFFMOSMPU-GMVOTWDCSA-N 471.489 0.740 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1c(Cl)cncc1Cl 1792408616 GLPJHAISKCQGLN-IVWMJMPLSA-N 464.114 0.585 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792984232 ZVIAZQZJBSPPJP-DBWAAGBOSA-N 459.971 0.869 50 20 JCGD Cc1oc2cc(O)ccc2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795738858 IMPBMIOBHAWJOZ-MFKICJERSA-N 464.283 0.644 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccccc1)C2 1796440296 KMWQWLFUQYAFSS-CUCMZJRUSA-N 467.526 0.927 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccc2n1 1796777485 DTPOFGFZDKSUAL-VTEUUUEMSA-N 461.482 0.145 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1OCC1CC1)C2 1797749545 DGQNUSGLQOXNOB-CWPLJXCYSA-N 480.525 0.386 50 20 JCGD CCC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCOCCOCCOC 1800847994 QYLCXIIKTQAKDC-DMUMMCEESA-N 464.987 0.680 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]13C[C@@H](CO1)N(C(=O)OC(C)(C)C)C3)C2 1800977096 ILUNZWUIDIHDQJ-UNPPPGBBSA-N 487.981 0.608 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1CCN(C(=O)OC(C)(C)C)C1 1801140246 UONWWVSEVTWJKC-AYMMHLMVSA-N 495.621 0.596 50 20 JCGD COC(=O)[C@H]1CCC[C@@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)C1 1802258052 PEBOGUBUVXMDHQ-BPKGMFCQSA-N 457.531 0.916 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@@H](CNC(=O)C(F)(F)C(F)F)[C@H]1c1cccnc1 1804007042 OLJRAZRMLVMFBS-GOEBONIOSA-N 453.201 0.981 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364843 GYOLPUXSLLNITC-HYBUGGRVSA-N 484.325 0.366 50 20 JCGD COc1nccnc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365129 XDWPIAJSIFJETG-PXNSSMCTSA-N 461.287 0.193 50 20 JCGD N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366440 ZEESQVGKBULGQB-VQIMIIECSA-N 455.349 0.098 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2cscn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371691 XWWHHGDTUZXWLC-LAUBAEHRSA-N 450.329 0.780 50 20 JCGD Cn1nc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c2c1CCC2 1807374817 JORCSCYCMCCGPC-FDDCHVKYSA-N 473.342 0.617 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)COCCO)[C@@H]1c1cccnc1 1808416131 FBZWAZNIZONDOX-MFWRVWTKSA-N 456.503 0.230 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1 1810060411 PBTOBEKSLCNMHI-VGSWGCGISA-N 464.530 0.817 50 20 JCGD N#Cc1c[nH]c(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c1 1810303868 ZNPXWSYGJWLUJX-JXFKEZNVSA-N 458.482 0.913 50 20 JCGD CC(C)(C)n1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1 1811551979 GCEIZGQMKVUOSI-GHTZIAJQSA-N 476.346 0.741 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1C 1811629404 UOTDIFPANSSYSH-UWJYYQICSA-N 463.303 0.137 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1 1812393595 PICSSXZXGOUOAA-LNSITVRQSA-N 455.309 0.414 50 20 JCGD COCc1c[nH]c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1 1815343843 RSRODSNOLZFEGD-OAHLLOKOSA-N 454.317 0.837 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(O)cn1)CC2 1819795632 PQOLSAYQPVBANI-JTQLQIEISA-N 453.484 0.782 50 20 JCGD CC[C@H](O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828532278 GOEBLCZVLUTDCO-NJNPRVFISA-N 467.950 0.809 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cc2cncnc2)CC1 1828923434 KEJQEUBJCKBUIB-HXUWFJFHSA-N 451.531 0.951 50 20 JCGD COc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(OC)c1OC 1830724785 CJCRICIZBSADDG-AOMKIAJQSA-N 486.949 0.311 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1F 1830730742 DGDSKFBSPKJVFV-KKSFZXQISA-N 472.897 0.672 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCN(C(C)=O)CC3)C2)C1 1831650136 DKDJLBVWVKESTG-RXVVDRJESA-N 458.987 0.014 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C[C@H]3NC(=O)NC3=O)CC2)CC1 1833765373 VQGDZIAEBMLIKR-HUUCEWRRSA-N 472.384 0.330 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3n[nH]c(C4CC4)c3F)CC2)CC1 1835737203 WDSNZEFWMOHAKA-UHFFFAOYSA-N 498.563 0.924 50 20 JCGD Cc1scc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1C 1835929579 XBFFZDSHTBBDSJ-QFIPXVFZSA-N 458.345 0.429 50 20 JCGD O=C(c1ccc(C2CC2)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932064 LUEKMKHONOYWKJ-VWLOTQADSA-N 464.327 0.628 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)N3CCN(C)CC3)CC2)CC1 1836372900 LAGVRQIPQISHNI-XLIONFOSSA-N 458.047 0.448 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cn[nH]c3cn1)CCO2 1837197906 UTQJXYLJIVFHHS-QNBNLKTOSA-N 494.512 0.162 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)cc1 1837455662 CEXQZLHXQWVRFM-GKVSMKOHSA-N 497.552 0.567 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)nc1Cl)CCO2 1837827461 IUVGIEJYPXGRRX-HXUWFJFHSA-N 488.372 0.831 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H](O)Cc3ccccc3)CC2)CC1 1837920191 QUXSARCCEDILAT-DEOSSOPVSA-N 480.370 0.582 50 20 JCGD COc1cc(C#N)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1838584340 WUYXZNIOVLGGGD-HSZRJFAPSA-N 473.530 0.010 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCN1C(=O)OC(C)(C)C)CCO2 1839072372 XQIVRWGFKZKYNT-WHSLLNHNSA-N 475.970 0.706 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)N1CCN(C)CC1 1839103320 LUDGOGOVHBDGKQ-UXPWSPDFSA-N 465.422 0.315 50 20 JCGD N[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1cccnc1 1839199106 JMEPQNNQJDQRNY-QGPMSJSTSA-N 459.316 0.618 50 20 JCGD O=C(c1ccc2nncn2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200991 PTUYDYHWLOLGAS-RHSMWYFYSA-N 456.272 0.490 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc4c(c3)OCO4)C2)C1 1840151943 SAYNRKQUCKDDBB-HRAATJIYSA-N 454.907 0.668 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C(F)(F)F)o1 1840184256 YBHUWBYJNRWVFA-IBGZPJMESA-N 491.467 0.445 50 20 JCGD C=CCOC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841352106 WAZRTSXXHZALQL-HUUCEWRRSA-N 488.969 0.595 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCS(C)(=O)=O)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841354372 VTEDXRTYGSMJFW-UONOGXRCSA-N 481.999 0.118 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)CO2)C1 1843012466 RAXMZEPBHKCJKD-GOSISDBHSA-N 499.373 0.209 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](C)[C@H]1SC(=N)NC1=O)C2 1843416037 RVFLYIKTZCDVNG-IZMVQDNVSA-N 459.532 0.126 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cnn3c2CCC3)C1)NC(=O)NCc1ccccc1 1845626271 ITJMJGJSSNBAJL-UHFFFAOYSA-N 465.558 0.993 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)/C=C/c2cnc[nH]2)C1)NC(=O)NCc1ccccc1 1846533276 NWHVYBFSSVLBGB-CMDGGOBGSA-N 451.531 0.973 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)OCCCO2)c1cccc(S(=O)(=O)N2CCOCC2)c1 19172836 KVRLSVLLVTWBLY-UHFFFAOYSA-N 461.496 0.944 50 20 JCGD NS(=O)(=O)c1ccc(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1 22618075 BCWGXJOXJGOBQN-UHFFFAOYSA-N 494.595 0.902 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 28581015 SUFZCOKRUFYPRS-UHFFFAOYSA-N 484.575 0.702 50 20 JCGD CCCC(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 727293435 MFNGOSRFLUHZQQ-INIZCTEOSA-N 454.574 0.934 50 20 JCGD CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)cc1 729274944 HWEGPSVGUSFTOM-CYBMUJFWSA-N 484.556 0.585 50 20 JCGD O=C(Cn1ccc2ccccc21)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 729507046 CVORYMJMICAZCD-UHFFFAOYSA-N 460.472 0.858 50 20 JCGD O=C(CN1CCN(Cc2ccc(Br)cc2F)CC1)NNC(=O)[C@H]1CCS(=O)(=O)C1 729512816 RURKHLCVTDCWDC-AWEZNQCLSA-N 491.383 0.288 50 20 JCGD O=C(COC(=O)c1sccc1S(=O)(=O)C(F)F)NNC(=O)[C@H]1COc2ccccc2O1 731092564 DISAJBGYEDMKBC-LLVKDONJSA-N 476.435 0.889 50 20 JCGD O=C(O)COc1ccc(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)cc1Cl 748690646 ZGHQVFDCGACFHC-UHFFFAOYSA-N 476.920 0.720 50 20 JCGD C[C@@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 750281736 XRDAFUZAVVJXNJ-CFAJVAMVSA-N 459.455 0.081 50 20 JCGD Cc1cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)N3CCOCC3)CC2)c(C)n1C[C@H]1CCCO1 798119091 ODOZUTLGMNFOTN-ONQWYEKWSA-N 483.569 0.721 50 20 JCGD COCCN1C[C@H](C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1=O 914461169 PQDULYJLZQZUAD-QGZVFWFLSA-N 463.494 0.701 50 20 JCGD CC(=O)Nc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 916247908 SYEJRQGCWHPVLY-UHFFFAOYSA-N 475.527 0.810 50 20 JCGD COCCCCNC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 916502099 LSLMEECELINHPL-MRXNPFEDSA-N 472.564 0.710 50 20 JCGD COCCOc1ncccc1CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 916510402 IWZQOZAZIVCMMM-UHFFFAOYSA-N 479.563 0.264 50 20 JCGD O=C(NC[C@H]1CCN(C2CC2)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916577933 MQZNXBFJJCVOGZ-OAHLLOKOSA-N 451.549 0.136 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(Br)cc1Br)[C@@H]1CCS(=O)(=O)C1 917734568 RFNFHXCDWPUAAR-SSDOTTSWSA-N 476.168 0.956 50 20 JCGD O=C(NCCS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 918229938 XFTBNMJBHYETPP-UHFFFAOYSA-N 480.568 0.889 50 20 JCGD Cc1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nnn1-c1cccc(Br)c1 919887941 IQFJZIIGNUVEPM-LLVKDONJSA-N 457.310 0.469 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)C1 1778237932 PEMDIPDIQPDPAL-KOSHJBKYSA-N 487.362 0.067 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1 1778946662 MSLDVLARKRMIDF-OAQYLSRUSA-N 484.904 0.139 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3nc(-c4ccccc4)ns3)CCO2)C1 1779030871 YUONBVATZQCFST-QHCPKHFHSA-N 493.549 0.961 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccncc1F)C2 1779373121 CVOHRDYPVRIHJZ-XMSQKQJNSA-N 456.478 0.661 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1779473076 GFACVKUBVZXCFW-OUFKLWKOSA-N 486.342 0.799 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1 1779539634 HZOHMJNYTFEDMW-FRQCXROJSA-N 463.673 0.680 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(C)[nH]n2)C1 1780133212 FMOAZPNQVXXHRP-GULKHOJOSA-N 455.519 0.980 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(O)c1OC 1781826164 DARGXVURGPFEQA-QHCPKHFHSA-N 485.497 0.165 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]nnc3n1)C2 1781901180 ZCJIJMRKGQGRAU-WHWRDJHUSA-N 482.339 0.114 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nn[nH]c1C(F)(F)F)C2 1782212383 ZJJHJZVBAUXBBJ-KZULUSFZSA-N 475.472 0.324 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CNC(=O)C(F)(F)F)C1 1782236161 FCZXTSOOBHWVLY-FIXISWKDSA-N 458.275 0.962 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)CCO2 1783880452 INSJXNIYVAEWGF-MDOVXXIYSA-N 463.959 0.346 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@H](O)CN3C(=O)OCc3ccccc3)C2)C1 1785430210 QWADIAABCUZLNK-XWQURZDVSA-N 495.960 0.188 50 20 JCGD CN(C)c1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1785553883 UZECVYROGOZWBA-GKCIPKSASA-N 467.530 0.053 50 20 JCGD Cc1ncccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786980240 YSSSOBIXFHTGJP-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD COc1cc(C)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786984874 TYDZPMBPMNMGBN-HSQYWUDLSA-N 452.316 0.591 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1787469849 HZMHAYZQECIKNB-GVRJEKJASA-N 463.959 0.106 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncn(C)c3C(F)(F)F)[C@H]2C1 1787645163 UHORARVGKVCMDT-IHRRRGAJSA-N 474.484 0.405 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCN(S(C)(=O)=O)CC3)[C@H]2C1 1788109219 DISOCZYSPWFKEG-HJWJTTGWSA-N 494.452 0.669 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788779694 GGWZHSWQUHUGAT-LNMJFAINSA-N 467.530 0.174 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ccc3O)[C@H]2C1 1790265730 GAZPTBRHVYNGGV-KHDYIWLOSA-N 455.471 0.003 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C[C@@H]21 1791063810 SXAPUCHMRANYKL-OSFYFWSMSA-N 471.308 0.520 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1792116853 ZOWRQARECMPHBV-GVRJEKJASA-N 480.027 0.822 50 20 JCGD COc1ccc(COCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1 1796190540 KDIXWIWSSPTARE-WKCHPHFGSA-N 452.316 0.844 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796192771 QLGWQKGJQYPIBV-REPLKXPHSA-N 455.251 0.908 50 20 JCGD COc1cc(OC)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1798898589 OLWNTRGXDONBTK-YVWYUNDQSA-N 469.498 0.219 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CNC1=O)C2)[C@H](Br)Cc1ccccc1 1800435409 GZUJSZQEEBLGCL-YYAJDYIMSA-N 493.358 0.134 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800741520 GTLFJDWGQQRLRJ-FWEDZOCSSA-N 453.923 0.491 50 20 JCGD COC[C@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1802285322 XEEFDOJVIYULLW-PLZKBRGSSA-N 472.995 0.059 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807359906 MSIKBZXOPOOTOE-ILWGZMRPSA-N 450.348 0.565 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365990 ZWJVMIFHCPNTKV-UGKGYDQZSA-N 484.325 0.746 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C#CC2(O)CCCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374311 GYVDBGKPNJQDCP-URXFXBBRSA-N 475.354 0.780 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1810297745 DBJFSPNHUFUXOE-KKSFZXQISA-N 490.524 0.902 50 20 JCGD CCn1nc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1C 1811019596 HOLUMFLYOUGBJD-KNQAVFIVSA-N 461.331 0.920 50 20 JCGD CCOC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1812464663 GEMXZYLSVXIGNV-QUCCMNQESA-N 465.315 0.424 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1 1813326897 VPXZKPLOIKQKEK-LBUQITIBSA-N 488.552 0.928 50 20 JCGD Cc1cnn(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)c1 1815759398 PSXYOCDBGLEZOU-LBPRGKRZSA-N 454.516 0.573 50 20 JCGD CCC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816668578 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Cn1ccc(CC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)n1 1827138191 AHNOKHBWQOXMJO-FQEVSTJZSA-N 453.547 0.895 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cnn3ncccc23)CC1 1827524960 LIESICMIFIHHCZ-NRFANRHFSA-N 461.331 0.956 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828938962 HNXZVLUHXNSUBV-LAUBAEHRSA-N 465.363 0.890 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](N)CN)CCN2C(=O)OCc2ccccc2)C1 1829050716 SLUDGSFBMRTONV-KUDFPVQQSA-N 496.406 0.508 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1830543665 XRNNNOXNZFDBJT-BMIGLBTASA-N 484.273 0.925 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832247274 CSGDRNLNVRYFGN-ZDUSSCGKSA-N 479.221 0.583 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1833497073 WUVJAOIQLWDXNB-APPDUMDISA-N 457.281 0.028 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1833565886 WXVKNYDBBHBHDQ-GOSISDBHSA-N 480.370 0.500 50 20 JCGD Cc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1833948352 QKBJJESBFBOSRZ-NRFANRHFSA-N 459.528 0.439 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799150 PBIUHWFKIBBMLE-MRXNPFEDSA-N 475.351 0.113 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C(F)(F)F)o1 1835929264 HWTVOSXTRRVTAY-OAQYLSRUSA-N 496.247 0.670 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc[nH]c4cc3Cl)C2)C1 1835930263 GBJABDZKHHBEBM-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3Cl)C2)C1 1835931318 MNTXWLQFXJOXEW-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCCC3(F)F)C2)C1 1835934114 OLASLWWUOPCFFC-NQIIRXRSSA-N 466.290 0.262 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cc(F)c(F)cc3[nH]1)CCO2 1836800241 LIKQBIXQSNVSHR-QHCPKHFHSA-N 493.511 0.889 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1 1836873950 GWSXJOCLUITIPF-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837319030 IBVBERCAWXVRME-CABCVRRESA-N 465.252 0.785 50 20 JCGD CC(C)(C)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837456999 VGKLTMJMFIWCOE-VWLOTQADSA-N 496.568 0.761 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc43)C2)C1 1837460759 JZSXTMJJKILQRS-CJFMBICVSA-N 479.537 0.485 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837709289 XBBLRLAGFXKHBQ-IERDGZPVSA-N 489.642 0.180 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CC[C@H](N)C(N)=O)CC2)CC1 1837883203 WGLAPGDTADLKSG-CVEARBPZSA-N 461.401 0.751 50 20 JCGD COc1ccsc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838299710 PSUSIDRFBJPXNR-FQEVSTJZSA-N 454.549 0.200 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528324 RACHCBCLTMUAHA-RWAHWCJQSA-N 492.529 0.964 50 20 JCGD Cc1cc[nH]c1C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054362 VTPKZISMLMOCED-RUZDIDTESA-N 498.584 0.739 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200344 GHGVGEPTETXKLG-DWDHNRKMSA-N 488.314 0.267 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(O)cc1F)CCO2 1839316209 KDLIIWVEXGKFSH-XQQQEEOESA-N 487.488 0.735 50 20 JCGD C[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802512 ZQDBNPCEURVOQU-VPWXQRGCSA-N 455.349 0.830 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3=Cc4ccccc4NC(=O)C3)C2)C1 1840185321 KWKDKBYJBGNPPU-RUZDIDTESA-N 499.568 0.242 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CSCC(=O)O)CCO2)C1 1840193983 SBRSPDMPTDYZBI-MLGOLLRUSA-N 453.355 0.434 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1cccc1)CCO2 1840351364 VGKJSWHVIYVKFJ-YRBPKABKSA-N 470.530 0.640 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)CCO2)C1 1840771531 CJNCKWGMVXXUJR-FDDCHVKYSA-N 491.928 0.440 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840945695 BIRGAIGTMSEIST-CMBDLQSPSA-N 493.960 0.390 50 20 JCGD Cc1c(Br)c(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)nn1C 1844809897 ZXOUYGOAADOAJA-UHFFFAOYSA-N 461.125 0.302 50 20 JCGD Cc1nnc(CC(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)s1 1845038729 MBHRZAVWSGZGCW-UHFFFAOYSA-N 471.587 0.939 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)[C@H]2C1 1846161159 XUMDRQWUYCYVBA-VAMGGRTRSA-N 499.373 0.065 50 20 JCGD CC(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1846253388 SJMICXOBGYOPGR-IRXDYDNUSA-N 489.013 0.989 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CC1 1846950973 STJIIDFDIRYXDD-UHFFFAOYSA-N 469.347 0.751 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1 725902363 LRPNBYRYONQRML-AWEZNQCLSA-N 466.541 0.396 50 20 JCGD Cc1cc(=O)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)nn1-c1ccccc1[N+](=O)[O-] 728845584 MXVLBVTXSQYFAK-UHFFFAOYSA-N 478.469 0.917 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1)NNC(=O)Cc1cccnc1 728850844 CXQFDEYJMDGWCL-UHFFFAOYSA-N 493.973 0.738 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)c2ccc(C#N)cc2)c1OC 747175687 GEYWIDQWSIGUNH-UHFFFAOYSA-N 474.495 0.671 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccoc1 747185841 BKVZQKIJDVTIGB-IYCSXQJISA-N 455.514 0.434 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1)C(=O)N1CCCC1 748247394 NCQFBAGWCUCIMJ-UHFFFAOYSA-N 493.586 0.081 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCC(=O)N2CCN(c3ccccc3)CC2)c2ccccc2c1=O 749219540 BNFIACQPJWWGJD-UHFFFAOYSA-N 463.498 0.226 50 20 JCGD CCCN1CCC[C@@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 749564019 PHWAMVNEMYBZMG-LJQANCHMSA-N 452.577 0.662 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1sc(C)nc1C)c(=O)n2Cc1ccccc1 789855631 ZWXFJJCUHAFBHV-UHFFFAOYSA-N 481.538 0.962 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(NC(C)=O)cc2)c1 825776064 AZLMKEOOIPPDKD-UHFFFAOYSA-N 463.516 0.534 50 20 JCGD CN1C(=O)c2ccc(S(=O)(=O)NNC(=O)c3ccc(CSc4nncn4C)cc3)cc2C1=O 861506306 ZBRJUIURYBYMDY-UHFFFAOYSA-N 486.535 0.957 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCC(=O)N1CCN(C)CC1 916433207 GTBBVGLHVRWXJJ-CYBMUJFWSA-N 456.341 0.711 50 20 JCGD Cn1nc(C(=O)NNC(=O)NC[C@H](c2ccccc2)N2CCOCC2)c2ccccc2c1=O 916508792 DMCIPFBFWLLYDZ-LJQANCHMSA-N 450.499 0.951 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)c3nc(-c4ccccc4)n(-c4ccccc4)n3)n(C)c2n(C)c1=O 919689254 GCYJVSQLFMLLBY-UHFFFAOYSA-N 498.503 0.898 50 20 JCGD Cc1cccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)c1 919886159 QXJQAIPGPYTLEP-INIZCTEOSA-N 466.541 0.927 50 20 JCGD CN1CCN(Cc2cccc(CNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)c2)CC1 1318284654 YUIIQBSEGVDQMI-UHFFFAOYSA-N 488.614 0.829 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c2n1 1777775936 DEIGNOWRYFQDSQ-QHCPKHFHSA-N 478.513 0.102 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CCCC3)C1 1777876205 ARIYVDQADHYPEA-NTKDMRAZSA-N 481.557 0.728 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccnn1-c1ccccc1 1778396390 FOYWNMDTFMWCRJ-ZEQKJWHPSA-N 488.353 0.993 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(C(F)(F)F)nc3)CCO2)C1 1779030851 JBJUIGITDFEDQJ-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD COc1cc(OC)cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1780662167 NQFVYEAOCGMPIV-QHCPKHFHSA-N 469.498 0.460 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)C2)C1 1781938792 OHOUDQHBNQNWAB-NRFANRHFSA-N 470.442 0.056 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782786937 KFGKLKOMDWARRK-IBGZPJMESA-N 452.540 0.438 50 20 JCGD CN[C@H](CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1)C(=O)O 1783023946 RJNDUQDBDDKCRI-CSODHUTKSA-N 482.375 0.885 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CNC(=O)C3)C2)C1 1783158258 QGIGLRASRJEFLI-PJSUUKDQSA-N 458.943 0.085 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1783351785 LOGHLCBZTKHZAJ-AUUYWEPGSA-N 485.404 0.895 50 20 JCGD Cc1cc2nnc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](C)Br)C4)C3)c(C)n2n1 1783534047 DGNKWSXCTGTTRH-KZULUSFZSA-N 451.325 0.968 50 20 JCGD COc1ccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1783777894 KWECMXNMCTXEFP-HSQYWUDLSA-N 468.315 0.047 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CN(C(=O)OC(C)(C)C)CCO3)C2)C1 1785726375 ZYQMZDCSQUQZNQ-GCKMJXCFSA-N 475.970 0.706 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CCN1C(=O)OC(C)(C)C 1785741433 XESQAFWLTMSZQH-XFAGBWLFSA-N 495.621 0.835 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786820720 KEZKWRKKZSPLKE-ZXDAYAIVSA-N 488.633 0.686 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=N/O[C@H]3CCCCO3)C[C@@H]21 1787508425 IRMGKNXALKKYTP-WKXGMAPOSA-N 488.545 0.629 50 20 JCGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)nc2ccccn12 1787856757 PWWXVRKRSVFVCQ-IHPCNDPISA-N 462.315 0.230 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788196082 MCDKQVUTTLJHHQ-SSPYTLHUSA-N 478.354 0.527 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788611691 RFAYQCBJQBBFDY-XJABCFGWSA-N 481.553 0.974 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21 1788637893 IEFMVCUGSWRGDE-BXBUPLCLSA-N 477.352 0.492 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(C)n3)C[C@@H]21 1789220701 FXOFWXOWGZPBOK-OWQGQXMQSA-N 472.458 0.556 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(O)cc1 1789884807 NDYKRXNJDDHLKX-VPPRVIDZSA-N 452.316 0.469 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cnn2cccc(F)c12 1790518602 KVGNNVWMNGIHOL-QSFXBCCZSA-N 466.278 0.060 50 20 JCGD COc1ccc([C@@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1792826474 BOMFKSLMQBHSBQ-HCBXPFHNSA-N 452.316 0.382 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1ccccn1)C2 1792872203 QVFZPIJGOCOKKQ-LBKYZSNHSA-N 467.364 0.821 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)cc([N+](=O)[O-])c1OC 1792980090 LKQYUBNPUNLPCQ-FAXLKDOZSA-N 457.867 0.415 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccco1)NC(=O)NCc1ccccc1 1793931290 JHYZKASIZNNJEY-RMFSNUHRSA-N 483.525 0.398 50 20 JCGD CN(C)c1cccc(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1 1794116717 YJGSPPWLYNXYST-NUZGMZIFSA-N 451.332 0.763 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1F 1795490863 KNXAMFZBMKREPZ-GFENJXEQSA-N 490.268 0.179 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795738852 HXPJOMKAXKKYLV-OPMZPASUSA-N 460.299 0.135 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1CCCCC1)C2 1796441279 SRENZPWPNJTLDV-JBUXMVGSSA-N 458.563 0.586 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2sccn12 1798414032 HAOSGGLNENEQSV-NJBDSQKTSA-N 455.334 0.743 50 20 JCGD CN[C@@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C(=O)O 1799217949 NWVDXOPTFHWPJT-LOUJCGABSA-N 462.459 0.835 50 20 JCGD CC(C)CNC(=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799871459 HLKWCHXVKOYZDD-ACDBMABISA-N 472.590 0.743 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801015427 CIDSCPWZAFDWRO-GNXNZQSNSA-N 450.344 0.633 50 20 JCGD CSCC[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1801026797 JRNNBEIXIKZDHC-NPJQDHAYSA-N 480.027 0.822 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1 1804094278 NURPOKPYDGRPJX-CRFBAAHOSA-N 456.330 0.876 50 20 JCGD Cc1noc(C)c1CC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804244254 JLGACEDCJUDIKL-CVDCTZTESA-N 462.315 0.929 50 20 JCGD CN(C)c1cncc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1807363476 PFWJFHCVGIWWQY-XXBNENTESA-N 473.342 0.856 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807366959 IUSNXAODMJVCOL-BUVFEPMLSA-N 461.331 0.847 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)CN)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807453954 QXBXAZCEQAVWHY-DENIHFKCSA-N 453.547 0.392 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1)[C@H](F)Br 1808662615 NINODAKLAPKHRD-GDLCADMTSA-N 479.270 0.218 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1808727193 MWHLPCQCXIEXSI-MJQMVNBJSA-N 484.981 0.963 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)CC2)C1 1809980691 PDTADEWEBTYJDU-CTNGQTDRSA-N 467.375 0.612 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813072295 AFUKQPITSVBYFL-GEQKSPFYSA-N 495.584 0.674 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813074920 WTHIKFRROZLHAE-CMUXQDGESA-N 451.593 0.619 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CS(=O)(=O)N2CCCC2)n[nH]1 1818109901 HFJADHHVAVQQMH-MRXNPFEDSA-N 483.595 0.200 50 20 JCGD COc1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)n(C)n1 1819401958 YDTXAUQXZISHMZ-OAHLLOKOSA-N 467.490 0.770 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)ncn1)CC2 1819793405 MORVOTBDCAOJEY-VIFPVBQESA-N 454.472 0.177 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1819834535 OPTTWMCESRVAGA-NEPJUHHUSA-N 481.542 0.658 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccn3c(O)nnc13)CC2 1826085393 QHRGROADONMASL-LLVKDONJSA-N 472.531 0.490 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCCC[C@@H]3C3CCN(C(=O)[C@H](O)CCl)CC3)cc21 1828499709 ZTPUYMXTNHNINX-SJLPKXTDSA-N 451.955 0.850 50 20 JCGD O=C(Cn1ccnc1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828547930 BTVLVEZKJOXJCD-AUSIDOKSSA-N 489.960 0.935 50 20 JCGD C[C@H](O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551139 KCZYOXUDSPYCNP-XPIZARPCSA-N 453.923 0.419 50 20 JCGD O=C(O)c1cnncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829252107 XLUYNUWGKDTGDO-HXUWFJFHSA-N 466.303 0.402 50 20 JCGD CNC(=O)CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCN2C(=O)OCc1ccccc1 1829341125 XNZOQOYFCBMLOK-JPYJTQIMSA-N 494.976 0.828 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1830535854 UUINHHPHNGSIKT-IFXJQAMLSA-N 488.404 0.965 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830544303 UMFWDKJPRSJBKJ-XLIONFOSSA-N 495.411 0.544 50 20 JCGD CCNC(=S)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1831090706 XETIEMYGVDSFRA-IBGZPJMESA-N 460.409 0.084 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1 1831281043 FMAUSTXEOFCPAI-UXHICEINSA-N 462.377 0.177 50 20 JCGD C[C@H](Br)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1831651318 SJDOQCQVEQMIND-FZMZJTMJSA-N 466.340 0.829 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833400806 BMCPJMRHHQBBIK-FZKQIMNGSA-N 490.376 0.339 50 20 JCGD CNC(=O)CC(=O)NC1CCN(C2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)CC1 1833436410 KHHYMWBKCXBEHM-KRWDZBQOSA-N 488.029 0.826 50 20 JCGD CC(=O)NCC(=O)N1CCC(N2CCC(NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC2)CC1 1833728122 YRYBMDPVKBIBIS-SFHVURJKSA-N 488.029 0.826 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cccn(C)c3=O)CC2)CC1 1835116223 AYPSKHJCABXEIU-OGLMXYFKSA-N 495.584 0.705 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC(=O)N1)CCO2 1835128536 ZJMYHJGEOPWERQ-WCPBPTQFSA-N 474.464 0.607 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2 1835473848 AYMRANPSEILJLG-GOSISDBHSA-N 464.485 0.548 50 20 JCGD CNC(=S)NCCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1 1835743724 XAIOLGVKOOHDDB-CYBMUJFWSA-N 462.458 0.825 50 20 JCGD C[C@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccccc1 1835940164 XEYWGVREHNWKCI-KBMIEXCESA-N 466.343 0.630 50 20 JCGD O=C(Cc1ncccn1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837210290 BLCJNJDMOVFEJR-UHFFFAOYSA-N 452.320 0.011 50 20 JCGD N[C@@H](CC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccnc1 1837896699 QAMKZDVWFFSZMW-QHCPKHFHSA-N 480.374 0.464 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cccn4c(O)nnc34)CC2)CC1 1837919377 KDGNNZLFVAUERY-UHFFFAOYSA-N 493.329 0.041 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1838403745 AYABAXVTLPUZSQ-IFXJQAMLSA-N 462.385 0.419 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839200997 UTIOGHSRMQDECK-QEORTHHSSA-N 460.304 0.424 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1 1839578425 BUEIPMIKAZVBIS-JLTOFOAXSA-N 484.962 0.450 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1 1839967268 HEIVIXPFAFKNCW-TXPKVOOTSA-N 462.385 0.921 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1840033019 QRSPNFKYFHEXTI-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(S(C)(=O)=O)c3)C2)C1 1840149461 PKBXLQMPISCUOP-XLIONFOSSA-N 474.963 0.414 50 20 JCGD Cc1ncccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840182302 FYLXWRQEFCRWCA-HSZRJFAPSA-N 461.563 0.152 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C[C@@H]2C[C@@H]21 1841360177 YVNGOPZSPZYKGW-WBAXXEDZSA-N 484.557 0.900 50 20 JCGD CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843011243 IJYTXZHIIOIRNK-LJQANCHMSA-N 487.362 0.209 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1 1844263932 MEMSBKPUGIOUEM-UHFFFAOYSA-N 471.539 0.284 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039002 STCMMVRQCXJYFD-GOSISDBHSA-N 472.590 0.841 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)C2(F)CN(C(=O)OC(C)(C)C)C2)C1 1847132124 TZLSOQLDMCUVFN-UHFFFAOYSA-N 455.531 0.522 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C 1847641660 YXDTXPUSDFLEBN-RZIGVOANSA-N 490.561 0.598 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCCN(CC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)CC1 17523408 JPRJOJMXLSORCG-UHFFFAOYSA-N 480.503 0.357 50 20 JCGD COC(=O)N1CCC[C@H](NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 726717496 XZQOCPNFAKLDFN-KRWDZBQOSA-N 497.574 0.201 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(N2CCCS2(=O)=O)cc1)[C@H]1COc2ccccc2O1 726764561 IELLVHJUVMYASR-QGZVFWFLSA-N 453.498 0.376 50 20 JCGD CC1(C)COCCN1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 728401331 VWPLDKYFSYIHJA-UHFFFAOYSA-N 453.565 0.526 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CC(=O)N([C@@H]3CCS(=O)(=O)C3)C2)c1 728527486 KYMJJKJVLNUJEO-GHMZBOCLSA-N 474.333 0.254 50 20 JCGD C[C@]12CCC(=O)N1c1ccccc1C(=O)N2CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728845472 IRURDNYOBJVCKC-XMMPIXPASA-N 477.525 0.839 50 20 JCGD CCOc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1 729274945 HWEGPSVGUSFTOM-ZDUSSCGKSA-N 484.556 0.585 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc1C 729275116 LLJNOSIZWNTDEW-CYBMUJFWSA-N 484.556 0.503 50 20 JCGD Cc1nc2cc(O)nn2c(C)c1CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 729509691 ALUPAGFTGQUKAJ-UHFFFAOYSA-N 472.527 0.840 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCN(S(=O)(=O)Cc2ccccc2)C1 730490470 ZQOBCPRADCETJQ-INIZCTEOSA-N 464.569 0.867 50 20 JCGD C[C@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)C1 731220323 CESSUQDYHRUMIU-HOTGVXAUSA-N 464.592 0.531 50 20 JCGD COCCOCC(=O)NC1CCC(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)CC1 748697492 KYNVOPSZOZGQGS-UHFFFAOYSA-N 459.503 0.033 50 20 JCGD Cc1ccc2c(c1)C(=O)N(CC(=O)OCC(=O)NNC(=O)[C@@H]1COc3ccccc3O1)C2=O 804007626 OWOHHLBFOREDIL-KRWDZBQOSA-N 453.407 0.122 50 20 JCGD COc1cc(C(=O)NNC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)ccc1OC(C)C 912953174 TYEJGWYYEYGNQH-CABCVRRESA-N 453.517 0.279 50 20 JCGD COc1cc(N2C[C@@H](C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)CC2=O)cc(OC)c1OC 914280449 OPBVMCIAWFVWHF-ZDUSSCGKSA-N 495.492 0.773 50 20 JCGD CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)CC1 916237978 RDSQPDKYNGQPMO-UHFFFAOYSA-N 498.565 0.813 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(C)(C)N2CCN(C)CC2)c1 916259148 WDBQTOIRSJIQGW-UHFFFAOYSA-N 468.624 0.687 50 20 JCGD CC(=O)Nc1cccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1 916373603 KBVDYXBJYHTGTH-UHFFFAOYSA-N 461.548 0.802 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)N[C@@H](C)Cn1ccnc1)N(S(C)(=O)=O)CC2 916623409 RKMNVRKHYYIZJA-YOEHRIQHSA-N 494.574 0.568 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21 916828300 QNSZECRKTHGXOU-UHFFFAOYSA-N 468.470 0.862 50 20 JCGD C[C@@]1(NNC(=O)NCc2cccc(NC(=O)CCN3CCOCC3)c2)CCS(=O)(=O)C1 918093710 KKOKVNRVSLHUAI-HXUWFJFHSA-N 453.565 0.228 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCOCC3)cc2)c1 919790703 ZFQXVDIZMFQDAW-UHFFFAOYSA-N 461.544 0.918 50 20 JCGD CC(C)[C@@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919885473 PIBXCQQUJIBDAE-FUHWJXTLSA-N 482.584 0.660 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)C(=O)N(Cc1ccccc1)C2=O)N[C@@H]1CCS(=O)(=O)C1 919885681 QDUDOZLJOHYZRM-OAHLLOKOSA-N 456.480 0.614 50 20 JCGD NC(=O)[C@H]1CCCN(c2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)C1 1318321371 YUBZHVKZOHQSLX-SFHVURJKSA-N 451.531 0.856 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779037353 WSKOPIMHZNNURJ-WAIKUNEKSA-N 452.515 0.402 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3ncnn3c2)C1 1779170219 QXCIQHNEKXLTOT-WZONZLPQSA-N 478.513 0.169 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Nc3ccccn3)C2)C1 1779328201 VINBKUUWPHHWIW-VFIILPSSSA-N 467.530 0.846 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)Cc3cnn(C)c3)CCO2)C1 1780098442 ACAWOPGSJQBAPS-QFIPXVFZSA-N 471.470 0.940 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(O)c([N+](=O)[O-])c2)C1 1780877179 ZBWMUNZVVVBEEZ-XMSQKQJNSA-N 477.518 0.801 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2)C1 1781355424 NCCTZBDFGXOWOT-NJSLBKSFSA-N 478.384 0.875 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C1)CC2 1782986042 BBEISIYQPYRUGG-IBVKSMDESA-N 478.354 0.624 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1783448961 OFCBVTBTQAKYCW-PZPWOCDFSA-N 457.955 0.673 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1783880383 HZHQOVKPOSEEEW-AUSJPIAWSA-N 463.959 0.346 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COc3ccc(C(=O)OC)cc3)CCO2)C1 1783884880 VKZALPVEWPNZIV-UTKZUKDTSA-N 454.907 0.936 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(C(=O)N(C)C)c1)CCO2 1783938065 REWXBPBBFPVEGP-QHCPKHFHSA-N 459.547 0.205 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCC[C@@H]1NC(=O)OC(C)(C)C)CCO2 1783940751 ZXPCHWSTTFJGIE-XFAGBWLFSA-N 495.621 0.883 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])C[C@@H]21)c1ccc(B(O)O)cc1 1786983688 QIYPREDYCWLLNZ-QRFRQXIXSA-N 499.354 0.660 50 20 JCGD NC(=O)c1nccnc1C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788148017 WCVLZSGGSBZNRS-UHFFFAOYSA-N 459.271 0.317 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4cccnc4n3)[C@H]2C1 1788283682 MRYMVTWMHDDWFV-QSFXBCCZSA-N 475.509 0.535 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cnccc5C(=O)NN)[C@H]4C3)c2n1 1788610124 FDCIBLXRXWTNLS-YSSFQJQWSA-N 492.540 0.252 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1789694297 CZSNXOWWIIJVHF-IDOKYYSUSA-N 455.914 0.523 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)OCCO4)C[C@@H]21 1791290947 FTPLNMAGZBVKDT-ZWOKBUDYSA-N 460.531 0.424 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Br)cc1F 1792690586 QMPZXQJFONKOEM-HBCWATKFSA-N 491.122 0.785 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(Br)ccc3n1)C2)[C@@H](O)CCl 1792981270 IJJREUKYTZNZKY-VAECKANCSA-N 471.739 0.900 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792982983 XPGXHCQWMKIREV-JTTNIQEDSA-N 459.927 0.102 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc[nH]c3cc1F)C2)c1cccc(B(O)O)c1 1795740316 RSIATQMLGDRUAG-VPTLXERWSA-N 451.263 0.504 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CN)c1ccccc1)C2 1796440329 LKGJETYUJNFIDF-LYLAWYLISA-N 466.542 0.453 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1OCC3)C2 1796442205 VNPMZITXSACLKM-KEMUROEHSA-N 465.510 0.959 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2ccccn2n1 1796831906 IHLGMIQWNAQFJG-FFZFCVPESA-N 463.498 0.672 50 20 JCGD COc1ccc(F)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1OC 1797753897 KNQOHAMOQLJVBR-DBWKPXFBSA-N 487.488 0.358 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)nc2sccn12 1798414578 LMNPVAGYWAQTBV-FXOZFUDCSA-N 497.537 0.093 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cn1)C2)NC(=O)NCc1ccccc1 1799095025 QRXRKRFMXQWWRT-NHKMSHSESA-N 498.559 0.699 50 20 JCGD COc1cc(F)ccc1CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1802181410 KULRLJCXHOCGQB-MFKICJERSA-N 450.511 0.339 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1 1806819861 TZQBBBYAJRBKOT-SCLZEDSOSA-N 465.514 0.500 50 20 JCGD C[C@](O)(C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(F)(F)F 1807360759 CWOBKQIWROARBU-VPWXQRGCSA-N 465.237 0.394 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)ccn1 1807362432 LVVPZPDWSIDGMG-NZQKXSOJSA-N 487.325 0.748 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)c1 1807481956 MYHQODNJDTYVRB-UHFFFAOYSA-N 485.371 0.324 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1nccc2nc[nH]c12 1808132037 NVUROQSFJBJKBI-HTAPYJJXSA-N 470.298 0.666 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808417736 OLXDEWFJRCQHLR-OXZQMUTCSA-N 499.528 0.286 50 20 JCGD Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c2c1CCC2 1809358989 CBKRDWHJRKOJTA-MBSDFSHPSA-N 473.342 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1 1810302912 NYAVNHPBUBFHPJ-KXBFYZLASA-N 489.492 0.837 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1810305586 LXGSWSGBZIWWCZ-VQIMIIECSA-N 480.525 0.743 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1)c1cc(=O)nc2cccnn12 1811334453 NHSJMYCSAUDQHM-QOKNQOGYSA-N 456.890 0.404 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812715949 AXXZCEQQBMFFTB-LESCRADOSA-N 457.369 0.157 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)C1 1814861214 JULUXLIFLFKWCO-IDHHARJASA-N 468.319 0.985 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)no1 1817476155 HTPDQGBHWJRLJO-GOSISDBHSA-N 480.290 0.122 50 20 JCGD Cc1cc(C(=O)NCC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)no1 1819466548 QWFHUOCCTSBHBY-GOSISDBHSA-N 480.290 0.122 50 20 JCGD CN1CCN(C2(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)[nH]n3)CC2)CC1 1820794708 FSPPZJDLTMCTGB-HXUWFJFHSA-N 480.378 0.175 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1 1822416796 PZADSDNTEFOPED-GFCCVEGCSA-N 461.445 0.453 50 20 JCGD C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825640556 AXNYLLRPHVMIHG-JOYOIKCWSA-N 452.139 0.832 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CCc3nc[nH]c3C1)CC2 1826092298 YGKUZSCYPFHKGJ-CHWSQXEVSA-N 459.576 0.956 50 20 JCGD Cn1cc(CCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1 1827090677 NPHHEWNGRVUBBR-QFIPXVFZSA-N 452.364 0.966 50 20 JCGD O=C([C@@H]1C=CCN1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551144 KLUPYIJOLGJKDH-SFYKDHMMSA-N 476.961 0.566 50 20 JCGD Cn1ccc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)n1 1828926276 CJTVHLNVFALICL-HXUWFJFHSA-N 453.547 0.895 50 20 JCGD O=C(C(Cl)Cl)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCN2C(=O)OCc1ccccc1 1829206342 RAFXMGULUJNUQW-HOIFWPIMSA-N 499.395 0.965 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)N3C[C@H]4C[C@H]4C3)C2)C1 1830539766 IQHOJUYFRMCRAS-QOSLBHJFSA-N 458.397 0.814 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CCO2 1830574135 ZUMOEZCNBBAZGD-CKFHNAJUSA-N 494.383 0.112 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1830668159 SAEJKMYAVGAZSG-PMACEKPBSA-N 489.378 0.443 50 20 JCGD O=C(C1CCN(Cc2ccccn2)CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726305 QAGNBSJFAJRWCB-NZQKXSOJSA-N 480.993 0.350 50 20 JCGD O=C(c1ccnc(Br)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731486 LUNZJHVXMNFJNX-SUMWQHHRSA-N 462.728 0.514 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CC1 1830737732 GTWINJSZNAAYRZ-VGSWGCGISA-N 487.981 0.610 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1831139331 QOJMHCFJXYYLBS-HRAATJIYSA-N 473.954 0.220 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1833957630 RTBWACYNLGTTQH-NRFANRHFSA-N 459.528 0.439 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1coc(Cl)n1 1833984751 HPFZBDAUMDXCRK-UHFFFAOYSA-N 460.727 0.507 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4c(s3)CCC4)CCO2)C1 1834544940 BXLZDRQESZVFGH-QHCPKHFHSA-N 485.566 0.619 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CCC1)CCO2)NC(=O)NCc1ccccc1 1834636609 KMFOMSZFLCHMOV-XMMPIXPASA-N 473.574 0.589 50 20 JCGD CC(C)c1nc(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)no1 1834797429 KKRYNYDUXHXGBE-UHFFFAOYSA-N 483.378 0.301 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnc(Cl)nc3)CC2)CC1 1835734684 PMPTUTKBMOVZDX-UHFFFAOYSA-N 486.964 0.628 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836128269 HPPDUILXQDADSX-RTBURBONSA-N 462.330 0.702 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837319792 HTDMBMNPNQXRSL-YGRLFVJLSA-N 461.231 0.332 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ncsc3[nH]1)CCO2 1837751292 HXDWHHAOFZDHDC-RVWJGDDESA-N 499.553 0.828 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(N(C)C)nc1)CCO2 1838196030 YDIOMRBIZQDGMG-VNSNFZHPSA-N 497.556 0.352 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1839150866 ZYXCGFVFRDVGOZ-IRXDYDNUSA-N 464.306 0.484 50 20 JCGD CC(=O)NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839744153 RIWSJNVBZPMTPP-SCVJVIIRSA-N 476.480 0.854 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1 1839964400 QHDGGBNSPQAVNI-YWZLYKJASA-N 495.378 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(C#N)cc3)C2)C1 1840182885 KUHISIITDBTWIT-XMMPIXPASA-N 471.558 0.320 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)CCO2)C1 1840772201 GIXGYIBHGVTCKY-MGPUTAFESA-N 492.953 0.553 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840895014 AMVBGERTAIVHAV-UGSOOPFHSA-N 464.009 0.711 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1841765256 FDSUNQIHWYOIRA-MRXNPFEDSA-N 458.519 0.512 50 20 JCGD O=C(c1cn2c(Br)cccc2n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014133 BDJHBZOTQAKCBJ-UHFFFAOYSA-N 483.131 0.907 50 20 JCGD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 725904678 ACTKAWYEKMAACN-SFHVURJKSA-N 489.598 0.722 50 20 JCGD CCOC(Cn1cc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)nn1)OCC 728214431 NZVMLVCPCCZOQG-UHFFFAOYSA-N 481.579 0.370 50 20 JCGD CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)CC1 728947826 RJSUTHAWAAPIRH-UHFFFAOYSA-N 480.573 0.611 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C2CCCCC2)c1 729276295 BMIZWZLCRVFPBA-ZDUSSCGKSA-N 460.578 0.339 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)[C@H](C)N1CCOCC1 729623453 JMLXBFTZEJYNPU-HOTGVXAUSA-N 453.565 0.524 50 20 JCGD O=C(NNC(=O)N1CCOCC1)[C@@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 745988201 VMAWTOWILYYSPZ-CYBMUJFWSA-N 475.365 0.923 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H]1CCc3nccn3C1)c(=O)n2Cc1ccccc1 746307955 MHONATMZJSHXNL-QGZVFWFLSA-N 490.524 0.034 50 20 JCGD Cc1c(/C=C(\C#N)C(=O)OCC(=O)N(C[C@@H]2CCCO2)[C@@H]2CCS(=O)(=O)C2)cc(C#N)n1C 913286745 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O=C(COCCO)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783021592 CXXKBGYTHJOFQI-FXAWDEMLSA-N 455.349 0.831 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)C1 1784091778 BRCPZAMITIKEGB-VGWMRTNUSA-N 459.971 0.823 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1784196721 KGHRFLOTIQVGIL-YTFOTSKYSA-N 451.923 0.776 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cncn3)C[C@@H]21 1785076610 ZFXBFFKPMDSLSV-VGWMRTNUSA-N 470.958 0.390 50 20 JCGD CC(C)(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cn1 1786978762 RBNGJTKFEAMHBX-JBACZVJFSA-N 465.359 0.966 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1787505924 SQPBKAYGBWZXOP-PWNZVWSESA-N 470.361 0.082 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])o3)C[C@@H]21 1788607858 PFWVPMJVGSWDSP-PJODQICGSA-N 458.431 0.093 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3C[C@@H]3F)C[C@@H]21)NC(=O)NCc1ccccc1 1789726661 KMUALKZEGSBZQU-HVTWWXFQSA-N 461.538 0.670 50 20 JCGD COC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789726736 RIUJDYHMBRJLJZ-UFYCRDLUSA-N 489.573 0.266 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn4c(F)cccc4n3)[C@H]2C1 1790420860 VSPPKIUFPBFJBD-OWQGQXMQSA-N 481.488 0.379 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1 1791287149 QEDPTCRYUACUPM-FUOQNJDISA-N 462.547 0.081 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3sc4nccnc4c3N)C[C@@H]21 1791289036 CZSIMZLFZBLVRA-IHRRRGAJSA-N 475.575 0.240 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1791545125 RHZWDCRMFOOLKK-LLLHUVSDSA-N 470.368 0.222 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1793053221 SWXWIKIQUKLRGL-ZSBFGKGUSA-N 468.337 0.995 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)on1 1794779683 KDLRNHLTWWNBBQ-RMFSNUHRSA-N 470.530 0.532 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cc(F)ccc3[nH]1)C2)c1ccc(B(O)O)cc1 1795734503 PVYODBAMRRQMGA-VPTLXERWSA-N 451.263 0.504 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS[C@H]1CCCCO1)C2 1796441919 GWPLXZMOQTYYMT-NLCLCXLOSA-N 477.587 0.970 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Cc1ccccn1)C2 1796445721 HZFJJQQFUUABLK-WITPMNRCSA-N 466.542 0.984 50 20 JCGD COc1cccc(OC)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797752726 BJAKJERZRSETLP-VTEUUUEMSA-N 469.498 0.219 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCOC1)C2)NC(=O)NCc1ccccc1 1799099352 UYXLQUISQNHZTG-KEZQHZCBSA-N 473.574 0.349 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c(=O)cn1)C2)[C@@H](Br)Cc1ccccc1 1800436025 JAHMSJZDPLTNBE-RCJHGTSTSA-N 475.343 0.979 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(C(=O)OC)cc1 1802230303 PCJWWUVYJHXULR-LORHWOILSA-N 454.907 0.695 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1803016749 YCAWOKUIMGIGBZ-AYBZRNKSSA-N 471.396 0.405 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3nc(CO)[nH]c3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362910 NXVCAYCXRWKPKQ-DVECYGJZSA-N 499.336 0.763 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366032 RKFFGBJIGFPCQE-ILWGZMRPSA-N 466.347 0.386 50 20 JCGD C[C@H](O)C(=O)N1CC[C@H](CNC(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1807454042 RMXRWIGIRUKCCV-WEYGHZABSA-N 468.558 0.814 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1 1809763977 FIZGRMHNFCLEFG-KKSFZXQISA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1cccnc1 1811614712 ZNUKNWAYDLOMSX-LIRRHRJNSA-N 478.469 0.950 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)CC1 1813073964 MRXIXSNRLYOYLO-FXAWDEMLSA-N 459.547 0.804 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1CCC(O)CC1 1813194304 PKRFXFCDTBLYPG-HHKCAYGPSA-N 451.332 0.632 50 20 JCGD CCOc1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815337947 XWZRVBACXAFKAY-AWEZNQCLSA-N 467.316 0.551 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nccnc1C(N)=O)CC2 1817282132 YCLMEKNTVBIBGS-LHXNHHJWSA-N 495.525 0.392 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CCc3nc[nH]c3C2)[nH]n1)c1cccc(B(O)O)c1 1817479761 POIPSXONDAMUPD-QRWLVFNGSA-N 462.319 0.924 50 20 JCGD O=C(/C=N/N1CCCCC1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819393205 KDBOVCGEQPZGHQ-IERINAHZSA-N 452.324 0.867 50 20 JCGD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)n1ccccc1=O 1819570561 KTSFKAVDRPZIAW-HNAYVOBHSA-N 463.303 0.818 50 20 JCGD Cc1cnn([C@H](C)C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1 1826746358 YNJKLWVMZZAVHM-CJNGLKHVSA-N 453.333 0.815 50 20 JCGD COC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1829931325 FTJZNPHUUWNORW-BTYIYWSLSA-N 477.986 1.000 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)N1CCN(C)CC1 1830238252 NAUFOPLDFQVHNM-XXBNENTESA-N 470.423 0.236 50 20 JCGD O=C(/C=C\c1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832734043 QPIHMAPFGODALI-UHKPCRMSSA-N 489.337 0.631 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@H]3C[C@H]3C3CC3)CC2)CC1 1833249655 WQVCPKUOOCLFHO-PMACEKPBSA-N 454.575 0.916 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cc3cncnc3)CC2)CC1 1833860680 FOSYJHKVXCDSHW-STBIYBPSSA-N 480.573 0.725 50 20 JCGD Cc1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1834061160 XPMHFEVFLBTCNF-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3nccn3C)CC2)CC1 1834269803 WSGJPIOPUJQQHK-JVWAILMASA-N 468.562 0.739 50 20 JCGD Cc1cc(Br)cnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1834550566 KFPYZYQSOZVWQU-KSSFIOAISA-N 476.755 0.822 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C/N=C/c3ccco3)CC2)CC1)c1ccc(B(O)O)cc1 1834798511 FASLMMZVAMQEDK-WGOQTCKBSA-N 466.347 0.264 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCN3CCCC3)CC2)CC1)c1ccc(B(O)O)cc1 1834800650 VLLNUXIPOUVAPD-UHFFFAOYSA-N 456.396 0.038 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1c[nH]c2ncccc12 1835317890 JBWPWWCLCXYJRH-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD Cc1nc(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cs1 1835736959 BWSXQUDHYVPZAD-UHFFFAOYSA-N 485.614 0.878 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835933622 DRDWIWVBRROLTP-DEOSSOPVSA-N 470.306 0.127 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cccc4cccnc34)C2)C1 1835937477 ZCKUOYBSAFNBLC-RUZDIDTESA-N 475.310 0.298 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1cccs1 1837461131 OVYIXDGTXPVRLW-IVZQSRNASA-N 473.555 0.620 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920789 FJZMPIUVSGWSAK-PKTZIBPZSA-N 498.385 0.734 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CC3(O)CCC3)C2)C1 1838528408 VTOWEOGARASTPM-HSZRJFAPSA-N 491.497 0.895 50 20 JCGD COc1ccc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1839358851 UAHGWBLXBQJKLG-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD COc1c(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1C 1839392946 POOWGADHBQCXGU-RUZDIDTESA-N 482.342 0.376 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839652090 MXJDWXFESNWBJL-RDJZCZTQSA-N 461.288 0.262 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2 1839690278 CAKWTTVGNZEWRS-HXUWFJFHSA-N 479.440 0.140 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839764889 NRTYGSCRALWIEC-AVRWGWEMSA-N 484.333 0.454 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1839962609 LQHJBWBSYJNFBX-AUUYWEPGSA-N 469.336 0.424 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnn(C)c3)C2)C1 1839964126 HJSWCBGFYYOLCF-LPHOPBHVSA-N 457.369 0.983 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1 1839989204 UNZFMQNPERZHTH-FZKQIMNGSA-N 464.357 0.751 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1840033778 PSELAXWGAKCCJR-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C2)C1 1840156158 JKYOAOAERPLLAP-FDDCHVKYSA-N 491.928 0.440 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)cc(F)c3)C2)C1 1840184022 NUPJWQWRCNXKEB-JOCHJYFZSA-N 468.501 0.337 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4[nH]ncc34)C2)C1 1840184188 WRTIBXHHHWZWOK-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)c3cccc(Cl)c3)C2)C1 1840184299 YWKSFLAZZBIQTB-RBBKRZOGSA-N 481.981 0.169 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C#N)ccc3F)C2)C1 1840184786 BQCXFMJJTONADK-JOCHJYFZSA-N 461.494 0.140 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1 1841028852 GZHLNFVBCHOVEL-SIFCLUCFSA-N 459.971 0.798 50 20 JCGD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010428 OYFLBSZYRHHZCI-UHFFFAOYSA-N 457.679 0.988 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)[C@H]2CN(Cc3ccccc3)CCO2)C1 1843924148 REIZJQBXWVNLBQ-JOCHJYFZSA-N 463.343 0.084 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1845441636 LJZKJYFJSIFXJZ-ZDLGFXPLSA-N 452.471 0.272 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)Cn1cnc3c(O)nc(NC(=O)C(C)C)nc31)C2 1846364237 FFTDLZWMQYBHRE-CYBMUJFWSA-N 493.952 0.584 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O 1847437554 ZGRJHBCRJNBKPW-SYXICTDQSA-N 494.552 0.502 50 20 JCGD CCOc1ccc(-c2n[nH]c(=S)n2CCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)cc1 9931097 LFCLZRYZBOPITR-ZDUSSCGKSA-N 453.546 0.979 50 20 JCGD CS(=O)(=O)Nc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 11660589 WFBZLCLBRCIEAB-UHFFFAOYSA-N 466.541 0.917 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c2ccccc2c1=O 726283172 XQWQBLWPRPEIAP-JOCHJYFZSA-N 463.454 0.132 50 20 JCGD NC(=O)[C@@H]1CCCN(c2ccc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)C1 728959640 OLRNMONBTUZLEH-LJQANCHMSA-N 480.573 0.925 50 20 JCGD CCOC(=O)/C(C#N)=C/NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 730964542 VCHIFAHRNAKLQS-GRNBYLDVSA-N 466.516 0.544 50 20 JCGD C[C@H]1CCC[C@H](NC(=O)CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)C1 731214413 NBRTVZSAURJMOV-WMZOPIPTSA-N 460.535 0.668 50 20 JCGD NS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccccc2)sc1Br 744687785 YIHYINJNPZOGGA-UHFFFAOYSA-N 462.303 0.776 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)N3CCOCC3)ccc2Cl)C[C@@H](C)O1 745992791 KMDVNEUCMGQLMO-BETUJISGSA-N 460.940 0.825 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c1 751206188 GIPVYJJWIIXXOM-UHFFFAOYSA-N 479.584 0.086 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(Br)cc2)C[C@@H](C)O1 912920242 ZTHAAQHMVJJBMC-OKILXGFUSA-N 491.408 0.764 50 20 JCGD O=C(NCc1ccnc(N2CCOCC2)c1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 916388670 CVGFUUUXEWHFEF-UHFFFAOYSA-N 488.570 0.847 50 20 JCGD NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(Cc3ccccc3)c(=O)c3ccccc23)o1 918679403 UXMFDARWYKPFAO-UHFFFAOYSA-N 467.463 0.760 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 919692291 MCNKBFDWYXJPEA-GOSISDBHSA-N 486.616 0.826 50 20 JCGD Cc1oc2cc(O)ccc2c1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1777883381 STOOPWILBWBADC-XMMPIXPASA-N 464.283 0.884 50 20 JCGD N#Cc1ccc(F)c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779037386 ZGCLIXJGPDXCRZ-JOCHJYFZSA-N 452.446 0.453 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnncc3C(=O)O)C2)C1 1779522233 FAQXSNDJECHRNO-BTYIYWSLSA-N 497.936 0.750 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn(C)c3Cl)C2)C1 1779862812 XNAMMDAZKOKSKV-FINLKQIMSA-N 461.910 0.651 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780098036 ZBHWJZMLVGYNPO-FPTDNZKUSA-N 474.470 0.654 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967961 GCQFSWVMFXJOQM-DVECYGJZSA-N 474.606 0.503 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCCO1)CCO2)NC(=O)NCc1ccccc1 1780968333 IVRKZGDEANKVFI-AUSIDOKSSA-N 459.547 0.342 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccccc3O)C2)C1 1783236664 INHOFQVLXPUYOJ-AJPHYDNBSA-N 453.499 0.899 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(-n3ccnc3)ccn1)CCO2 1783934622 FFPAATAIXNIZHP-QFIPXVFZSA-N 455.519 0.084 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1785654659 AKJDNDRIGXOTEK-HSZRJFAPSA-N 456.279 0.200 50 20 JCGD CCn1nccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1786177556 GGYPSXMAKHCKII-GDJYOZILSA-N 455.519 0.630 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)cco3)[C@H]2C1 1786284754 VJGRBKSKCSJNGS-MZONFKNFSA-N 455.471 0.367 50 20 JCGD CN1CCN(CCC(=O)Nc2ccc(C3(NC(=O)c4cccc(B(O)O)c4)CCC3)cc2)CC1 1787909678 AWRZHOOXXVOAEE-UHFFFAOYSA-N 464.375 0.752 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]3C2)no1 1789922717 LRXLTLDMUANWNZ-CENBSLRLSA-N 461.288 0.982 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1790174795 AIPAJWXEYKWBRS-JNLQPACOSA-N 468.320 0.500 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccc(F)cn34)[C@H]2C1 1790473410 BJBQNLNXLXQYEI-IXDGSTSKSA-N 481.488 0.379 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1791434865 ZWZMDZIDRUGDKZ-RBZJEDDUSA-N 473.954 0.492 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCCC3)[C@H]2C1 1792312284 KALZNYMYABHPMA-RWRPXTCXSA-N 458.563 0.586 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(-c2ccccc2)on1 1792407044 HLRDDMWHYLEMPQ-OPMZPASUSA-N 461.283 0.538 50 20 JCGD CS(=O)(=O)c1cc(C(F)(F)F)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792979730 CZEWCFWEBCHROF-YHYOWMERSA-N 498.907 0.912 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr)NC(=O)NCc1ccccc1 1795114844 DDSLXYNSJRXCIE-XEMDLRDOSA-N 496.406 0.707 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)CC1 1795736820 ITOJHYLTPLACBQ-CEQLMSFQSA-N 499.373 0.137 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@H]3c4ccccc4S[C@H]31)C2)c1cccc(B(O)O)c1 1795738695 AJJNTOYXZLUBCC-CSXWMVMESA-N 464.352 0.458 50 20 JCGD CCN1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1796444203 DVDDHOYVMZNHHM-WCARGJHZSA-N 458.563 0.442 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1796909670 MBMOLFYBABTPCD-RZXSNQJFSA-N 472.590 0.838 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799094922 KAJILBDIRUITTA-WRHDZBKDSA-N 497.600 0.455 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(N3CCN(C)CC3)CC1)C2 1800642673 WCYABWBDWIVZPZ-YYIAUSFCSA-N 457.413 0.530 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCCNC(=O)OC(C)(C)C)C2 1800977059 GTYUDALVBZIREU-JYYAWHABSA-N 463.959 0.371 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)[C@H](O)C1 1801014417 PLSJQDDRYXPOFE-ZQNQSHIBSA-N 480.389 0.998 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1803162082 ZLHNOBOORBXQAQ-CEMLEFRQSA-N 450.348 0.565 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C(C)(C)C 1803387090 ZOFWYCDUKYFTBR-JRGCBEDISA-N 495.584 0.951 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](N)c2ccccn2)[C@H]1c1cccnc1 1807170890 XHSJUDCMYDOSKA-TYCQWZJGSA-N 474.525 0.495 50 20 JCGD CN1CCC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C1 1807367070 PUOBDLNWXKCOAP-ONTIZHBOSA-N 450.348 0.423 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807373876 DDZGMFWMFXOUME-AZUAARDMSA-N 462.319 0.567 50 20 JCGD O=C(Cc1cscn1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807487917 FNVTUCGFPIGLMZ-DYESRHJHSA-N 450.329 0.780 50 20 JCGD Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c2c1CCC2 1809364825 GTUGZJFKGJEHGW-AOMKIAJQSA-N 488.552 0.936 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCC4(CCCN(C(=O)c5cccc(B(O)O)c5)C4)CC3)nc2N1 1809977751 FVYVRKSQMRCCIJ-UHFFFAOYSA-N 476.342 0.805 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810294366 JQYVLIRRBUEBPO-YYWHXJBOSA-N 465.558 0.884 50 20 JCGD C[C@H](Cn1cncn1)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1810479853 GUSLXWLLDOBQFX-PLMTUMEDSA-N 456.551 0.388 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@H]1CCN(C(=O)c3cccc(B(O)O)c3)[C@H]1c1cccnc1)CCC2 1812224871 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Cc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cc(O)n1 1817152336 ZDJAIYQSNGCLSN-HNNXBMFYSA-N 452.301 0.772 50 20 JCGD C[C@@H](Br)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNCP(=O)(O)O)n[nH]1 1817235026 LLXVSFIGYBWSHH-MWLCHTKSSA-N 452.246 0.910 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3ncccn3n2)[nH]n1)c1ccc(B(O)O)cc1 1817471537 HXUBUAFPVNRXCC-GOSISDBHSA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)C(F)(F)F)CC2 1819799657 FFHPPQJGHGHUJY-MRVPVSSYSA-N 485.448 0.046 50 20 JCGD COC(=O)CSCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827048935 DFZLAAXSQWJYGQ-IBGZPJMESA-N 462.377 0.506 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827049094 KLLBABSCYPNQOR-OXJNMPFZSA-N 464.393 0.280 50 20 JCGD Cn1nc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)cc1O 1828925442 LTQWWWJJBCCZOU-SFHVURJKSA-N 455.519 0.671 50 20 JCGD O=C1CC(C(=O)N2CCN(C(=O)OCc3ccccc3)[C@]3(CCN(C(=O)[C@@H](F)Cl)C3)C2)=NN1 1829124290 NVRPLXIXGJTIJE-UTKZUKDTSA-N 479.896 0.849 50 20 JCGD CNc1nsnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830532975 CMLBLALYYZHOFV-BDJLRTHQSA-N 462.370 0.681 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731754 MLXGUUZJZYNPAB-BLLLJJGKSA-N 454.833 0.109 50 20 JCGD O=C(c1cnn(Cc2ccccc2)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732974 ZHSCUJKFACIBKN-SIKLNZKXSA-N 462.934 0.601 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1NC(C)=O 1830733000 ZISFJIMCTJWJJO-UWJYYQICSA-N 469.922 0.323 50 20 JCGD Cc1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)[nH]1 1832549061 DBBVWNZMHAMMET-BTYIYWSLSA-N 485.969 0.920 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(C)cn3)CCO2)C1 1832991059 JYPPFDRGNMXWTP-DYMLFOFBSA-N 496.568 0.913 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CN(C)C(=O)C(=O)O)CC2)CC1 1833264223 AZQJPEGLLFSIHG-CYBMUJFWSA-N 475.384 0.132 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(O)nc(Cl)c3)CC2)CC1)c1ccc(B(O)O)cc1 1834797475 MMMYCWFZPKQHRE-UHFFFAOYSA-N 486.765 0.619 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835116543 MGZWWIAKLWYSSW-QGZVFWFLSA-N 497.431 0.674 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cc[nH]n3)CC2)CC1 1835116740 ZHSICILJAGUHBC-CVKSISIWSA-N 454.535 0.729 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835117872 VAMQSUNDWPEIBQ-RWMQCTEASA-N 485.589 0.732 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836679981 NEXSKRAGRHZPBC-AREMUKBSSA-N 494.353 0.004 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cnn4c3CCC4)CC2)CC1 1837920023 CQDHMFAFJYYOAG-UHFFFAOYSA-N 466.347 0.435 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cn4cccnc4n3)CC2)CC1 1837920378 QSGKMMJRUNHOBF-UHFFFAOYSA-N 477.330 0.335 50 20 JCGD COc1ccnc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1OC 1837921139 DTFUFQOFJYCURI-UHFFFAOYSA-N 497.357 0.705 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921538 LBRMPJCOKQBRCU-IBGZPJMESA-N 452.744 0.232 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1 1838430128 UUEDPOOMEZMKEE-DNVCBOLYSA-N 466.336 0.973 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838527285 MDJFAPUNGFTVFR-OXJNMPFZSA-N 485.877 0.190 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCCCC3=O)C2)C1 1839155367 RTKMPNKIURZATJ-MOPGFXCFSA-N 450.363 0.692 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1839994809 GBFJYLVWSQISBL-WHTWLKBESA-N 480.326 0.158 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn1 1840032763 JRQQNMWCNSCUCV-BFUOFWGJSA-N 470.320 0.722 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1840038707 QCDXZWQSURJIAS-YVHKJVDXSA-N 489.997 0.690 50 20 JCGD COc1ccc(COCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1840252997 MDAYUYXNPOLBDW-NQIIRXRSSA-N 456.923 0.268 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)C1 1843007910 AIIKBLGBWYACPZ-ZDUSSCGKSA-N 479.925 0.367 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1 1846384103 DCTDFKZQPXHPKT-QAPCUYQASA-N 469.583 0.491 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1 1847296453 IBUOYSIXNWNZLJ-AABGKKOBSA-N 458.563 0.449 50 20 JCGD COCCCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1 727031159 MUGZZSIQTNHRMY-UHFFFAOYSA-N 467.592 0.916 50 20 JCGD Cc1ccc(NCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)c(C)c1 728205609 SFUKEFMFEIUCDY-UHFFFAOYSA-N 459.528 0.297 50 20 JCGD COc1ccc(C(=O)Nc2nc(CC(C)=NNC(=O)[C@H](C)NS(C)(=O)=O)ns2)cc1OC 728436089 CPISEMKMRQFQHI-NSHDSACASA-N 484.560 0.780 50 20 JCGD O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)C(=O)N1CCCC1 748240308 RGIFOZPGNKARBG-FQEVSTJZSA-N 463.494 0.270 50 20 JCGD COc1cccc(/C=C(/C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)n2nnnc2C)c1 817819868 PHDYPKKLJXFBBZ-ZZODWALSSA-N 494.464 0.519 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)Cn2nnc(-c3ccccc3)n2)CC1 914554843 WIBQFNFLDKVBLB-UHFFFAOYSA-N 457.520 0.637 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CCn1ccccc1=O 914870739 HTPWKHFOFWGBSU-UHFFFAOYSA-N 462.528 0.040 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)c2ccc3c(c2)OCCO3)o1 915063605 YUQZBJSJSJTEHG-AWEZNQCLSA-N 493.494 0.842 50 20 JCGD CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1 916383904 WJVSSAKAKBOYQG-UHFFFAOYSA-N 489.620 0.150 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](c2ccccc2)N2CCOCC2)c1 916509469 PEYYAQDDRRSDML-FQEVSTJZSA-N 475.571 0.954 50 20 JCGD CCCC(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 917519165 KKCDWEKHGYTIFF-QGZVFWFLSA-N 466.560 0.507 50 20 JCGD O=C(NNC(=O)/C(=C\c1ccco1)n1nnnc1-c1ccccc1)N[C@@H]1CCS(=O)(=O)C1 919889459 MMKNZHQTUPGODP-DSQDWWTGSA-N 457.472 0.449 50 20 JCGD Cc1c(NC(=O)CSCC(=O)NNC(=O)Cc2cccnc2)c(=O)n(-c2ccccc2)n1C 1321549409 FESYWDVNQKNZAU-UHFFFAOYSA-N 468.539 0.941 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4ccc(F)cc34)C2)C1 1778620959 UAUBQTGCBUPQQR-QFIPXVFZSA-N 452.251 0.139 50 20 JCGD Cn1ncc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)cccc21 1778709991 GPLMZVRGQKMBOI-RCZVLFRGSA-N 476.342 0.694 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)CCCO4)CCO2)C1 1779034833 VGCVNYLFTGDGMK-XMMPIXPASA-N 465.510 0.767 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(F)cnc1Cl 1779640066 SNAIPAONXUKAGX-XMSQKQJNSA-N 475.713 0.995 50 20 JCGD Cc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)n(C(F)F)n1 1780314037 COSPIXCOEJXEAA-HXUWFJFHSA-N 463.445 0.342 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780776903 IFNNGRLHJVRCBF-ISTRZQFTSA-N 451.337 0.564 50 20 JCGD CC(=O)C[C@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968569 NVFIATJKRVBMQO-MHECFPHRSA-N 473.574 0.778 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781171906 HXQVUXGURCDCJB-ZJSXRUAMSA-N 497.313 0.730 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(O)O)C2)[C@H](Br)Cc1ccccc1 1781681674 CZJCIPDHCFCJMA-JXXFODFXSA-N 455.349 0.817 50 20 JCGD C[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)Oc1ccccc1 1782877909 BAWXTDYKSIVIAP-UUOWRZLLSA-N 452.316 0.668 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(OC)c1 1782991649 FVIFWCFJQJMRHF-RUZDIDTESA-N 482.342 0.460 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1783354952 ZNGSQNOCUVXZKE-BZNIZROVSA-N 464.407 0.850 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)Br)C2)C1 1783540149 SIJRJDJOKKGCEH-LPHOPBHVSA-N 481.384 0.296 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1785567168 GDRKFWMAVLBWHR-HSZRJFAPSA-N 475.351 0.115 50 20 JCGD 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CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2CCN(C)CC2)C1 1778851532 GTGRGYZTVMOEGG-MBOZVWFJSA-N 459.429 0.921 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)COc3ccccc3F)CCO2)C1 1779034072 LPTCUEDCKJGBJM-QFIPXVFZSA-N 457.462 0.347 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCc1cc(F)ccn1)C2 1779371083 BPGLIAFFXFATHT-HYBUGGRVSA-N 484.532 0.980 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@H](N)c1cccnc1)C2 1779373176 KJKUIBDCTOJOBC-DCLXLUIPSA-N 481.557 0.298 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)NC[C@@]13CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C3)C2 1781593032 YFFRJDLUAUFMNV-GDEXEMPNSA-N 496.992 0.736 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)C2 1781905218 KQIYIAAPLQGCIY-VEVIJQCQSA-N 462.341 0.217 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)c1ccc(F)cc1 1784092323 HNPRDYWQOLEYLC-BHNDVYRESA-N 455.914 0.582 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccnc(C(F)F)c1 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CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)n[nH]1 1821220296 DUVVUOOHONFDNK-AUUYWEPGSA-N 481.554 0.618 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(N)=O)CC2)NC(=O)NCc1ccccc1 1822518341 LHFZTNHTNTYBPE-OAHLLOKOSA-N 487.586 0.667 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1825397302 BEHIKPWZMAMZMA-HXUWFJFHSA-N 464.331 0.407 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3cccnn3n1)CC2 1826087403 AVMMEDDFZJEWDD-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CS(C)(=O)=O)CC1 1827681544 YOEBUKKEWDDSBD-MMTNMYCKSA-N 465.576 0.785 50 20 JCGD CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1828825839 BLBNPOZBXYXRTD-VWLOTQADSA-N 479.342 0.842 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1 1829627295 WOGVGZSOFPSWGD-YLJYHZDGSA-N 455.895 0.848 50 20 JCGD CC#C[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccc(O)cc1 1830738340 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Cc1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)s1 1834061047 RGPCILAMLRJYHN-UHFFFAOYSA-N 471.587 0.949 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1834823375 QQQPRUJWAHDSNQ-AWEZNQCLSA-N 461.231 0.333 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCC4)CC2)CC1 1835737944 NPVJSCOWLKWMNC-UHFFFAOYSA-N 480.573 0.327 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)C(Cl)Cl)CC2)CC1 1835753731 BZKYBJHNIVCBIZ-INIZCTEOSA-N 466.362 0.857 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835754379 JLBQTZJRHUSLQK-DLBZAZTESA-N 494.358 0.743 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835796156 SFWAUBXWBMDTIO-SUMWQHHRSA-N 499.385 0.857 50 20 JCGD O=C(c1ccc(-c2ncc[nH]2)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835934490 VTFUSMRKOCHZPB-RUZDIDTESA-N 490.325 0.140 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4nccc-4c3Cl)C2)C1 1835935542 JXACMKDZRHOESK-QHCPKHFHSA-N 498.732 0.232 50 20 JCGD N#Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)ccc1F 1836409115 KKXXURAITHDIDC-UHFFFAOYSA-N 492.360 0.805 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3[nH]ccc3n1)CCO2 1836908528 CCFHTQWEMLLBKZ-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD O=C1NCc2cc(C(=O)N3CCC(OC4CCN(C(=O)c5ccc(B(O)O)cc5)CC4)CC3)ccc21 1837919075 BEMDNHXRTKOWQN-UHFFFAOYSA-N 491.353 0.536 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(C)ccn1C)CCO2 1838820846 XNFVNBXHTBDSPD-QADUPLGGSA-N 470.530 0.538 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2 1838862642 DWPCXXADDBGAQI-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2)N1CCN(C)CC1 1839154589 RTYXKHYLUUSNGL-VDGAXYAQSA-N 465.422 0.315 50 20 JCGD COc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c(F)c1 1839198353 YNFWMNYOIXDKML-WMLDXEAASA-N 464.263 0.990 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c([N+](=O)[O-])c1 1839232521 MPENLMYDZKMESQ-XLIONFOSSA-N 471.894 0.202 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839518977 OTWQKKAFZQPQTG-UGSOOPFHSA-N 457.325 0.519 50 20 JCGD C=C(C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)C(F)(F)F 1839893396 TZRMSRVNYVGILM-CPUXBYDOSA-N 471.436 0.695 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)N3CCN(C)CC3)C2)C1 1839966181 WUPSKJUDUNBJPW-QKLQHJQFSA-N 475.428 0.252 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)C1 1840182671 POBNJNPNNBYJBI-FHOSRQNYSA-N 479.490 0.030 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)c1cccs1 1840186032 WRINHZRWCIUMBD-IERDGZPVSA-N 452.577 0.681 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1840854809 NZQMOHUIXHNQRZ-KFKAGJAMSA-N 452.379 0.984 50 20 JCGD CCc1[nH]nc(C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)c1I 1841350491 GJWCXLBWLADVPZ-JTQLQIEISA-N 466.707 0.993 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1843902944 LULXFVLZMXTNJT-OAHLLOKOSA-N 472.546 0.759 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1n[nH]cc1I)C2 1844264553 HHRROAVZWBQRLX-UHFFFAOYSA-N 495.281 0.144 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1847133723 AHDSBELLEDLDER-YOEHRIQHSA-N 490.536 0.850 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2cc(Cl)ccc2Cl)CC1)C(=O)NC1CC1 9889421 LAYFIASKLPXBQU-UHFFFAOYSA-N 463.343 0.820 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)c1 25435017 ZURPACMETIDMDY-NRFANRHFSA-N 491.501 0.304 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)NCCC(=O)N1CCN(c2ncccn2)CC1 726710801 SPZOAPDKPGQGON-UHFFFAOYSA-N 451.491 0.116 50 20 JCGD COc1cccc(-n2c(CC(=O)NNC(=S)NCC(N)=O)csc2=NCc2ccco2)c1 727067551 NPDAWPGRTNXAEN-UHFFFAOYSA-N 474.568 0.764 50 20 JCGD CS(=O)(=O)Nc1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)ccc1F 728344947 UNMNKKOXRDXKLQ-INIZCTEOSA-N 467.431 0.341 50 20 JCGD CSC[C@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 728845081 FZBOKHMEZODGJI-IXDOHACOSA-N 474.587 0.747 50 20 JCGD O=C(CN1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1 729482948 QGUPHRKYLSENBI-MRXNPFEDSA-N 479.490 0.938 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](NS(=O)(=O)c2ccc(C)c(C)c2)[C@@H](C)O)n1 760139306 QKWTYTINESMRAT-AUUYWEPGSA-N 498.583 0.029 50 20 JCGD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=O)CNc2ccc(OC)cc2)c1 825549837 VGCIAVJTKWIGQJ-UHFFFAOYSA-N 450.517 0.801 50 20 JCGD O=C(CCNS(=O)(=O)/C=C/c1ccccc1)NNC(=O)c1csc(N2CCOCC2)n1 912851829 JLMZRUNXBIPSLF-NTUHNPAUSA-N 465.557 0.721 50 20 JCGD N#Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 913392003 SEUOSYXRYLEBMY-UHFFFAOYSA-N 470.555 0.196 50 20 JCGD COc1cc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)cc(OC)c1OC 913635943 KAOQCLWKCVRTLS-UHFFFAOYSA-N 463.491 0.911 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(S(N)(=O)=O)s2)c1 915188161 DEFFCRDHWLZHGA-UHFFFAOYSA-N 474.586 0.430 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(C#N)cc2)cc1 916649759 SJIDNFOKFRZUNY-UHFFFAOYSA-N 461.500 0.392 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCS(=O)(=O)N2CCCC2)c1 917392347 ZUSCAJQWQAVLNR-UHFFFAOYSA-N 474.605 0.684 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(Cl)ccc4c3OCO4)C2)C1 1777802339 IOQLVBSQXMGCDV-JOCHJYFZSA-N 487.900 0.825 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(F)cn1C)CCO2)NC(=O)NCc1ccccc1 1780968589 NZMCQRGAFBCFNR-XMMPIXPASA-N 486.548 0.954 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nc1 1780970950 QPPLAIINAWHDCM-HSZRJFAPSA-N 461.563 0.750 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1782037946 KJRIDOVKIABLRK-DEOSSOPVSA-N 481.509 0.619 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)C1 1782210543 YYCDWOMZQFKUKU-YTSMVRMISA-N 466.579 0.463 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)COc3ccccc3F)C2)C1 1783358729 VQFYTUPNLAXYRE-JOCHJYFZSA-N 457.462 0.347 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1783533121 QXEOLFCGQMWFGP-QFYYESIMSA-N 461.338 0.065 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1n[nH]c3cc(Cl)ccc13)CCO2 1783934716 KXUCAUDARGDFNS-QFIPXVFZSA-N 476.965 0.962 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@]1(F)CCN(C(=O)OC(C)(C)C)C1)CCO2 1783935086 NQISZRXEMSBMLU-XZOQPEGZSA-N 499.584 0.538 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2 1783937124 PNNUHDGJHWXQPM-ZUOKHONESA-N 486.495 0.346 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)NC(=O)c3ccccc3)C2)C1 1785555361 CHSCWQCMUWBJKA-ROXQBCMVSA-N 494.552 0.769 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncccn3)[C@H]2C1)NC(=O)NCc1ccccc1 1786111407 LQJZMYVQCBKZBY-UFYCRDLUSA-N 481.557 0.416 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(Cl)cccc4n3)C[C@@H]21 1788610110 DVJUTOMVZKBPSL-OWQGQXMQSA-N 497.943 0.893 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1ccc(-n2c(O)nnc2O)cc1 1789273358 HPMUOIIHHGJUQS-MXAVVETBSA-N 498.309 0.962 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791292225 IRIDSUPODUCSSA-QRFRQXIXSA-N 464.538 0.730 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1792255381 KDUKMZXWOYREBJ-WOYTXXSLSA-N 457.955 0.482 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(Cl)c(F)c1 1792754464 IGJKCHNQYSOFLX-VTEUUUEMSA-N 475.908 0.924 50 20 JCGD COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1OC 1793657467 PNMQIMIIVSLFFF-NHKMSHSESA-N 482.342 0.220 50 20 JCGD COc1ccc(C(=O)CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1795139366 YSRLJIGBIRDZFK-GPVSGQMNSA-N 495.536 0.560 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)n(-c2ccccc2)n1 1797750805 RAXWSRPRNJBBBP-FAQVEIGNSA-N 489.536 0.696 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccccc1F)C2 1797754272 PKLMGGCZFHFYAE-VPTLXERWSA-N 455.490 0.660 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn(Cc2ccccc2)c1 1798150525 KQFMDCJEQXMWHT-JHDGKUDLSA-N 468.558 0.508 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2)c1c[nH]c(=O)cn1 1798636310 IFRQDYNEMNGOLV-YYAJDYIMSA-N 475.343 0.979 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2 1800643570 XRAPMPDDINPEKW-KBRXKUPHSA-N 464.357 0.593 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1800710370 FUPQWGDJBMCDQF-QKQGURCUSA-N 477.961 0.915 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)[S@](=O)c1ccccc1 1801012654 DNZRHUBVTRYPTM-PJWGTFSHSA-N 464.588 0.145 50 20 JCGD COc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1C 1801651383 UTJMILBNSCRDKJ-YVWYUNDQSA-N 453.499 0.519 50 20 JCGD CC[C@H](Br)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCS(=O)(=O)CC1)C2 1801799533 SLUQEWUILBZNAZ-XGUBFFRZSA-N 450.399 0.529 50 20 JCGD C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)CCC(N)=O)[C@@H]1c1cccnc1 1803009096 RASGTDRGJRJXQW-JJAZEVLHSA-N 454.369 0.711 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803147035 SIFMNBOBBSBLAN-HBFSDRIKSA-N 457.955 0.757 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)COc2cccnc2)[C@@H]1c1cccnc1 1804336858 DPLXNBFHKHLQTE-VGSWGCGISA-N 475.509 0.874 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(O)cn2)[C@@H]1c1cccnc1 1806106807 LOKZDAURSJBZEN-QRWLVFNGSA-N 461.482 0.814 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(=O)oc2)[C@@H]1c1cccnc1 1806120457 OVZOVQMCMCZJQP-YWZLYKJASA-N 462.466 0.667 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCSCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807367412 ZHIOBCKJUXTUAD-KNQAVFIVSA-N 468.388 0.130 50 20 JCGD COc1ncccc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807369629 QMSXUSSDYILPQR-WIYYLYMNSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CNC(=O)c2ccco2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371390 TWAPPMRGVMQDOR-PGRDOPGGSA-N 476.298 0.104 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cc2ccc3ncnn3c2)[C@H]1c1cccnc1 1807416447 FQUULKVENWGQCM-NTKDMRAZSA-N 478.557 0.746 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)n(C)n2)[C@H]1c1cccnc1 1808413382 AGOLICAOVZBYDJ-RMFAIBCQSA-N 478.513 0.974 50 20 JCGD C[C@H](C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1)n1ccccc1=O 1809971006 IDMNGVAJFJDNAM-GOSISDBHSA-N 451.332 0.634 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n(C)n1 1810297883 FUWZPCUDUHVQDZ-QRWLVFNGSA-N 478.513 0.456 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1 1810485052 BLFOIFGVGDVHRX-LNLFQRSKSA-N 461.950 0.988 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1810540906 HAHWHEAOHLWDKE-RDTXWAMCSA-N 470.566 0.379 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)no1 1813331569 HHNNCXWFGTVDNH-KKSFZXQISA-N 463.498 0.939 50 20 JCGD CC(=O)N[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(C)(C)C 1815335815 SIHICPICEMEILA-QAPCUYQASA-N 472.376 0.600 50 20 JCGD Cn1ccc(=O)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360898 QLWZSIXIJVJPGU-CQSZACIVSA-N 452.301 0.061 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](N)c2ccccn2)n[nH]1 1817336735 OYWCCRFJNDMUFA-IEBWSBKVSA-N 463.502 0.809 50 20 JCGD O=C(CSc1ncccn1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1817592971 WXGVBQBYIGFZKC-QGZVFWFLSA-N 466.332 0.978 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1nc(O)n2c1CCCC2 1819629803 YZZRTPNFKPNGCB-KRWDZBQOSA-N 478.318 0.948 50 20 JCGD Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c(=O)[nH]c1C 1819793510 OSEYYDHTJOLCKR-LLVKDONJSA-N 482.526 0.381 50 20 JCGD O=C(Cc1ccc2ncnn2c1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1822496119 JJUKLASEZVLOEI-MRXNPFEDSA-N 476.327 0.334 50 20 JCGD C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(CCO)CCO)CC2 1822870198 URVLJXTYBNQBQK-DIFFPNOSSA-N 453.392 0.578 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)N1C(=O)OC(C)(C)C 1829640427 ZDOYIACZZQIVIJ-FSTVOOFJSA-N 489.997 0.831 50 20 JCGD C/C(=C\c1cccs1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1829706641 RGLMPRZQKRXEKF-BRBKRDGESA-N 464.588 0.981 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)NNc1ccccc1)CCO2 1829815124 VIIPPDSEWPGLTI-PLMTUMEDSA-N 454.955 0.702 50 20 JCGD O=C(CCCc1ccccc1F)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830693397 BAHZAOYXKBRYGK-RUZDIDTESA-N 484.333 0.598 50 20 JCGD CN(CC(=O)N1CCC(N2CCC(NC(=O)C(=O)C3CC3)CC2)CC1)NC(=O)NCc1ccccc1 1833279782 HPNPYTLZRJSMMX-UHFFFAOYSA-N 498.628 0.883 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1 1835837067 QETWJQHTUFYFLN-SFHVURJKSA-N 458.632 0.474 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1nc(O)n2c1CCCC2 1835852301 RPRMLNBDDJGKBV-UHFFFAOYSA-N 495.389 0.104 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(F)cc3F)C2)C1 1835931629 UHDXYVOWZFCHMB-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)no1 1837546350 WYOFPHAAAHOMRP-BFUOFWGJSA-N 487.351 0.200 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)ccn1)CCO2 1837867154 FTAKDYBGCDQIBZ-HXUWFJFHSA-N 453.927 0.178 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921539 LBRMPJCOKQBRCU-LJQANCHMSA-N 452.744 0.232 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C)nc1C)CCO2 1838359191 DKMFNGOWWUTDRD-BYEYKRMRSA-N 482.541 0.902 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC3)C2)C1)NC(=O)NCc1ccccc1 1839054681 IYFINFDELLBHGF-QHCPKHFHSA-N 459.547 0.199 50 20 JCGD O=C(c1n[nH]c2c(Cl)cccc12)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839495313 XGQMLZKDJPWXFC-LIRRHRJNSA-N 457.314 0.886 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1onc3ccccc13)CCO2 1839547923 VYQWLSKYMLYZDZ-QFIPXVFZSA-N 459.503 0.271 50 20 JCGD Cn1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)cn1 1840463410 HTIYZLXOQCMITO-HTAPYJJXSA-N 499.996 0.551 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1840789908 IYDHJHLPQGEBIP-LPHOPBHVSA-N 495.381 0.413 50 20 JCGD O=C(Cc1ccc(Br)cn1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013392 DBIHLBSTRLXDIB-UHFFFAOYSA-N 458.121 0.584 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 10791128 ZTRHDPKDHDOHBJ-KRWDZBQOSA-N 463.468 0.081 50 20 JCGD COC(=O)c1sccc1S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 28778815 ZJUOXDLOPCDRTR-UHFFFAOYSA-N 461.543 0.473 50 20 JCGD COc1ccccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 104761918 YITCLXYGTKOFDI-UHFFFAOYSA-N 455.514 0.339 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)c1 728206224 CJFXXEWWDKOEDU-UHFFFAOYSA-N 475.571 0.569 50 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COC(=O)Nc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 912975075 XFWPDSPTVVKLIB-UHFFFAOYSA-N 462.484 0.961 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccco1)c(=O)n2Cc1ccccc1 916333106 DEJNBLSTDCKTKP-UHFFFAOYSA-N 450.455 0.798 50 20 JCGD CCNC(=O)NNC(=O)Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O 916526381 FYHTUHUYLBNXAA-UHFFFAOYSA-N 475.509 0.807 50 20 JCGD CNS(=O)(=O)c1ccc([C@H](C)NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 919779263 OPPBRCPHGZCHHI-LBPRGKRZSA-N 482.588 0.901 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c2)cc1 920297957 UZIGRZSDRDGSFV-GFCCVEGCSA-N 470.529 0.195 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1778344682 AVGDZYLXWINAAX-OSAWLIQMSA-N 459.971 0.919 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)[C@@H](O)C1 1778360507 GFPHVYWTMUNUBE-AERDPVEMSA-N 489.997 0.424 50 20 JCGD Cn1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c2cccnc21 1779186194 GLBHKAGNUYPNIE-PXDATVDWSA-N 476.342 0.694 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1779534166 ZQGTXBFYVQHHJN-JZVDBHTCSA-N 472.546 0.325 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccc4)no3)C2)C1 1779578339 YOYISHUOETWUTH-XMMPIXPASA-N 461.283 0.779 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc[n+]([O-])cc3)C2)C1 1779884528 SKLROGLZHUPPNV-QFIPXVFZSA-N 470.438 0.911 50 20 JCGD O=C1Nc2ccccc2Cn2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc21 1779985509 MHOBWLJVBYFBFP-GCJKJVERSA-N 473.917 0.540 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782007569 UHLZAUBWZOMHEX-NRFANRHFSA-N 475.889 0.507 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncc(S(C)(=O)=O)c1)C2 1782170895 FDTYSYRUTNJPKE-MBOZVWFJSA-N 473.979 0.866 50 20 JCGD Cc1ncc(/C=C/C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)s1 1782666405 OAVDVHXVHJFAGZ-SJUPYBQOSA-N 469.372 0.972 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)[S@](=O)c1ccccc1 1782682463 XMKHENBHZANUIY-RPKDZRGRSA-N 470.356 0.006 50 20 JCGD CN(C)C(=O)NCC(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1782862783 ZWPVFPBGCCDFSI-KYIYGJGQSA-N 461.469 0.973 50 20 JCGD Cc1cn(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](F)Br)C3)c(=O)nc1O 1783116353 LNQSEUQFKDPXLU-UVBSCNOISA-N 475.315 0.462 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)CCO2 1783939916 NGPCUVSKCDLRMQ-OAQYLSRUSA-N 485.557 0.148 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Cc3cnc[nH]3)NC(=O)OC(C)(C)C)C2)C1 1784313529 CQIZDWNJFKWLGJ-JLHGSKIFSA-N 499.996 0.929 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1OC 1786983771 ZUJAABDBUWNCNH-PTLVVNQVSA-N 496.369 0.610 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3ccco3)[C@H]2C1 1787081750 IDVSHPKNULHIPX-TVHLAIKQSA-N 484.513 0.123 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(OCF)cn3)C[C@@H]21 1787508921 STHONXMKUAKRRM-AYZFKNHXSA-N 487.492 0.510 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(-n4cncn4)c3)C[C@@H]21 1788609928 TWQXJZHDHQJUCN-NDXORKPFSA-N 490.524 0.173 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccccn4)[nH]n3)[C@H]2C1 1788949699 UMICRBYOCDDBSM-FTRWYGJKSA-N 469.546 0.438 50 20 JCGD CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3csc4c3c(=O)n(C)c(=O)n4C)C[C@@H]21 1789866488 LHLXJCJTAFLXQJ-HNKHHVNMSA-N 497.017 0.838 50 20 JCGD CCC1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)COC1 1790743834 AQPZVHGCLXNZRZ-ACRUOGEOSA-N 487.601 0.739 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)O2)C1 1792972506 SCWXLFHSBRQXQV-NNXHMXCWSA-N 487.981 0.344 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793117683 YFOVLVUZRVFXRF-QRJUGERDSA-N 490.001 0.566 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS(=O)(=O)c1ccc(C)cc1 1795323721 KUBXZOHPNNPOQI-LORHWOILSA-N 458.964 0.612 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cc([N+](=O)[O-])cc2c1OCC2 1796188535 RMDIRWOKOULFMX-BCDXTJNWSA-N 465.271 0.775 50 20 JCGD CCc1c(Br)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)nn1C 1796189226 MMRFKMXZVUASPD-MUJYYYPQSA-N 489.179 0.990 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc(N(C)C)c1)C2 1796439439 DQRPYOHVXFYAOF-QBNJWTLUSA-N 496.568 0.855 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(C(F)(F)F)n1 1798085698 PUBMYDDKIDDPMM-DPIQGUFMSA-N 478.431 0.616 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccc1O)C2)NC(=O)NCc1ccccc1 1799097073 ATBJHQUNNMVZKD-GQEURGSBSA-N 495.580 0.871 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)C(Cl)Cl)CC1 1801020992 BQUVDIIZGJUEPQ-MIFYACCESA-N 479.405 0.932 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H](O)CN2)[C@H]1c1cccnc1 1804241363 LZOWLUCVYHLHBP-VMXHOPILSA-N 496.008 0.942 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1807119722 DKOXCNGSMZVFJB-XWTMOSNGSA-N 483.997 0.929 50 20 JCGD CN1CCC[C@H](C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C1 1807367076 PUOBDLNWXKCOAP-URVUXULASA-N 450.348 0.423 50 20 JCGD CN(C)c1cncc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)c1 1809974863 COHMBWGLNMVQSK-UHFFFAOYSA-N 450.348 0.986 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810309570 SCANXAMOCNZOBE-LPHOPBHVSA-N 482.541 0.989 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCc3nc[nH]c3C1)CC2)c1ccc(B(O)O)cc1 1815347553 CZPIBQCNSRKKCS-HIFRSBDPSA-N 465.344 0.577 50 20 JCGD Cc1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c(=O)[nH]c1C 1815354902 HTJSDGASVNUZKJ-AWEZNQCLSA-N 467.316 0.063 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCN(C(C)=O)CC2)n[nH]1 1818967752 YLFHIZZNRCIVOI-DOTOQJQBSA-N 454.959 0.820 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc2n(n1)CCCNC2=O 1818974256 MSSZRTGAIMYPHF-GOSISDBHSA-N 491.317 0.039 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnncc3C(=O)O)sc2C1 1820497798 IRIGQDVZUAHRKG-PCMXRQBPSA-N 496.509 0.991 50 20 JCGD C[C@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)N1CCOCC1)CC2 1822867357 FDRCIAFVDQQBOR-VMDBXTETSA-N 451.376 0.942 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)N[C@H]1CCc2nc(NC(=O)C(Cl)Cl)sc2C1 1826092935 BXVBUQLPTFLUMI-VIFPVBQESA-N 455.389 0.589 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828521226 WYMRXDWSQVWWFP-BTYIYWSLSA-N 498.374 0.780 50 20 JCGD COC(OC)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828562571 HDOSCPOWUJHEKQ-HTAPYJJXSA-N 483.949 0.657 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2CCOC2=O)CC1 1828923296 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O=C(NC1CCN(C2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1)c1ccc(B(O)O)cc1 1834798288 CMQABCMMIHBHRY-UHFFFAOYSA-N 469.307 0.102 50 20 JCGD COc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834800206 YWYPAMQOVIWDME-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCCSC3)CC2)CC1)c1cccc(B(O)O)c1 1834801548 WBCBJPSPRNAMQP-GOSISDBHSA-N 459.421 0.695 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cnccc1F 1834938986 BHDNNYIZRWGGAY-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc(O)n1 1835086395 FHNLQDWRPDNFAM-UHFFFAOYSA-N 466.347 0.274 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)[nH]3)CC2)CC1 1835964123 PNRRGIIETOIUKW-MZJWZYIUSA-N 470.534 0.435 50 20 JCGD CCc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1Cl 1836232487 SZUUYENGYHOARM-FQEVSTJZSA-N 470.958 0.069 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)nc1 1836714881 AEBZGABJRORHFS-GOSISDBHSA-N 473.979 0.697 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1836723709 PSYOMKCWTHVPKR-VFNWGFHPSA-N 475.970 0.300 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1 1837020593 UCQRGBLRUDOLFE-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CNC(=O)c3cccs3)CC2)CC1 1837178841 LPMTVBSWSKEXHA-UHFFFAOYSA-N 493.630 0.850 50 20 JCGD C[C@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC1 1837461232 QFMXCTAPPNNXQU-SEPYTNNBSA-N 459.547 0.581 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1 1837710465 ZJZICVNACVVSGW-OAQYLSRUSA-N 464.595 0.962 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1 1838012130 KHQPPYGCUFRRDE-IERDGZPVSA-N 463.922 0.796 50 20 JCGD CCOc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1838884346 URQPHNZIRIZEAS-DEOSSOPVSA-N 468.315 0.149 50 20 JCGD O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839045412 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CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4cccn4)cc3)C2)C1 1840185457 QRPCLMITPLNYTN-XMMPIXPASA-N 484.557 0.315 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(CN(C(=O)CC3CCC3)CCO2)C1)NC(=O)NCc1ccccc1 1840848797 PTLSXPIFEFYLPE-VWLOTQADSA-N 487.601 0.979 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCSC1)CCO2 1840862963 PXFOZZXQIUWUOR-KTUMRIBQSA-N 477.587 0.720 50 20 JCGD C[S@](=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1841232196 ABLIEVJPUQGIGC-PWNDQGHQSA-N 466.000 0.451 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)C(C)(F)F)C1 1842842683 LHDWHXRQWOYULP-KRWDZBQOSA-N 495.332 0.661 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)c1ccccc1 12177120 KVBPAXALMLGKNA-UHFFFAOYSA-N 475.401 0.868 50 20 JCGD C=CCNC(=S)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 725908554 HBCPPTKFFXMHSB-CYBMUJFWSA-N 469.010 0.103 50 20 JCGD Cc1noc2ncc(S(=O)(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)cc12 726764786 OALXGZDXSXXRBB-UHFFFAOYSA-N 465.513 0.939 50 20 JCGD C[C@@H](NC(=O)NNC(=O)CNC(=O)c1cccs1)c1cccc(S(=O)(=O)N(C)C)c1 727610438 QVKJRRMFOWGFKH-GFCCVEGCSA-N 453.546 0.820 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1 728203506 KHKAIWAPRWUDBN-RHSMWYFYSA-N 463.516 0.415 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1csc(-c2cccc(Br)c2)n1 730767158 HHTDHWJVCJWYHY-QMMMGPOBSA-N 483.391 0.820 50 20 JCGD CCn1c(CCC(=O)NNC(=O)N2CCOCC2)nc2cc(S(=O)(=O)N(C)C)ccc21 745991947 MUQVKDAGLYZWON-UHFFFAOYSA-N 452.537 0.312 50 20 JCGD COC(=O)c1ccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c(C)c1 747691853 JEYOZSLHOLYPOO-UHFFFAOYSA-N 469.541 0.720 50 20 JCGD CNS(=O)(=O)c1ccc(Cl)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 787810680 KQVQPPOOPIBNSM-MRXNPFEDSA-N 483.886 0.392 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1 912848169 LSZJZKSQEDTDEM-UHFFFAOYSA-N 481.556 0.230 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)NC2CCCC2)c1)c1ccc(-n2cnnn2)cc1 914406150 PWMBAEUSFBHGEM-UHFFFAOYSA-N 455.500 0.958 50 20 JCGD Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)COc2ccccc2Cc2ccccc2)cn1 915635794 PGBDUNMPCQNCFI-UHFFFAOYSA-N 457.512 0.516 50 20 JCGD CCN(CC)CCNC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 915879474 ZPABWIJTYZWRMA-QGZVFWFLSA-N 485.607 0.625 50 20 JCGD CCCCS(=O)(=O)N1CCC(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)CC1 919362469 XBNXIXRYTPDBFH-UHFFFAOYSA-N 470.504 0.741 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1778075853 HYGPQWYVJDIQNB-ODCFSMADSA-N 463.934 0.764 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc4[nH]ccc4s3)CCO2)C1 1779032400 QLBVCJHTCMCQRB-NRFANRHFSA-N 454.512 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(F)c(F)cc3F)CCO2)C1 1779037306 VIPCTOYMSTVHHX-NRFANRHFSA-N 463.416 0.860 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1779520361 NAKRDQXQBFUJLV-BMKBHAAASA-N 488.589 0.939 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1780199890 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CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1792452927 XVIYAWBCYKMHQQ-WHDKQWSOSA-N 489.997 0.184 50 20 JCGD O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3=O)C2 1795115601 BMMPXOSOHAIPNK-QHBPRCKVSA-N 450.289 0.810 50 20 JCGD CC(C)(C)C(=O)Nc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1 1795736957 PWVUHBTYFADCCF-HATOLVCRSA-N 493.369 0.868 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc2nnc(Br)n2c1 1796189200 JRAJQQDEODGVAO-BJWYYQGGSA-N 498.146 0.737 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796189229 MVGTVPOBMXSGMK-YRPNKDGESA-N 487.362 0.254 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](N)c1cccnc1)C2 1796440632 WBBGJFYKTJHBDQ-LIFSWNFGSA-N 467.530 0.195 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncccn3n1)C2 1796441973 LHBNJHVQTYKKTN-DHMDNZFNSA-N 464.486 0.067 50 20 JCGD 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0.172 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)NCCCCN2CCN(c3ncccn3)CC2)cc1 729614534 JCMUHRWQDFORNF-UHFFFAOYSA-N 452.519 0.660 50 20 JCGD CN(C)C(=O)CN1C(=O)C(=NNC(=O)N[C@H]2CCS(=O)(=O)C2)c2cc(Br)ccc21 750936192 OKGPARZOITWXKK-NSHDSACASA-N 486.348 0.074 50 20 JCGD Cc1c(/C=C(\C#N)C(=O)OCC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)cc(C#N)n1C 912659966 RADLMBIEZHAGRU-VCHYOVAHSA-N 454.531 0.714 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CN2C(=O)NC(C)(C)C2=O)c1 913126054 FEGPFTDMMABXEH-UHFFFAOYSA-N 489.510 0.587 50 20 JCGD NS(=O)(=O)c1ccc(CCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 915883673 CKNXBIWMDZLGTK-UHFFFAOYSA-N 474.587 0.419 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NN=C1C(=O)Nc2cc(O)ccc21 915937968 WCRZULVFEUHFJD-UHFFFAOYSA-N 458.496 0.818 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc([N+](=O)[O-])o1)c(=O)n2Cc1ccccc1 916333664 PWWVOBLJSWAIBG-UHFFFAOYSA-N 495.452 0.706 50 20 JCGD CC(=NNC(=O)c1csc(N2CCOCC2)n1)c1ccc(S(=O)(=O)N2CCNCC2)cc1 916337813 BXVOFVGJTZKMBR-UHFFFAOYSA-N 478.600 0.728 50 20 JCGD 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CC(=O)O[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)C 1837921320 ZCZILKVFBQFSCL-QFIPXVFZSA-N 474.363 0.566 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc4c(c3)CNC4=O)CC2)CC1 1838348997 ILFNSGJDIWBQHB-UHFFFAOYSA-N 485.585 0.915 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1838471482 PWEUFRRGLIHJHQ-QRWLVFNGSA-N 451.911 0.418 50 20 JCGD C=C1CC(C(=O)N2CCOC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)C1 1839054286 RDKNMOARXHHPOT-RUZDIDTESA-N 485.585 0.755 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@H]1F)CCO2)NC(=O)NCc1ccccc1 1839770566 FVBVSVQKSIIDMH-SFYKDHMMSA-N 477.537 0.147 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CSCC(=O)OC)C2)C1 1839962571 KUATXJRAAZYIEL-GUYCJALGSA-N 467.382 0.523 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(=O)OC)cc3[N+](=O)[O-])C2)C1 1840155133 QIANXLUEOXLHSN-IIBYNOLFSA-N 499.904 0.705 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccoc4C3)C2)C1 1840182827 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COc1ccc(C(=O)NNC(=O)COC(=O)Cn2nc(-c3ccc(F)cc3)oc2=O)cc1OC 104990565 HAEUFDWUFOLSIT-UHFFFAOYSA-N 474.401 0.664 50 20 JCGD CC/C=C(/C)C(=O)N1CSC[C@@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 728018298 JHHBEJXEVHUMIT-VXXVJXPCSA-N 454.574 0.956 50 20 JCGD COC1CCN(C(C)(C)CNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)CC1 730907910 NYAOGFDESATRBN-UHFFFAOYSA-N 469.608 0.835 50 20 JCGD Cn1c(=O)c2ccc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)nc2n(C)c1=O 742453179 FCTNCQBLIXBTLL-UHFFFAOYSA-N 450.377 0.795 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN1C(=O)c1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1 749475100 AIUUBPYVJWKSRW-OCCSQVGLSA-N 458.334 0.636 50 20 JCGD C[C@H](NC(=O)OCc1ccccc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 750292767 ADNVVNFEFIYLQE-KBXCAEBGSA-N 457.439 0.832 50 20 JCGD O=C(COC(=O)CSc1nnc(-c2ccco2)o1)NNC(=O)[C@@H]1COc2ccccc2O1 783145208 KYPJKIBHLGKHSS-AWEZNQCLSA-N 460.424 0.952 50 20 JCGD CC1CCC2(CC1)NC(=O)N(CC(=O)OCC(=O)NNC(=O)[C@H]1COc3ccccc3O1)C2=O 794168702 HXNHGVGRBMYAMF-HTONAGSSSA-N 474.470 0.018 50 20 JCGD CN(C)S(=O)(=O)c1ccc(I)c(C(=O)N2CC[C@H](B(O)O)C2)c1 864233704 JSANHETZDWVBAJ-VIFPVBQESA-N 452.079 0.230 50 20 JCGD CNS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1 906369291 GRSPPZXDJGXVRX-UHFFFAOYSA-N 459.502 0.244 50 20 JCGD Cc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1C 912848168 LRFGSCDABJBLAJ-UHFFFAOYSA-N 467.573 0.644 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCC(=O)N2CCOCC2)c1 913125930 CXKJNQFCJDJEBC-UHFFFAOYSA-N 490.538 0.896 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)c1 914829968 KPNMZUMIZMXMLB-HSZRJFAPSA-N 499.549 0.697 50 20 JCGD CN(C)N(C(=O)CN(C)S(=O)(=O)c1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1 915277532 VDMFAXLMIQMITB-CYBMUJFWSA-N 468.395 0.562 50 20 JCGD O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)NNc1ccc(-n2cccn2)nn1 916232094 DRLQKYRUYQKVKV-UHFFFAOYSA-N 464.533 0.571 50 20 JCGD O=C(NNC(=O)N1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)c1cc(Br)c[nH]1 918002881 YHBPLHLZTAUKGB-UHFFFAOYSA-N 481.332 0.898 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc4cccnc4s3)C2)C1 1777753398 ZDHHNVQFUJWXJV-QFIPXVFZSA-N 451.313 0.733 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CS(=O)(=O)N2CCCC2)C1 1778091585 VCWUFXUJHPSEEB-GPMSIDNRSA-N 466.000 0.180 50 20 JCGD Cc1ccc(OCCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779029688 WVWSQJGGBAMFJV-DEOSSOPVSA-N 467.526 0.906 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnn4n3)C2)C1 1779963252 NLKCSBQTDINWRK-BHSKHCGUSA-N 464.486 0.307 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780775035 VDXOWTOLJLJHMM-PFHKOEEOSA-N 451.337 0.898 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1ccnc1 1780968141 AXBOWGIRYNEWHF-YADARESESA-N 483.573 0.620 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1)NC(=O)NCc1ccccc1 1780969304 KUHRSHOCCDBOHE-VWLOTQADSA-N 496.568 0.506 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C1CCOCC1)CCO2)NC(=O)NCc1ccccc1 1780970063 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O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(-c2ccccn2)[nH]n1 1788947363 QROLFPSIIGTKMG-ZJBJCVSYSA-N 475.314 0.059 50 20 JCGD COc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)ccc1[N+](=O)[O-] 1789848145 FNJYMDPVCNGBSI-JLMWRMLUSA-N 497.313 0.119 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1 1791056024 MBJKQLKJXMZBHC-CUXOXCPVSA-N 463.325 0.244 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1791254169 OXNULHLUEFXTDE-WOYTXXSLSA-N 477.986 0.496 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791293030 FVCDLQBWPZJCPX-PJVZLEMVSA-N 464.563 0.095 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792982557 IDMOJHKZAUWPDU-FWEDZOCSSA-N 453.923 0.491 50 20 JCGD O=C1NC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)O1 1793421607 QOCKUXCLYCUXLE-QEOTZNIISA-N 466.332 0.691 50 20 JCGD 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CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1C(F)(F)F)C2 1801011939 WRGZQDUPPIUXBI-FVCICTRLSA-N 457.453 0.677 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C)C2 1802332636 GEBVSOCRHKZOHV-MHORFTMASA-N 481.594 0.634 50 20 JCGD Cc1nn(C)cc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803821923 FYPJEFTYXAUFCK-UZLBHIALSA-N 462.514 0.755 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1CCC(CO)CC1 1804216851 PXHLHOGRBSHDMD-OVFRKTKQSA-N 465.359 0.880 50 20 JCGD Cn1nc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cc1O 1804895956 WUPLRDVGLNXKST-KUHUBIRLSA-N 464.486 0.153 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ncn(-c3ccccc3)n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361520 IOMYIDFZFULYPF-OFNKIYASSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CSc2ncccn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362243 FRJXQHWJFPIJTE-NQIIRXRSSA-N 477.355 0.663 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807363809 QJYJACRALFQDLE-CVDCTZTESA-N 487.325 0.748 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376039 RFMAPPSFLPZILE-VGSWGCGISA-N 470.298 0.666 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376852 WRQHMSOAHQGIDE-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)no1 1808390809 KPHDBNZSCQJBEW-HXOBKFHXSA-N 485.545 0.786 50 20 JCGD N[C@@H](CC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)c1cccnc1 1809883126 CBMNNJYWMOSIEL-NRFANRHFSA-N 450.348 0.696 50 20 JCGD O=C(CSc1ncccn1)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1810123244 HQQMUPKRLYDURC-UHFFFAOYSA-N 454.361 0.794 50 20 JCGD Cc1cccc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815350612 ZXPOBOAZGXEAEZ-QGZVFWFLSA-N 450.329 0.995 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2 1824542687 IAVRUPCODKKBCF-MJVIPROJSA-N 451.936 0.868 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)Cc3ccc(O)cn3)sc2C1 1827050404 AKDCPXOHIZOXLS-GFCCVEGCSA-N 467.511 0.711 50 20 JCGD COC(=O)C12CC(C(=O)N3CCC([C@@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)CC3)(C1)C2 1827060623 VBLUFNMDQRUYQR-LXKSKSEUSA-N 468.359 0.943 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)CC1 1828175415 FDYATMZDMPUXJU-LJQANCHMSA-N 462.319 0.351 50 20 JCGD O=C(CCc1ccc(F)c(F)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830271272 CFCMOYFYZIVXKQ-DEOSSOPVSA-N 488.296 0.347 50 20 JCGD O=C(C1CCN(Cc2ccccn2)CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830726307 QAGNBSJFAJRWCB-OFNKIYASSA-N 480.993 0.350 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830738035 LIVKGPCJHKNUFT-DRSNIGMVSA-N 489.997 0.690 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc3n(n2)CCCNC3=O)CC1 1831873057 HMPFAZWVHCLPBS-LJQANCHMSA-N 487.605 0.623 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1noc(C)c1C)CCO2 1831975022 PGSIXCLCVICFFH-NMWDDECMSA-N 472.502 0.495 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)C1(O)CCC1 1833071878 PVCKWWLNTSLBOR-KRWDZBQOSA-N 451.612 0.482 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(N3CCOCC3)cn1)CCO2 1833614824 KIKLFNDPTJHCFJ-HSZRJFAPSA-N 492.649 0.840 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)cnn1C 1834421610 MWBZVZYSJZZGOQ-JTSKRJEESA-N 499.996 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC3CCCC3)CCO2)C1 1834671459 NWPCXVLYTVBDDJ-HSZRJFAPSA-N 459.547 0.726 50 20 JCGD O=Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1834802628 LLJLVALFACNEBF-UHFFFAOYSA-N 469.372 0.739 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)n3)CC2)CC1 1835077785 RTDAOIOWEPQKOP-LLVKDONJSA-N 456.341 0.856 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCC#N)CCO2)C1 1835360262 YIGJNZMQJAAFFK-OAQYLSRUSA-N 460.443 0.894 50 20 JCGD O=C(CSc1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929150 CHJLUZRCZKLRJQ-QHCPKHFHSA-N 470.356 0.229 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@@H]43)C2)C1 1835930715 VWBLVXZGIPPJGT-HXKBJWFLSA-N 494.378 0.324 50 20 JCGD CCOc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835939045 CGTOAFJTTSZLRJ-DEOSSOPVSA-N 468.315 0.149 50 20 JCGD Cc1c(C(=O)NC2CCN(C3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cn2[nH]cnc(=O)c12 1836090149 SMQUIUKHEMGEDX-QGZVFWFLSA-N 464.954 0.116 50 20 JCGD O=C(CSc1ncccn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1836115062 LBEAMOWFFMRTJQ-CJNGLKHVSA-N 463.329 0.716 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@@H](F)Br 1836412335 FJISZQSNMCVDOF-QGZVFWFLSA-N 470.148 0.242 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(F)cc3)C2)C1 1837456710 PYVNXKLQAQLPLL-FHAGJXEFSA-N 497.527 0.698 50 20 JCGD Cc1ccc(OCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837457435 BFWHOTJWHCAWDQ-XMMPIXPASA-N 483.525 0.143 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CS[C@H]3CCCCO3)C2)C1 1837458753 AGESPRSKUWQKPW-SIKLNZKXSA-N 493.586 0.015 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1838468917 SEOUCVFCGIVXBW-IIBYNOLFSA-N 465.938 0.809 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@@H]3F)C2)C1)NC(=O)NCc1ccccc1 1839054088 GQIBNYGFXIDXSY-MSYCTHLASA-N 477.537 0.147 50 20 JCGD COc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)ccc1[N+](=O)[O-] 1839136251 PHSZNNOJRKKLML-OXJNMPFZSA-N 471.894 0.202 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)C1 1839144830 LMMUTVJKZYMSIQ-QEEYODRMSA-N 463.959 0.346 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1839965790 LJPKXYZBMBCYHU-PXNSSMCTSA-N 487.439 0.396 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(C(=O)OC)(C1)C3)CCO2 1840007309 YOPFWMOUPAMNIJ-HJXCVWKLSA-N 473.364 0.960 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)nc2nccn12 1840035167 IHJUCPMMBLCCOG-AUUYWEPGSA-N 466.336 0.891 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1 1840035545 VKVCROSZICLKEU-PBFPGSCMSA-N 451.314 0.788 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C2)C1 1840156455 POHQAWLKWFTJHU-MGPUTAFESA-N 475.970 0.754 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(F)CN(C(=O)OC(C)(C)C)C3)C2)C1 1840156705 STANUVSUAIZPRF-QRWLVFNGSA-N 493.960 0.656 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)CCO2 1840608812 XHWURIPFJVVRCJ-ZYRMUBPZSA-N 489.481 0.483 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840905568 MLILSCZINLXFAM-MGPUTAFESA-N 463.959 0.347 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840908549 NNJIQKYZAGRADP-MRUHUIDDSA-N 477.986 0.736 50 20 JCGD Cc1nnc(NNC(=O)CCCCCNS(=O)(=O)c2ccc3c(c2)OCCO3)nc1O 23311633 UOOBYPXYYUBECU-UHFFFAOYSA-N 452.493 0.639 50 20 JCGD CN(C1CCCCC1)S(=O)(=O)N1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1 725872612 DXOSJUPJTIXWRT-UHFFFAOYSA-N 486.620 0.346 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(C(=O)CCC(=O)NNC(=O)c3cccn3C)CC2)cc1 726538165 FOBQOQKWLZXXHF-UHFFFAOYSA-N 461.544 0.408 50 20 JCGD COc1c(Br)cc(Cl)cc1S(=O)(=O)NNC(=O)[C@H](C)NS(C)(=O)=O 728510233 UNLAESRFFKNMIG-LURJTMIESA-N 464.747 0.358 50 20 JCGD C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1=O 728848118 VYCCVYSTNGBDBF-JOCHJYFZSA-N 469.477 0.447 50 20 JCGD O=C(NC[C@@H]1CN2CCC[C@H]2CO1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 729620556 YTYZGPCWEDBKMD-DLBZAZTESA-N 451.549 0.278 50 20 JCGD CCOc1ccc(O[C@@H](C)C(=O)NNS(=O)(=O)c2cccc(S(=O)(=O)NC)c2)cc1 747406958 MPJIYGQWCRJQPP-ZDUSSCGKSA-N 457.530 0.770 50 20 JCGD C=CCN1C(=O)c2ccccc2N2C(=O)CC[C@]12C(=O)OCC(=O)NNC(=O)Cc1nc(C)cs1 762476769 RJPBVKWZARWQMY-QHCPKHFHSA-N 497.533 0.850 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCCC2)c2ccccc2c1=O 822438651 MERZZUZCBYBYPB-UHFFFAOYSA-N 461.525 0.854 50 20 JCGD O=C(COC(=O)c1cc(Cl)ccc1-n1cnnn1)NNC(=O)[C@@H]1COc2ccccc2O1 915244110 CHTXXAHJKWIMGB-INIZCTEOSA-N 458.818 0.460 50 20 JCGD O=C(CCN1CCCS1(=O)=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 918209765 IEIGROLEZKHNNU-UHFFFAOYSA-N 472.570 0.736 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccccc1OC(F)F)N[C@@H]1CCS(=O)(=O)C1 919886588 SNMJJUQAXUSMQO-DGCLKSJQSA-N 460.459 0.410 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCO3)C2 1778091182 PVKHQWRFIHMIII-CAAOGRNVSA-N 497.556 0.927 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374687 CGOHHJFKTRCLEM-WZONZLPQSA-N 468.514 0.034 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CSc3nc[nH]n3)CCO2)C1 1780098757 UZWGCONWWXFVFS-HXUWFJFHSA-N 490.498 0.874 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(O)cc([N+](=O)[O-])c1 1781096460 XTNXUFYMVFQWTD-NFBKMPQASA-N 483.286 0.422 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781334676 YZYMKVSBWRSSQT-RVZJWNSFSA-N 482.347 0.783 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c(O)c1 1782212160 KONZQDYGPKUDIN-AUSIDOKSSA-N 462.547 0.901 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2s1 1782298180 VYCLOQXFGSXYRL-JOCHJYFZSA-N 453.329 0.975 50 20 JCGD C[C@@H](CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)Oc1ccccc1 1782878785 ITBHEQLDXJMXHG-MHECFPHRSA-N 452.316 0.668 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)CN1CCc3sccc3C1)CCO2 1783933647 TYKMTJFLRYLNNB-JOCHJYFZSA-N 463.604 0.309 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784091336 OEDXGKSWPPZEAF-RPZXMPESSA-N 469.878 0.713 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)ncn3)[C@H]2C1 1784663449 HSSNZOTXCMRLKK-SDADXPQNSA-N 483.953 0.908 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c(C4CC4)c3F)C[C@@H]21)c1ccc(B(O)O)cc1 1786980032 ALFVAPGTHFIBFY-XIRDDKMYSA-N 456.283 0.013 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4ccc(F)cc34)[C@H]2C1 1788388903 ROCVFXXCIOGUAJ-OWQGQXMQSA-N 460.510 0.668 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccn4cn3)C[C@@H]21 1788611058 ILJLOECORIUKOE-DCPHZVHLSA-N 463.498 0.240 50 20 JCGD Cc1cccn2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)c12 1790505864 OQZKBOCPAXNVCG-YYWHXJBOSA-N 462.315 0.230 50 20 JCGD COCCOCCOCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1791134513 RVNPGYZSDJVIDV-QBYUYEEZSA-N 469.348 0.726 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cc(Cl)ccn3)C[C@@H]21 1791290973 FVWJSRLGDQLABV-XIRDDKMYSA-N 467.954 0.467 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)c3nccnc3C(N)=O)CCC2)cc1 1791601116 MCIHECXFEKIIQP-UHFFFAOYSA-N 453.503 0.696 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)c1 1792696111 VHUXZTIRJQXCPU-NEBZKDRISA-N 463.325 0.984 50 20 JCGD Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1F 1793305730 RVUNAMJQRCTJMV-BBIADKPPSA-N 454.307 0.650 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)N1CCOCC1)C2 1794141957 GVSFDQNVASNDEY-SPCJURDBSA-N 474.986 0.407 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccc(Cl)cc3nn1)C2)c1cccc(B(O)O)c1 1795738789 FUDFDOFJKAOEDG-VPTLXERWSA-N 480.717 0.480 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796369663 AHNNEQKXTVRXPH-KHMAMNHCSA-N 493.964 0.452 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)C2 1796892058 DCQUZPLIYSGAAF-WMTNFOANSA-N 473.559 0.561 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1csc2c1CCCC2 1797391617 MZJLVTVBFLSRIX-VPTLXERWSA-N 454.357 0.824 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(F)c(F)c1)C2 1797748674 RKFMEYDWXCHCOQ-USGNIVHTSA-N 473.480 0.799 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754365 SNXUWNCOYNUWDJ-LAVAIGHBSA-N 451.527 0.767 50 20 JCGD Cc1nc[nH]c1CSCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798440512 NFHSIFHSYGCQEX-QDMKHBRRSA-N 457.560 0.902 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)C(C)(C)C)C2)NC(=O)NCc1ccccc1 1799095369 PKHCNIFNJUNTRH-KOUHRCEDSA-N 475.590 0.329 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc([N+](=O)[O-])c(OC)c1 1799252336 ZYZWMOWGZIEXHF-YGTYGHESSA-N 455.895 0.989 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3cc([N+](=O)[O-])ccc3[nH]1)C2 1800979415 FWXGNPDAKOJOGF-DZJQYVJYSA-N 451.867 0.928 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1OCC1CC1)C2 1801009385 CVTUNNVZJZVPNV-UPHUGPLXSA-N 459.547 0.447 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1ccnc1C 1801451480 DJTAUTVMLZHPOC-DTLTXRAUSA-N 455.519 0.476 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2 1802148584 IVQFOXOWIODJSM-QYTFOEQGSA-N 495.404 0.581 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1804190411 GATMRVKXTDKLIY-RBOXIYTFSA-N 452.309 0.423 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cncn1-c1ccncc1 1805103922 IBHFJWICHKGKOK-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD Nc1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)s1 1807275522 PTXSPOLMQYLCRW-MAUKXSAKSA-N 451.317 0.434 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3Cc4ccccc4CN3)CC2)C1 1809966720 KQMFQTWDYJNCJY-HSZRJFAPSA-N 461.371 0.926 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1810303309 SZMISWMQPJBHJV-SDLUEBNPSA-N 477.569 0.740 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810507849 JXUOWLMCVQKSLL-KUDFPVQQSA-N 481.557 0.705 50 20 JCGD O=C(CCc1cnccn1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813442101 CXDGLGYXDKWZOE-XXBNENTESA-N 459.315 0.504 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](C)CC(N)=O)CC2 1817275768 CRIWSJWVYBWUTO-OUROMSBLSA-N 459.532 0.701 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CCCC[C@H]2c2cc(NC(=O)[C@H](F)Cl)n[nH]2)n(C)c1=O 1818036444 QPNYMNMHHHZXDC-NHYWBVRUSA-N 480.888 0.384 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1nc2ccc(F)cn2n1 1821597305 RRYFXEJHQMRKDY-KRWDZBQOSA-N 477.265 0.891 50 20 JCGD O=C(CNC(=O)C(F)(F)F)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822441014 USRZRXMQNZQHCQ-CQSZACIVSA-N 467.213 0.074 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525291 OAEXALMSXSBFPP-IIBYNOLFSA-N 498.374 0.923 50 20 JCGD CN(C)C(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 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O=C(NC1CCN(C2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)CC2)CC1)[C@H](O)CCl 1833313776 QNIRKNOPQMOWME-QGZVFWFLSA-N 484.022 0.063 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)CCO2)C1 1833726236 XBZPVISEMWLWIY-HXOBKFHXSA-N 493.992 0.495 50 20 JCGD Cc1scc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1C 1834542081 ZPLDVQWCUACGSJ-NRFANRHFSA-N 452.577 0.808 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnccc3F)CC2)CC1)c1ccc(B(O)O)cc1 1834798096 ZOMGQIUFNBFXRJ-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(F)nc3F)CC2)CC1)c1cccc(B(O)O)c1 1834800653 VVWGOQMZRSLTII-UHFFFAOYSA-N 472.301 0.539 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nncn4c3)CC2)CC1 1835582816 IOMULWPSXYZBCF-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3[C@@H]4C=CS[C@@H]34)CC2)CC1 1835738217 MOZJCQQRVCRYKN-DFQSSKMNSA-N 470.599 0.745 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1 1835795922 FEROSDBIMRXCQS-GUYCJALGSA-N 454.934 0.701 50 20 JCGD CC#CC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835938136 NAKBCCHEECNVKW-SQHAQQRYSA-N 490.365 0.634 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3Cl)C2)C1 1835938285 RNOTZVBDZJVHIE-QFIPXVFZSA-N 458.707 0.404 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c(O)c1 1836245128 IFLRJDVJQUSDKT-UHFFFAOYSA-N 481.358 0.580 50 20 JCGD O=C(c1nn(-c2ccccc2)c2c1COC2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836391349 VBYYVTSGTJIBCO-WMZHIEFXSA-N 490.944 0.572 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1 1836866977 TZOFVBHUOIISMD-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1 1839153823 SUPMWIXQTWMYOU-NHCUHLMSSA-N 489.400 0.980 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nccn3)CCO2)C1 1839237908 JMDHUTMBTRIFGR-IXNCKXOBSA-N 472.452 0.620 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)ccc(O)c1F)CCO2 1839412537 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O=C(CNC(=O)c1ccco1)NNC(=O)CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1 725740205 CVACJPGFVIPLFI-JOCHJYFZSA-N 489.488 0.670 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)CS(=O)(=O)c1cccc(Br)c1 725740555 WXDJEORKWDPZOI-UHFFFAOYSA-N 460.331 0.862 50 20 JCGD CC(C)[C@@H](NC(=O)c1ccccn1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728342143 GJTQLLJYMIPKSP-IEBWSBKVSA-N 456.455 0.367 50 20 JCGD CCN1CCCC[C@H]1C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 729515802 OABSZBFSJDUJAS-ROUUACIJSA-N 482.603 0.975 50 20 JCGD Cc1nn(-c2ccccc2)c(N2CCCC2)c1C=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O 730569032 JWNZETHIHNBQQA-UHFFFAOYSA-N 482.570 0.816 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)Cc1ccccc1F 731344639 XUSKWYORQKNDTQ-FIIODCPWSA-N 497.570 0.909 50 20 JCGD COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1 751324457 FXAPZXYCTXBXBJ-UHFFFAOYSA-N 461.496 0.639 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2ccc3oc(=O)ccc3c2)cc1 903910098 OVFGDGLUFOMOMF-UHFFFAOYSA-N 465.509 0.732 50 20 JCGD CC(=NNC(=O)CN1CCCC1=O)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1 916357961 UUVYTYIPMXJYDD-QGZVFWFLSA-N 450.517 0.777 50 20 JCGD CC(C)(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 916622434 RAJMEFIOCLKKTL-UHFFFAOYSA-N 489.620 0.523 50 20 JCGD COC(=O)N(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1 917361268 HAYJWUVUMQLEFM-UHFFFAOYSA-N 450.473 0.955 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)N2CCN(C(=O)CN3CCOCC3)CC2)N(C)c2ccccc21 919696911 MZCFZSIIJBBRSH-UHFFFAOYSA-N 480.569 0.660 50 20 JCGD C[C@H]1CCCCN1S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919885802 RMCURLXQVIMJDH-DZGCQCFKSA-N 458.562 0.381 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc(Cl)n1 1779032647 PVAIWEDCGQGJQM-OAQYLSRUSA-N 474.905 0.499 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)C2)C1 1779044657 BCLJTOUDFDYYCF-WHLIWEHUSA-N 464.352 0.698 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779295114 YMDYZUQFPOJETC-KKSFZXQISA-N 473.643 0.944 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1[C@H]3C=CS[C@H]31)C2 1779374747 ZNJUMZACRPVAGT-GOWNKEFISA-N 457.556 0.688 50 20 JCGD O=C(c1cc(=O)nc2cccnn12)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1780059725 GFADUPYIWXJEIK-YOEHRIQHSA-N 454.256 0.224 50 20 JCGD Cc1cnn(CC(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)c1 1780970521 WUVMKUMZJLLJBS-XMMPIXPASA-N 483.573 0.368 50 20 JCGD CO[C@H](C)[C@@H](C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)N(C)C(=O)OC(C)(C)C 1781079972 XSOIVYHOAAVTJX-JXSLOMFPSA-N 477.986 0.686 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334401 NHQCVNMAMBEYTH-KXBFYZLASA-N 473.295 0.970 50 20 JCGD Cc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc(C)c1C(=O)O 1782172704 HAGGUBXWQFNFRI-XMMPIXPASA-N 481.509 0.757 50 20 JCGD Cc1nccn1CCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782491399 POEMQLMUJQGNGU-HYBUGGRVSA-N 483.573 0.798 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C3CCC4(CC3)OCCO4)C2)C1 1782944392 VBWRYBWXFGQFBT-OAQYLSRUSA-N 452.552 0.123 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@]1(NC(=O)OC(C)(C)C)CCOC1)CCO2 1783882243 WWGMKJPEXUXRAO-IWMITWMQSA-N 475.970 0.754 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)CCO2)C1 1783883128 FKBQHAFZWWQRMS-HTAPYJJXSA-N 461.902 0.813 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-c4ncc[nH]4)cc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786982335 YUGZWGWJQQSXRZ-BVSLBCMMSA-N 474.326 0.664 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(O)cc4)CC3)C[C@@H]21)c1cccc(B(O)O)c1 1786983567 SDCPCEYPCXHOTG-HSQYWUDLSA-N 464.327 0.397 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4ccccc4O3)C[C@@H]21)c1cccc(B(O)O)c1 1786986664 WYUZKNOTNAUVNY-HMNCIZAVSA-N 464.327 0.354 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccc(Cl)n3)C[C@@H]21 1788611451 CJIFLNXUPWCAPL-KKXDTOCCSA-N 472.933 0.570 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[S@@](=O)c1ccccc1 1790595426 KDCZLGGXZIWIQH-OJZOHFENSA-N 484.383 0.156 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)C=CC3=O)C[C@@H]21 1790695896 ZGXSXISTGJRCBA-TYDTZWSASA-N 484.459 0.776 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(N4CCN(C)CC4)CC3)C[C@@H]21 1790963423 RZXIKFXDHYVYHC-FJIDUMEYSA-N 471.440 0.920 50 20 JCGD CC(C)(C)OC(=O)N[C@H](Cc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792975131 KEAAFZUVAMYCQO-RHQZKXFESA-N 496.992 0.707 50 20 JCGD Cc1nc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)ccc2s1 1795734387 NZXKBVMWTJQJCQ-UPHUGPLXSA-N 465.340 0.802 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1Cl)C2)c1cccc(B(O)O)c1 1795737767 QTVRUVMJLHEONO-USGNIVHTSA-N 460.698 0.605 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn2nc(N3CCOCC3)ccc12)[C@@H](O)CCl 1796431212 RRMWSTDZJICOQH-IVSAIRAKSA-N 462.938 0.417 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cc(Br)ncc1F 1796620175 ITTVHUOPIFPFSI-XSPYEYLBSA-N 450.692 0.786 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1799382673 FRIHKYGIDIWUGK-CYGHRXIMSA-N 499.374 0.353 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801009432 IBFUYERPOVBGJZ-CWPLJXCYSA-N 475.546 0.223 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801012421 YBMGLWDEXZFRAS-NYUBLWNDSA-N 497.637 0.746 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1CN(Cc3ccccc3)CCO1)C2 1802336754 XNCHGQCXTDODQJ-LRSLUSHPSA-N 471.602 0.899 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803164788 SUJCMZNEZXMJGT-WMQCIHAUSA-N 465.558 0.884 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(=O)OC(C)(C)C 1807370695 IYDJIPRSEXUKRY-SIKLNZKXSA-N 496.373 0.948 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375450 OYBHYULFFIQCLG-PXNSSMCTSA-N 474.282 0.519 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2C[C@H](O)CN2)[C@@H]1c1cccnc1 1807704828 KYCSEZRKOHQRSF-NTPMHYTDSA-N 497.508 0.958 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H](F)Br 1808661336 IOUGJKCBXXPLAK-UAGQMJEPSA-N 464.100 0.772 50 20 JCGD Cn1cc(F)cc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1808865642 OQRAQESKOKHFEH-UTKZUKDTSA-N 450.279 0.872 50 20 JCGD Cc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1810300359 XQYNYKIMFIXKJC-JXFKEZNVSA-N 460.498 0.812 50 20 JCGD Cc1cc(C)n(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815337121 NIKGMRBRHQMUDZ-INIZCTEOSA-N 453.333 0.562 50 20 JCGD Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc(O)n1 1815341389 YFNJTKNBOXUQAA-HNNXBMFYSA-N 452.301 0.772 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347633 HTRLNNXCTDMLPU-RDTXWAMCSA-N 492.366 0.867 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347910 XEZCPMQJBBSABU-BBRMVZONSA-N 466.328 0.911 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815355002 YNPKBZJMXWZPJH-ZFWWWQNUSA-N 471.373 0.075 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CCNC(=O)C2)n[nH]1 1822482385 VOIMRRQXIGGYSF-WBMJQRKESA-N 454.491 0.240 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1 1822699344 ARVBCJBYANCAOJ-OWCLPIDISA-N 451.915 0.472 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826087710 JOQOLINVPUUTOH-OLZOCXBDSA-N 460.564 0.719 50 20 JCGD O=C1CC[C@@H](C(=O)N2CCN(C(=O)OCc3ccccc3)[C@]3(CCN(C(=O)[C@@H](O)CCl)C3)C2)N1 1828877655 ILUDUEGNZVODLN-BSRJHKFKSA-N 492.960 0.317 50 20 JCGD Cc1ccc(F)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830071372 PXRISEXXFAVQQI-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1830540385 PSTQJKZSZZCLMY-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)CCO2 1830575527 VUFJMZWJGFFHKN-BXTJHSDWSA-N 463.959 0.346 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CCOC[C@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)CC2=O)c1 1830719804 LEVHAGAZCMICQL-BVZALQNUSA-N 495.960 0.104 50 20 JCGD CN(C)c1cccc(OCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1832526027 NHJYWCIYEFNKTK-NQIIRXRSSA-N 455.939 0.188 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)CC2)CC1)[C@@H](O)CCl 1833308648 ZHMQFBFOEKSCAP-UZLBHIALSA-N 469.026 0.949 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccn(C(C)(C)C)n1)CCO2 1833587117 JEIPNJVCXZISRN-MSIOFZDNSA-N 499.572 0.842 50 20 JCGD CCc1[nH]nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c1F 1833738874 NATWNXRLBPTTMS-XJKSGUPXSA-N 451.268 0.872 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1834821422 JCRJXQGORNRDIH-GOSISDBHSA-N 452.309 0.584 50 20 JCGD O=C(C[C@H]1OCCc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926982 ATGJMBNDIIMDEI-BVAGGSTKSA-N 494.353 0.141 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(F)cc4)CC3)C2)C1 1835927177 KCGUNEJMFIHJOI-DEOSSOPVSA-N 482.317 0.307 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CCOC[C@]4(C3)CN(C(=O)c3ccc(B(O)O)cc3)CCO4)c2c1 1835927827 YGPFUVLJRQQIHK-SANMLTNESA-N 491.353 0.469 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc43)C2)C1 1835934557 YNZHYVUXBJILIN-RCZVLFRGSA-N 464.327 0.166 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836719339 PZJAXZPEPACSNU-HNAYVOBHSA-N 466.966 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4cccnc4n3)CCO2)C1 1836833332 NICFTXRAYKRQQU-XMMPIXPASA-N 491.508 0.012 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cnc1C 1837456210 FPQTYAXYUWPHCH-HSZRJFAPSA-N 468.514 0.081 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCCc3cccnc3)C2)C1 1837461096 ODUAPNVNKYRPFC-DEOSSOPVSA-N 482.541 0.173 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)no1 1837921112 BBCFNYSWBUMCGD-UHFFFAOYSA-N 455.320 0.843 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3nc4ccccn4n3)CC2)CC1 1838019503 GHMLZMBPFGWUTF-UHFFFAOYSA-N 492.540 0.654 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCN(C)C)C2)C1 1838528437 XTVGNZIFZCZSHF-QFIPXVFZSA-N 478.502 0.542 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C3(C#N)CC3)C2)C1)NC(=O)NCc1ccccc1 1839054113 HGBUSGPNCVNEQV-XMMPIXPASA-N 484.557 0.093 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)n[nH]1 1839054220 MCGJXUUJAIZTGU-DEOSSOPVSA-N 499.572 0.134 50 20 JCGD O=C(/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)NCc1ccco1 1839200314 IPKLCPRNDUEXPQ-HECAZONMSA-N 488.310 0.599 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202762 OWFHNDMRZOYYCV-YLJYHZDGSA-N 485.354 0.530 50 20 JCGD N#Cc1ccc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839420926 NCUIGIXYVNGFML-QHCPKHFHSA-N 482.472 0.080 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1 1840033285 ZWSDEFDITMBDJN-SGTLLEGYSA-N 452.309 0.811 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1 1840153004 AQBUXYDKUIMHKX-PNLZDCPESA-N 467.950 0.960 50 20 JCGD CC(C)c1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)on1 1840185927 WNLNRHBAARENHB-NRFANRHFSA-N 451.524 0.241 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(F)cc3)C2)C1 1840185938 UMHGOWJOUWIZMP-HSZRJFAPSA-N 464.538 0.588 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)C1=O 1840188456 KODAKIZSDNRWCW-LJQANCHMSA-N 456.282 0.695 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014883 MDZKKFKYRYLDBI-BWTSREIZSA-N 469.347 0.296 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CN1C(=O)COc3ccc(Cl)cc31)C2 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CC1CCC(NC(=O)CN2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)CC1 728305172 ADJPIYMYIBZTFS-UHFFFAOYSA-N 464.592 0.531 50 20 JCGD O=C(COC(=O)c1c[nH]n2c1nc(=O)c1ccccc12)NNC(=O)[C@H]1COc2ccccc2O1 728329750 GEWDQZBDKDKXOG-QGZVFWFLSA-N 463.406 0.320 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cc1ccc(C#N)cc1)c(=O)n2Cc1ccccc1 749842964 OWIDYHJUOUQNEV-UHFFFAOYSA-N 485.504 0.690 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 915922029 VUWGRPFUWWZSMR-UHFFFAOYSA-N 450.521 0.051 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NC3CCN(Cc4ccncc4)CC3)nc2)CC1 918226231 FBRWDUUNIBMDDL-UHFFFAOYSA-N 488.618 0.703 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2cnccc2n1 1778530759 LULBQWRQWONTPK-RCZVLFRGSA-N 474.326 0.751 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3cccn3cn2)C1 1778723487 RCZDCZLSGQQSDF-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ncncc4c3)CCO2)C1 1779032594 VMHJJBUQSWSOMJ-HSZRJFAPSA-N 461.482 0.386 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2 1779034040 JOOBMVDPFUISFJ-HYBUGGRVSA-N 465.510 0.522 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1 1779357673 LFLSJXOGAVYCAI-RVWJGDDESA-N 490.467 0.821 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn3ccsc3n1)C2 1779372664 UJICAIPQBIESMX-VGOFRKELSA-N 483.554 0.836 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(CCO)CCO)C1 1781838428 GTXHCJXJJWEUAX-AYOQOUSVSA-N 454.395 0.023 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3ccncc3=O)C2)C1 1782659063 QMFOPGQSJIZQJF-BTYIYWSLSA-N 483.953 0.205 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(S(C)(=O)=O)cn3)CCO2)C1 1783531910 FUYJEBZAOFCSPA-SJCJKPOMSA-N 460.350 0.712 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1783681333 ULVICESZBQPZOT-IBGZPJMESA-N 481.384 0.298 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784085122 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NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2ccncc2=O)CC1 1828924620 VQUFTNKZSRCYJI-LJQANCHMSA-N 467.530 0.175 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)nc3)CCO2)C1 1829507900 DSPIZQDNNQJIAP-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD COCCOCCOCCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830370193 LLVZKFMNCUOWEV-QFIPXVFZSA-N 495.013 0.404 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1830533816 UCLYUHDMBAOHCH-MAUKXSAKSA-N 464.426 0.523 50 20 JCGD CCOC(=O)C1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1831251564 ANWMGYSPHRZIAI-FQEVSTJZSA-N 456.348 0.943 50 20 JCGD O=C(CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1)N1CCCC1 1832420436 YAQSSPGBKUDGOM-IBGZPJMESA-N 460.369 0.630 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccco3)CCO2)C1 1832660508 ZBURNMOYTPVFJP-NMWDDECMSA-N 471.470 0.053 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1833766753 VGABJWKDORQZAI-IFXJQAMLSA-N 462.378 0.392 50 20 JCGD Cc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1 1833823780 UNKBGUGCNAFLAT-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc[nH]3)CCO2)C1 1834100330 YSHFFJRYXJDFLK-VBKZILBWSA-N 471.942 0.612 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C)CC1)CCO2)NC(=O)NCc1ccccc1 1834625891 VGFVSHQQQNFSTM-DEOSSOPVSA-N 473.574 0.589 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccn2cncc12 1835614845 PATIZWRFJRZTSO-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD CC[C@@H](C)[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737140 OLJMZCOQPSVFHH-QRWLVFNGSA-N 460.579 0.277 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1 1835927873 ZEZMTFNPUBXVJC-NRFANRHFSA-N 466.290 0.262 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(C)n1C 1836066979 WNCJWPYEIDUXGA-UHFFFAOYSA-N 466.391 0.821 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1836673043 LVMMRCIZXKZLFH-MGPUTAFESA-N 476.412 0.667 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1 1836973025 KHUQRICOOOZYSC-UGSOOPFHSA-N 457.325 0.519 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4scnc4c3)CCO2)C1 1837064803 OMXPBKIWAIZAAI-QHCPKHFHSA-N 496.549 0.679 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)COc3cccnc3)CC2)CC1 1837114519 YWYXGBCAPOWFDJ-UHFFFAOYSA-N 461.563 0.832 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCC=CO1)CCO2 1837410745 QHJCYIPTKBLIPN-LWIOAKLZSA-N 459.503 0.270 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ncccc1C(F)(F)F)CCO2 1838142443 WLVCWKSRCRRNJB-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD CC(C)N(C)CC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838395401 LQSOQRCDVRURLR-UHFFFAOYSA-N 460.579 0.638 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccccc3C(N)=O)CC2)CC1 1838675483 NOMWHLBKEYNVBA-UHFFFAOYSA-N 473.574 0.771 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838789228 MDSRWYVZJBTPQG-HXUWFJFHSA-N 467.611 0.663 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839023239 YJBIAQFSTCDILH-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)CC3CCC3)C2)C1)NC(=O)NCc1ccccc1 1839054793 LQYMKULVFVXFGS-VWLOTQADSA-N 487.601 0.979 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)N1CCN(C)CC1)CCO2 1839101283 MMEUAAIUNVUZEI-UWVAXJGDSA-N 475.428 0.110 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199435 WKCJODSFYXKJKS-NVXWUHKLSA-N 452.321 0.440 50 20 JCGD COc1cc(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1839254920 RNMZQVDVNRWHAM-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1839693700 URWGRGQDGMNGKE-XMSQKQJNSA-N 450.967 0.857 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(=O)Nc3cc(C)on3)C2)C1 1839964060 DQMLXINBYFYWJI-LIRRHRJNSA-N 487.351 0.942 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1cccc(F)c1F)CCO2 1839982828 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CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1847014714 QJEWHEMYIKHXCJ-IBGZPJMESA-N 461.538 0.449 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)NC(=O)CO3)c2ccccc2c1=O 24259111 RWEYIVKRIVIOPO-UHFFFAOYSA-N 457.468 0.761 50 20 JCGD CCOc1cc(C=NNC(=O)[C@@H](C)NS(C)(=O)=O)ccc1OCC(=O)N1CCCCC1 728436118 KZFLXSCMANHAHW-OAHLLOKOSA-N 454.549 0.864 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1 744440118 TWJBFMMOAZIVKA-UHFFFAOYSA-N 487.582 0.479 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)N[C@H](CN1CCOCC1)c1ccccc1 914598260 UAPUKNVCLDPTTA-QGZVFWFLSA-N 460.560 0.997 50 20 JCGD CN(C)[C@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccco1 915897088 UQDGSTFUXYIXCQ-QGZVFWFLSA-N 465.532 0.547 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1ccc(O)c(O)c1O)c(=O)n2Cc1ccccc1 916331297 GLYQJPQIASTCOO-UHFFFAOYSA-N 478.465 0.695 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1)N[C@@H]1CCS(=O)(=O)C1 919889494 NBSLWUBWJNZYIC-OAHLLOKOSA-N 498.608 0.626 50 20 JCGD 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CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(-n3cccn3)cc1)CCO2 1839338432 ZDTPLQGHHOLDQE-DEOSSOPVSA-N 484.557 0.315 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1O 1839426701 IWGMXTJUQSGFKX-DEOSSOPVSA-N 499.524 0.173 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)ccc3-n3ccnn3)CCO2)C1 1839479589 SYWTXPOSDCSBER-AVRDEDQJSA-N 477.949 0.900 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1839962514 IQOFZHNYOBMNSD-IINYFYTJSA-N 493.248 0.972 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1840031098 FPRNSAVMLXKJOB-IFXJQAMLSA-N 469.336 0.051 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@H]3COc4ccccc4O3)C2)C1 1840150137 GIZFVXWXFCLZLW-JLHGSKIFSA-N 468.934 0.927 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1840151269 XIVBCHLXWJMTCC-LIRRHRJNSA-N 459.952 0.188 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cnc[nH]3)CCO2)C1 1840342412 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489.554 0.350 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 913606435 PAQHHAVNKYQBFQ-UHFFFAOYSA-N 498.558 0.740 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1 915165445 AYFBDZKXLIMIPM-UHFFFAOYSA-N 457.505 0.991 50 20 JCGD Cc1nn(CCO)c(C)c1C=NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 1251256952 DRJHHJIVBKUVQH-UHFFFAOYSA-N 463.560 0.596 50 20 JCGD CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)C1CCN(c2ncccn2)CC1 1326380511 OHDFZUQZWQNFQD-UHFFFAOYSA-N 471.543 0.435 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(O)c(O)c(Cl)c3)CCO2)C1 1779037065 MFTVLPBVAQZFFQ-OAQYLSRUSA-N 475.889 0.507 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371125 GPMMVIYTGCZEDJ-IUBQTAPSSA-N 495.584 0.818 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1780202812 WESCIIYTBVKSSI-BUXKBTBVSA-N 480.319 0.905 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1 1780221651 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O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[C@@H]1CCc2ccccc2[C@H]1O 1784148499 LQFVORJPXDNCFK-PIAWWSJMSA-N 478.354 0.256 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1 1785334113 MGAFCVZMDMLCSZ-LRULAXNGSA-N 490.561 0.865 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CN3CCN(C(=O)OC(C)(C)C)CC3=O)C2)C1 1785669852 QHOHJZDUMPZGOV-AOMKIAJQSA-N 486.997 0.913 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1785735285 PCAHGMCGERHZCZ-XMMPIXPASA-N 489.378 0.361 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc4c(c3)OCO4)C[C@@H]21)c1cccc(B(O)O)c1 1786984428 LKTBJJLORORNON-LEDOBFOHSA-N 480.326 0.321 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CN)c3ccccc3)C[C@@H]21 1787508840 LPWLRMAFGWYXFB-HYTUWZOFSA-N 480.569 0.843 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(Cl)nc3)C[C@@H]21 1788607956 YZJDXLGLGGUJKV-UVBJJODRSA-N 459.894 0.036 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3cnc4[nH]ccc4c3)C[C@@H]21 1788610055 ZELRKUBJARYGEX-YYWHXJBOSA-N 491.552 0.788 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)ccnc3Cl)C[C@@H]21 1788611695 RPPBVHRCKDWGKD-PJODQICGSA-N 476.896 0.780 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc2n(n1)Cc1ccccc1NC2=O 1789154848 YAOQYRXUFAYLJW-QPAVJXABSA-N 487.944 0.690 50 20 JCGD CCN(C)[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1790554823 WKTZZUHIPXNTLX-GBAJDQEWSA-N 488.633 0.653 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3ccc(C)cc3)C[C@@H]21 1791256365 NUKILLSRCCNPRV-VJANTYMQSA-N 451.951 0.958 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1NC(C)=O 1791290810 NVWCAVPOLVVQEB-WFXMLNOXSA-N 489.573 0.620 50 20 JCGD CN(C)C(=O)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1792630319 BRKUKEHPVFZELA-ZMMAXQRCSA-N 481.391 0.853 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C#N)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)CC1 1792979019 QTYQXGSGCKNTKJ-YYIAUSFCSA-N 484.981 0.717 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NS(=O)(=O)CC 1793318310 OMCJUCJPVIAWSH-HPCHECBXSA-N 454.387 0.077 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(C(F)(F)F)n1)C2)c1ccc(B(O)O)cc1 1795734170 HCNFYHCNQJSIEX-JJLQDPRZSA-N 469.250 0.359 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C13CC(c4ccccc4)(C1)C3)C2)c1cccc(B(O)O)c1 1795741083 IQNCDJJJHZFLQK-LJAOBULASA-N 460.339 0.692 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(n1)NC(=O)CC3)C2 1796440500 OAPHRAFDIVXCOJ-JQQBHDRDSA-N 493.524 0.304 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(Cl)c(F)c1)C2 1797748743 ZMKQEUIRMMNJDX-NXCRSVRDSA-N 491.907 0.760 50 20 JCGD CO[C@H](C)[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)N(C)C(=O)OC(C)(C)C 1799169759 JQCJWCNYZXLOTC-DBHDPKECSA-N 477.986 0.446 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC[C@H](N)C(N)=O)C2 1800332921 CEUGRTADVNBTBG-WWKBNMOASA-N 461.469 0.054 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Br)ncc1F)C2 1801011128 FSUPRVBZTLIRKO-KSPBDQMDSA-N 486.342 0.559 50 20 JCGD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)[S@](=O)c1ccccc1 1801276531 UCIQYGRUWFQRLK-PTHBEVMPSA-N 454.357 0.815 50 20 JCGD C[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2)n1ccnn1 1801341514 RXXRWTFAJAELEU-FFGOWVMKSA-N 468.562 0.824 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362623 MOMRZSPBQVNPAC-PXNSSMCTSA-N 486.297 0.143 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccccc2-n2nccn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807367140 QKQLGSZXGUAKMS-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807367995 PHADKTQGNRSVKT-URXFXBBRSA-N 475.358 0.985 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCN2CCCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371088 PHJMZIIFSLBIEK-URXFXBBRSA-N 464.375 0.957 50 20 JCGD Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1 1807534364 XEPJXVUGUJVGOR-UTKZUKDTSA-N 465.344 0.484 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C2CCOCC2)[C@H]1c1cccnc1 1810298335 HPCNUFGBKMZNJA-PXNSSMCTSA-N 452.515 0.826 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1 1812392609 UAQBZYIOQMLALT-YCPHGPKFSA-N 469.336 0.804 50 20 JCGD N[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccccn1 1815012144 UAUFTYRPVUBGJI-KSSFIOAISA-N 451.317 0.144 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CN3CCN(C)CC3)sc2C1 1818798703 UEXPGVAXFHJKOK-PJAVDKHJSA-N 486.602 0.437 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCO4)sc2C1)c1cccc(B(O)O)c1 1819115477 ISWWHRFZILJKFW-CQSZACIVSA-N 467.316 0.342 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052479 KIVOYRNLLZSUAL-OAQYLSRUSA-N 451.332 0.612 50 20 JCGD COC(OC)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548281 HOLALTOLSITTMO-VGOFRKELSA-N 483.949 0.657 50 20 JCGD NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551142 KENZYLCTDZOPJR-VGOFRKELSA-N 480.949 0.304 50 20 JCGD O=C(C[C@H]1OCCc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831246709 XBTKAGZBPWACTK-BVAGGSTKSA-N 494.353 0.141 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)COc2cccnn2)CC1 1832193877 JLDZFZZNIZVPRJ-IBGZPJMESA-N 467.530 0.787 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833084118 PBUFHDCPNDIVRJ-IBGZPJMESA-N 493.417 0.557 50 20 JCGD Cc1noc(C)c1CC(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1833730186 MYHJBYTWFCNPAK-UHFFFAOYSA-N 462.595 0.779 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccccc1Cl)CCO2 1835013957 NILGFPSBFPRPTO-QFIPXVFZSA-N 466.966 0.712 50 20 JCGD Cc1ccccc1OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1835155503 ULWBDVWKWBHVJO-QHCPKHFHSA-N 462.547 0.203 50 20 JCGD CN1CCN(CC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)CC1 1835482734 OOEJHBOSUDRNJG-SFHVURJKSA-N 462.408 0.496 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc12 1835937399 UDUKOAYTTALSDJ-RUZDIDTESA-N 477.326 0.540 50 20 JCGD Cc1noc(C)c1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837437556 ZJWXKTSXNLWOLF-UHFFFAOYSA-N 455.320 0.897 50 20 JCGD CCc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837456875 PHPDVWRLESAIRY-QHCPKHFHSA-N 468.514 0.026 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=S)NC)CCO2)C1 1837467001 ARZORLCJYAWABI-SUMWQHHRSA-N 465.414 0.100 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1 1837713319 VSLZKWHHGBGFHP-QFIPXVFZSA-N 477.590 0.939 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1838103245 SGFPKKYJBPDQFI-SXJXFNOXSA-N 474.562 0.644 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1838934625 DOVMEHNZUUHBDA-HSZRJFAPSA-N 478.546 0.147 50 20 JCGD O=C(CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)N1CCCC1 1839199535 XUOBSHHFYWGCNE-FUHWJXTLSA-N 464.332 0.536 50 20 JCGD O=C(COC(=O)C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200644 NSMIWLDCFXBZFQ-MFKMUULPSA-N 465.194 0.239 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3nn(C)cc3c1)CCO2 1839506243 IJJVACAUHPALOW-HSZRJFAPSA-N 472.546 0.016 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](Br)Cc4ccccc4)CCO3)C2)O1 1839801588 RJELGBCVTSAUGI-FIKGOQFSSA-N 496.358 0.557 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H](O)CN3)C2)C1 1839802033 KIJNNMHNENYEBD-ZVVDCOBXSA-N 496.402 0.172 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1839966278 ZSHCZWHLDCOODH-DNVCBOLYSA-N 466.336 0.973 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1 1840155163 RONVBLOWCRDPQY-AUUYWEPGSA-N 457.867 0.624 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1 1840156336 QVKYAAHZZNAXLC-SXGZJXTBSA-N 463.959 0.610 50 20 JCGD Cc1cccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c1 1840182804 VIIQQVRCKHYCMN-DEOSSOPVSA-N 460.575 0.757 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(Cl)c1 1840186968 HEUKUFBYDYNSPL-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1 1840498528 PHPGADJSPXKPJP-QFBILLFUSA-N 456.337 0.960 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)cc1F 1840772688 JNUCZDCIXUMTCN-YJBOKZPZSA-N 466.890 0.834 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1 1840820369 MCLFGYIYKVOSSA-DYESRHJHSA-N 451.907 0.647 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCO2)C1 1840887803 DHRVQACSDFCKTH-OXJNMPFZSA-N 473.885 0.987 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)[C@H](F)Cl)C1 1843363423 CVJXGEMTYAWHQM-IRXDYDNUSA-N 497.760 0.540 50 20 JCGD CCC(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C1 1843428727 NBQZVTJSFQSFIF-SFHVURJKSA-N 459.352 0.416 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CCN(C(=O)OC(C)(C)C)C2)C1 1843905825 YPIAGGMERDTNOA-INIZCTEOSA-N 451.568 0.820 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844264415 PXSXHMDXFJFNBP-QHCPKHFHSA-N 490.536 0.851 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)cc1 1846507459 IXOHQPHNXDFWMJ-ZWKOTPCHSA-N 469.991 0.951 50 20 JCGD C#CCCC(=O)N1CCCC12CN(C(=O)[C@H](Cc1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C)C2 1846997901 KUQMVEFCLKWBOX-FQEVSTJZSA-N 483.374 0.419 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1cc(S(N)(=O)=O)ccc1OC 10453723 VTYPRSHIXTUAIK-UHFFFAOYSA-N 471.875 0.623 50 20 JCGD CC(C)CCOc1ccc(C(=O)NNC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)cc1 16229209 PCFVUDWEGCBPKE-UHFFFAOYSA-N 456.503 0.710 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)c1 728205919 LSNHWCHUZDEFPF-UHFFFAOYSA-N 491.570 0.655 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1CCCN(C(=O)c2ccc(Cl)c(Cl)c2)C1 729275821 RVOGCEFFELOSRP-ZYHUDNBSSA-N 465.359 0.931 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl 751212059 OGZLDKKRASKEFS-UHFFFAOYSA-N 470.891 0.145 50 20 JCGD Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)c1C 912919049 HIAOIJWUXOUNSO-IYBDPMFKSA-N 454.593 0.845 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1 914109960 UBCBZBCTVZTTBT-QGZVFWFLSA-N 463.516 0.415 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)c2ccccc2c1=O 914750356 DVMIKKMZKCMEJZ-UHFFFAOYSA-N 489.510 0.666 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC[C@](O)(c1nccn1C)C(F)(F)F 916378406 NGRXJNPVMQSQAN-KRWDZBQOSA-N 491.496 0.806 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCn2cc(Br)cn2)cc1 917912411 YKTBHJPYPFNJFP-UHFFFAOYSA-N 458.338 0.812 50 20 JCGD CCO[C@H]1C[C@H]1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 918017309 SGULFHHZRSNEMT-CVEARBPZSA-N 454.487 0.000 50 20 JCGD O=C(CCC(=O)c1ccc(I)cc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886487 UHUZRYIZXFSCME-LBPRGKRZSA-N 479.296 0.772 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NC[C@H]1CCOC1)N(S(C)(=O)=O)CC2 1319045936 CIFKHJXXMSTWET-CZUORRHYSA-N 470.548 0.320 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(C(F)(F)F)n3)CCO2)C1 1779031647 COCYFCQNYOUJEO-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD C/C(=C\c1cccnc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779033744 CRAVBNCGUQPMAT-UUFSLDAJSA-N 450.499 0.627 50 20 JCGD CN1CCC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)C1 1779374704 YLLTXMDFPQYNOQ-XKDCRVNJSA-N 458.563 0.154 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(c4ccccn4)CC3)C2)C1 1780960846 FSFIZLIHZUKTOA-XMMPIXPASA-N 472.590 0.501 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1782105484 YIZVRNAWBZEJRL-NRFANRHFSA-N 463.491 0.425 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1782618227 WDEFLRSKBJGJGD-YADARESESA-N 474.606 0.503 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)[S@](=O)c1ccccc1 1782688582 YHPYBNLDDJRPMH-FMADHPALSA-N 464.588 0.386 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCc4ccccc4C3)C2)C1 1783404664 QYNXSBAVEYHAOV-CLOONOSVSA-N 463.538 0.934 50 20 JCGD COc1cccc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1783414241 YGBLBCZIXYGQOR-HCXLOTKHSA-N 450.300 0.532 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1783687775 ZPXBLZOVIKKVMG-GOSISDBHSA-N 457.351 0.316 50 20 JCGD O=C(Cc1ccc(Cl)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1783815429 RRJABAVBKUCULI-MDKPJZGXSA-N 474.725 0.995 50 20 JCGD CO[C@H](C)[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)N(C)C(=O)OC(C)(C)C 1784093251 SZAWUYDBJBDBGQ-PXOUGSPUSA-N 492.013 0.836 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1784191341 ANZRINZDLNJTEW-WOYTXXSLSA-N 475.970 0.202 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1)n1cnnn1 1785079508 OJVFJTTTYJIKSU-YXMSTPNBSA-N 485.973 0.346 50 20 JCGD CC(C)(C)OC(=O)CCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983336 NSXVAOAVFJUMTN-IHPCNDPISA-N 474.363 0.472 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1)C(C)(C)C 1787506527 CMXRZFQTPITREI-XKXFTIQBSA-N 488.589 0.651 50 20 JCGD CN1CCN(CCC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)CC1 1788140711 MPTFGQJSUXMYKK-UHFFFAOYSA-N 464.375 0.752 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3cc(C(=O)O)ncn3)CCC2)cc1)c1cccc(B(O)O)c1 1788145894 CAGTZLCWZWSHEO-UHFFFAOYSA-N 460.255 0.916 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611086 LCEHJNZLRCGPAS-OQRYQMPQSA-N 494.552 0.097 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1cc([N+](=O)[O-])cc2c1OCC2 1789218717 ONDMCTKRCCNFAA-SJWGOKEGSA-N 453.879 0.723 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(O)c(O)c(Cl)c1 1790243536 VZNAYNIBPFRHPL-AXHNFQJDSA-N 474.706 0.338 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790382836 NQUJCTPNQYEJMH-JVPBZIDWSA-N 495.515 0.687 50 20 JCGD COC(=O)NCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21 1791476365 SFDRDFVXCOILIH-OWQGQXMQSA-N 478.458 0.469 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1792489710 KHVDDFJOYSKQNS-ASLGKTPDSA-N 486.481 0.582 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(c2ccccc2)=NO1 1793280315 BIGDJFMUYKWBQN-ZRAXVTTISA-N 457.531 0.142 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC(=O)NC1)C2 1793879921 SDYHHQABYIMXBL-LFYQSXPISA-N 472.970 0.234 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795116924 AQVRZSFZMCMZLG-ZWUHOBOKSA-N 491.383 0.130 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736859 OJTUPUZCADXKCR-XCRNZQRYSA-N 454.307 0.588 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1CN(Cc2ccccc2)CCO1 1796189069 SICHXAHWLVYTPF-KIHHCIJBSA-N 477.370 0.519 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)cc1Cl)C2 1797754439 XFIXBNBHFBGSGE-GAKFLWOGSA-N 485.928 0.961 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797956400 BOHCFJHDNMNKPM-OYNZLANYSA-N 485.654 0.798 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)Cc1cccnc1)C2 1798522251 LPKJMNKNAIQVHE-AXRVMRSRSA-N 497.508 0.688 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(F)c(F)c2)CC1 1799064992 HNARRRBDDRGMKE-VPTLXERWSA-N 470.281 0.580 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1)c1ccc(B(O)O)cc1 1801415682 RHNDAYPEJZRKBT-DMRZNYOFSA-N 476.264 0.775 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CNC(=O)c2cccs2)[C@H]1c1cccnc1 1804573820 HWNAJRWLGSXCRV-VGOFRKELSA-N 486.598 0.952 50 20 JCGD COc1ncc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1F 1807369862 XJTWJQYCFAMFKK-UWJYYQICSA-N 478.289 0.938 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N3CC[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)c21 1807373415 AWOIRUYPFQMAJB-AVRDEDQJSA-N 499.336 0.987 50 20 JCGD O=C1Cc2cccc(C(=O)N3CC[C@H](CNC(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)c2N1 1807373501 SGZBWSZKHSKLNT-DVECYGJZSA-N 484.321 0.889 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374682 HFVGCNPFNWFULX-GCJKJVERSA-N 470.298 0.438 50 20 JCGD Cn1cc(CCC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1807427976 YHZMVIAPBALUAW-REWPJTCUSA-N 461.331 0.447 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc3ncccn3n2)[C@@H]1c1cccnc1 1809763975 FIZGRMHNFCLEFG-IERDGZPVSA-N 485.508 0.756 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc2n(n1)CCC2 1809982534 SFQVGPGLSRLSIC-PGRDOPGGSA-N 459.315 0.538 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)C1 1810295389 SIRIGSYMINTZMM-HPNQWNLUSA-N 494.552 0.989 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810305675 OVTKWVWGIIGNOH-LAUBAEHRSA-N 480.525 0.909 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)C[C@@H](N)c3cccnc3)sc2C1 1815178946 YPYVJOGWQFQTPY-CZUORRHYSA-N 480.554 0.853 50 20 JCGD Nc1c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)sc2nccnc12 1815253152 UQMWDRONKCSIIC-LBPRGKRZSA-N 494.367 0.949 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1n[nH]c3c1CCCC3)CC2)c1ccc(B(O)O)cc1 1815340066 DGHJTNJHWLWCRO-CQSZACIVSA-N 465.344 0.964 50 20 JCGD O=C1COc2ccc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3ccc(B(O)O)cc3)CC4)cc2N1 1819146289 IBKDHTPAGWQLFV-HNNXBMFYSA-N 492.322 0.693 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@H](N)c1cccnc1)CC2 1819795269 LONHSWLPFNPWEI-BBRMVZONSA-N 480.554 0.853 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CNC(=O)C2)n[nH]1 1821961554 JBFQRCOFRXHZJD-NDYZHDMBSA-N 454.491 0.672 50 20 JCGD COc1nn(C)cc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827056206 QUJBZRRSKHCEQL-HXUWFJFHSA-N 454.336 0.656 50 20 JCGD O=C(c1cc(C(F)(F)F)ccn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732814 WAHDXJAHJSFGDC-WMLDXEAASA-N 451.829 0.770 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(C)n(C)n3)CCO2)C1 1830955316 KPIHHMQDXSUZJQ-QFBILLFUSA-N 457.369 0.901 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C2)C1 1831649729 BADCWMMCAMJXEB-QKLQHJQFSA-N 462.927 0.345 50 20 JCGD Cc1csc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1832981977 MCGOKEORALJYBJ-HSZRJFAPSA-N 487.582 0.758 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CC2)CC1)[C@@H](O)CCl 1833313679 MYQMMRMAOXIXDU-LZQZEXGQSA-N 454.999 0.559 50 20 JCGD CC(C)[C@H](S)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833491012 BWRHEMYGEKCACR-IBGZPJMESA-N 462.620 0.825 50 20 JCGD COc1cc(CCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccn1 1833738324 MLNOTLZRJVFVPC-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc(C)c(C)[nH]c3=O)CC2)CC1 1833940254 OWYIDZJFPPYNAT-KRWDZBQOSA-N 453.971 0.826 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3csc4c3CCCO4)C2)C1 1835928262 HJKMXIHSFFRIFZ-QHCPKHFHSA-N 486.355 0.137 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccc(Cl)cc1)CCO2 1836597523 NGPHRZADOOJUBI-RQTOMXEWSA-N 498.772 0.894 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cc(F)ccc4n3)CCO2)C1 1836962103 HPGCPRJWJDTLPM-MGPUTAFESA-N 454.886 0.797 50 20 JCGD O=C(C[C@@H]1CCCCO1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837049894 YHUAQLZPNGJPHH-QFIPXVFZSA-N 458.364 0.938 50 20 JCGD Cc1cncc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837456470 ILNIERNMTHDPGD-XMMPIXPASA-N 482.541 0.091 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C(=O)Nc3cccnc3)CC2)CC1 1838419988 YLBZXCUNFYBIJR-UHFFFAOYSA-N 474.562 0.392 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)nc4cccnn34)CC2)CC1 1838527008 JWBJHEDSHBDEDX-UHFFFAOYSA-N 499.572 0.075 50 20 JCGD O=C(Cc1ccc(Br)nc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839027615 KFSVFIQYIQRLQP-KSSFIOAISA-N 476.755 0.443 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(O)cc1F)CCO2 1839316208 KDLIIWVEXGKFSH-OJLHXUGZSA-N 487.488 0.735 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c([N+](=O)[O-])c1 1839462170 FKYYCUBJHLNJFH-UZLBHIALSA-N 485.877 0.051 50 20 JCGD Cc1ccn2c(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)cnc2c1 1839601773 UCXXDBDQRPMAPZ-DEOSSOPVSA-N 493.524 0.025 50 20 JCGD CCN(CC)C[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839677189 IFGJQMYHELVCJG-XXLKXFHXSA-N 490.605 0.555 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1840035267 LLVXTMWTDJIGDQ-JCGVRSQUSA-N 480.356 0.069 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(C(=O)OC)s3)C2)C1 1840154213 PHMMHBJZJTZMAM-FOIQADDNSA-N 474.963 0.787 50 20 JCGD C[C@@H](S)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1840159052 WKWLYPIDVRGGDA-BIENJYKASA-N 466.000 0.893 50 20 JCGD Cc1cccc2cc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)[nH]c12 1840184510 RIRDGTVVDTYPNX-XMMPIXPASA-N 471.558 0.919 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)[C@@H]2C1 1846133300 PVLWETGXUCSQQC-REPLKXPHSA-N 469.347 0.296 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN)c1ccccc1 1847451477 ALWZMFGAGJVEPO-GBESFXJTSA-N 466.498 0.598 50 20 JCGD O=C(c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847567799 DQXGZYJGXOWWOU-BZSNNMDCSA-N 471.963 0.123 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1cccs1 10778178 UILJYKQKOAGETB-UHFFFAOYSA-N 476.330 0.793 50 20 JCGD COC(=O)c1sccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 28694188 ORYYDAUAJQMAIV-UHFFFAOYSA-N 473.554 0.943 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)CC2)cn1C 109616002 KYLDQIUIDGICGM-UHFFFAOYSA-N 487.542 0.482 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1ccc(S(N)(=O)=O)c(Cl)c1 725907428 JRLLZGUBGCMJEE-UHFFFAOYSA-N 459.937 0.664 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(NC2=NS(=O)(=O)c3ccccc32)cc1 788023339 LJPVYHDVTHTNEX-ZDUSSCGKSA-N 462.509 0.443 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 912848152 HGCQAQZMRICKEH-RBSFLKMASA-N 495.627 0.956 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)c1 916516523 DZHKSYISSKYWNU-UHFFFAOYSA-N 454.530 0.154 50 20 JCGD O=C(NCc1cccc(CN2CCOCC2)c1)NNC(=O)c1csc(N2CCOCC2)n1 918224647 XMNSIBIHIHKSAA-UHFFFAOYSA-N 460.560 0.956 50 20 JCGD COc1ccc(-c2nc(CC(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cs2)cc1OC 919890003 YICJJJMPCSBQBR-GFCCVEGCSA-N 454.530 0.887 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 920051154 NNLXRTNEUJXKRK-UHFFFAOYSA-N 451.461 0.455 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1nc2ncccn2n1 1778589203 QAACOMAIMAKNGE-BWACUDIHSA-N 455.288 0.942 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031893 GVCCERRHNLSODU-QRQCRPRQSA-N 453.503 0.024 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1 1779177160 RIXXPTRHYXNTPB-UGSOOPFHSA-N 454.325 0.210 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)c1ccccc1)C2 1779371252 XHUQIFPQXMIPNM-JXALWOEJSA-N 467.526 0.546 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097356 YNRWQKFAFNBBHS-IIBYNOLFSA-N 477.474 0.411 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)NC(=O)NCc1ccccc1 1780559008 SKVOFVVLLVNGSX-DNVFCKCGSA-N 496.008 0.446 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1OC 1780655238 BHSFSCWRFMNZRC-HSZRJFAPSA-N 454.288 0.141 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccno1)CCO2)NC(=O)NCc1ccccc1 1780968495 BAAGDCCLAHEGOK-QFIPXVFZSA-N 456.503 0.464 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc(C)c(O)nc1=O)C2 1781904234 LOFIECWSHUWPEW-BXTJHSDWSA-N 485.379 0.945 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@]2(CN(C(=O)CNC(=N)N)CCO2)C1 1782869550 FVQDMXBATPOAHM-ULXKQSRTSA-N 475.347 0.669 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1783873026 ILGFESSBWFYDQM-TVSHIAKJSA-N 454.911 0.076 50 20 JCGD CN(C)C(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 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478.384 0.635 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)CO2)C1 1792984349 YLWPHMCDAIQHKL-KSWRQPAISA-N 487.981 0.202 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1792988629 SJOQUJLDBMWQQB-GGXPGOJBSA-N 469.583 0.110 50 20 JCGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1ccnn1 1793879247 SFNSKKLTPSHKDM-QMHWVQJVSA-N 470.958 0.561 50 20 JCGD CN(C)C(=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1795465086 PGYCMXMUQNRTSC-YVSFHVDLSA-N 452.349 0.670 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCS(=O)(=O)c1ccccc1)c1ccc(B(O)O)cc1 1795715687 QRBLTPNZYMNYEZ-ACDBMABISA-N 470.356 0.482 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3cccc(F)c3)CC1)C2)c1cccc(B(O)O)c1 1795737297 QAMKOFHWAROMLR-UPHUGPLXSA-N 452.291 0.441 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CS(=O)(=O)C2 1795930167 WCTLHDCSWAGUBX-QPPBUOOMSA-N 475.365 0.215 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccoc2c1 1796230497 CSZQQLKYLSSTEB-HBCWATKFSA-N 450.455 0.343 50 20 JCGD Cc1cc(C(=O)NCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)CBr)C3)no1 1797826284 RXSQANVKCOSXFC-YGSHXTJESA-N 457.325 0.333 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]cc1[N+](=O)[O-] 1798009696 IFKDRMGNGOUIOQ-DPIQGUFMSA-N 488.413 0.668 50 20 JCGD CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)nn1C 1798320209 PSBMRORMCONIBV-IHHIPJHASA-N 455.519 0.320 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799240438 IGRCQKWREQJZIW-NHKMSHSESA-N 477.301 0.500 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2 1799267937 IUXDYUVKSZCPNS-ZWUHOBOKSA-N 458.906 0.791 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cn1)C2)[C@H](F)Br 1799347399 JQNJNCARSKOAEF-RMHZUWNSSA-N 471.327 0.812 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1800369244 UHHPGBXZNKNOAC-XCRNZQRYSA-N 454.307 0.588 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1ccc(C(=O)OC)cc1)C2 1800982438 GCAKEGHYDVXUJT-LORHWOILSA-N 454.907 0.695 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807363672 CFEDGJNHOXCPHO-XMSQKQJNSA-N 472.310 0.494 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CSc2ncccn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370822 KYHUDRMYSQCYKY-NQIIRXRSSA-N 477.355 0.663 50 20 JCGD CC(C)n1cnc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1807373881 DDZGMFWMFXOUME-QUCCMNQESA-N 462.319 0.567 50 20 JCGD O=C(CCc1cncnc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807499647 HWYZIXYVAWTAPL-REWPJTCUSA-N 459.315 0.504 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnn2ncccc12 1808174501 SDTNBETXKXRGKR-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 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O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cn3cccnc3n1)CC2)c1ccc(B(O)O)cc1 1815344091 HFDGPJSAGOUBJK-CQSZACIVSA-N 462.300 0.405 50 20 JCGD O=C(COC(=O)C(F)(F)F)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356836 UECJLTAPNOQWDA-LLVKDONJSA-N 471.222 0.154 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)[nH]n1)c1ccc(B(O)O)cc1 1817472172 MOKILEOHZNWECE-AWEZNQCLSA-N 468.197 0.501 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc2nn[nH]c2c1 1821605440 CJDLXJGPYOHWOP-LJQANCHMSA-N 459.275 0.981 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)c2ccco2)[nH]n1 1822414628 XENKKFSBECCHLS-HNNXBMFYSA-N 459.507 0.798 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827050714 VLKFUPWMTCZEAK-NRFANRHFSA-N 457.380 0.762 50 20 JCGD O=C1CC[C@H](C(=O)N2CCN(C(=O)OCc3ccccc3)[C@@]3(CCN(C(=O)[C@@H](O)CCl)C3)C2)N1 1828915041 ILUDUEGNZVODLN-IEGUWTFLSA-N 492.960 0.317 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(O)ncn2)CC1 1828923738 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CC(C)(C)c1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835928294 IRJZHVSMJIJQLH-VWLOTQADSA-N 481.358 0.443 50 20 JCGD COc1ccccc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934086 MTACTFYENPHALM-VWLOTQADSA-N 482.342 0.078 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)CS(C)(=O)=O)CC2)CC1 1836875428 IPJCSLVEQXIKLY-YOEHRIQHSA-N 453.001 0.920 50 20 JCGD COc1ccc([C@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)cc1 1837455664 CEXQZLHXQWVRFM-SSOJOUAXSA-N 497.552 0.567 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837459328 CUAHBYMFQXPHFO-HSZRJFAPSA-N 469.498 0.078 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(OC)c1 1838880456 UOMWMLVWFTXSTQ-DEOSSOPVSA-N 499.524 0.086 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839154922 CEQUYOSCCISDOI-AHRSYUTCSA-N 490.388 0.150 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)CCO2 1839727175 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCC(=O)N1C)CCO2 1780098673 PLZGYGVFMHMNQV-JTSKRJEESA-N 474.470 0.584 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)[C@@H](O)C1 1780653057 JYIIRAVQHWZEPW-OCHXJIAHSA-N 489.997 0.328 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969924 NTTWQYFGTLPIBN-NSXLHWASSA-N 474.606 0.536 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781331053 JXUOJOFODDMISZ-VFVRVIDISA-N 481.363 0.749 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2)C(C)C 1781387158 QFGOPNXCTJMAQL-VCAMNPENSA-N 490.960 0.722 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(F)(F)c2ccco2)C1 1781520267 ISPUQNHTJOFOCS-DYESRHJHSA-N 462.258 0.879 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1781575284 CNWZWMMRGYARTI-QYUWHHMLSA-N 480.005 0.735 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc(Br)c(O)c3)C2)C1 1781697251 PJSDZRZXHOMNFM-NRFANRHFSA-N 489.131 0.592 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1 1782218617 KXNNWOLNQDOXLO-JOCHJYFZSA-N 483.916 0.972 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782536049 VXFVMZNKUQLSQW-WSCWJOSJSA-N 467.331 0.356 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CNC(=O)C3)C2)C1 1783163312 SEBKIKANGPCBPB-SZNDQCEHSA-N 460.443 0.100 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1783343702 PDWAAJONHYNAPR-BEFAXECRSA-N 453.337 0.815 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1783508076 PYFJNHWLIUFMKT-LDBYXDLTSA-N 453.923 0.731 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1783666972 PGPXEUQITVPTLM-YJBOKZPZSA-N 451.358 0.669 50 20 JCGD CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)CC1 1784085755 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0.864 50 20 JCGD COC(=O)C1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)CC1 1790887584 OITCYUKPVVDCJE-RPIBGLMYSA-N 459.503 0.053 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccnc3Cl)C[C@@H]21 1791287982 JWIVLFFZAFFTEQ-ULQDDVLXSA-N 451.955 0.630 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)c1ccccn1 1791714295 FLAFRGKXZZVEBS-OFVDUGFESA-N 452.515 0.477 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc2c(c1)CCCO2 1791912492 SVPSFMKGXUAVGB-RRPUWOKSSA-N 464.327 0.599 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1792533452 VMEQHOMWKDNPAJ-BPKGMFCQSA-N 474.986 0.623 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1793100670 PZJKUZNBOLKDML-VPTLXERWSA-N 454.531 0.466 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2c(s1)CCC2 1794960341 SRWCBXLXCSBMPJ-HBCWATKFSA-N 455.540 0.752 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nscc13)C2)c1cccc(B(O)O)c1 1795740517 DHSVCTWHZHALQE-YVWYUNDQSA-N 451.313 0.493 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796368024 AGMLCKXJNVTSAN-GHAFOHNQSA-N 475.945 0.869 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3ccoc3C1)C2 1797748711 WRTLSEJFVZFJPG-MFCZKXCZSA-N 453.499 0.286 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(-c2cccs2)on1 1798126689 JTYYYDZAASRYDT-YVWYUNDQSA-N 467.312 0.600 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798442768 TYFQHBBIPDQFRN-VQQMMKBISA-N 496.543 0.823 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn2c1CNS(=O)(=O)c1ccccc1-2)[C@H](O)CCl 1799093742 ROLLMBKPYTYRQN-UMPJEAMMSA-N 493.973 0.516 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccccc1=O)C2)NC(=O)NCc1ccccc1 1799871419 CGWICSHGXBUPGJ-WKCHPHFGSA-N 480.569 0.833 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cn2cccc(Br)c2n1 1800004407 LPXZMJRYRCOOOV-BAESOJJISA-N 471.739 0.900 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1CN(C(=O)OCc2ccccc2)C1)c1ccc(B(O)O)cc1 1801580233 QIILSJVYMKQRBY-NUNAXRQHSA-N 491.353 0.887 50 20 JCGD Cc1nc(O)c(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1C 1804878170 JBONHNWOBYUBHL-GHTZIAJQSA-N 475.314 0.507 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361104 DZGBKGPHBOZVAM-YKSBVNFPSA-N 478.358 0.484 50 20 JCGD COc1ncccc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807363294 OIZTUUBTQSBYTC-RXVVDRJESA-N 460.299 0.798 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C2CCC(O)CC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374078 IFOJEFMNTBWDBB-CYGMFBECSA-N 451.332 0.632 50 20 JCGD CN1CCC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)C1 1807552007 QUFIMHJPGOPLME-BBTUJRGHSA-N 465.558 0.742 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303204 QRHFDCDBCYNLLX-XPIZARPCSA-N 489.540 0.690 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1 1810309131 PNYQZCFXFSTUSF-OPAMFIHVSA-N 475.509 0.743 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cccn(C(F)F)c1=O 1810603974 UXCKGAQQEYFIOS-PXNSSMCTSA-N 496.279 0.952 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1)c1ccc(-n2c(O)nnc2O)cc1 1811423630 DTSJCXAGOHXOMH-JQHSSLGASA-N 486.916 0.993 50 20 JCGD C=CCNC(=O)/C=C\C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1814437832 FGTZABJLARWIMF-TUYSUELWSA-N 466.502 0.573 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CC(=O)NC2=O)n[nH]1 1815664318 RPTHXPPTYLAFOT-PWSUYJOCSA-N 455.313 0.985 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)Nc1cc([C@@H]2CCCCN2C(=O)C(Cl)Cl)[nH]n1 1815672925 IUYQHMHVTKPDGO-LBPRGKRZSA-N 452.364 0.936 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnnn2C)n[nH]1 1816034430 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O=C(CCNC(=O)c1ccccc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1827964310 ADYBPUYJLPAQKV-SFHVURJKSA-N 492.366 0.869 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1828262830 QRPPPZSCIPVPJN-KSSFIOAISA-N 492.366 0.867 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828926036 WTLXKNHGKKCMDP-SFHVURJKSA-N 465.576 0.353 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1830535084 IQMXDJQXQNIFTB-CXAGYDPISA-N 474.312 0.279 50 20 JCGD Cn1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1C(F)(F)F 1830724998 KTVDTNDFQBROLP-LRDDRELGSA-N 454.833 0.109 50 20 JCGD O=C(c1ccc(-c2ccc(O)nn2)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830734919 AFWHECAYFBVKDR-GCJKJVERSA-N 476.917 0.519 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(C)c1 1830737715 GPTRVNRFQLXFGI-UWJYYQICSA-N 454.907 0.451 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2 1830811081 RHUTWLITJXFZMR-DEOSSOPVSA-N 495.536 0.193 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccncc3Cl)CC2)CC1)c1cccc(B(O)O)c1 1834801204 QHPPKRDUDYOEIV-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3nccs3)CC2)CC1 1835736978 DNZZBFLPEDKTSP-UHFFFAOYSA-N 457.560 0.641 50 20 JCGD O=C(c1cc2sccn2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928273 HXWDJHXDURODKO-JOCHJYFZSA-N 469.328 0.064 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1F 1835934246 RFEAOBZYZQBYPX-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cn4cc(Cl)ccc4n3)C2)C1 1835937174 QYJYTNNIGOTNCR-QHCPKHFHSA-N 498.732 0.051 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCC=CO1)CCO2 1837410743 QHJCYIPTKBLIPN-IJRBDHGVSA-N 459.503 0.270 50 20 JCGD COC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1838103240 SCJZOSIDYCOOHX-MFKUBSTISA-N 476.534 0.475 50 20 JCGD O=C(c1cncc(C(F)(F)F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838179917 UMHZDZFXBRMTJT-YOEHRIQHSA-N 451.829 0.770 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)COC(=O)C(F)(F)F)CC2)CC1 1838376366 NODIUWHPYIMREY-UHFFFAOYSA-N 480.484 0.464 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)cc(F)c3)CCO2)C1 1839001622 DIOMRDLNGCJOFM-JOCHJYFZSA-N 475.452 0.347 50 20 JCGD CCO/C=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054316 TVEBVOWMTJSKHD-LUFJGRFYSA-N 489.573 0.339 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(CS(C)(=O)=O)nc3)C2)C1 1839144361 WFGLMYMPQCJTDE-PXNSSMCTSA-N 473.979 0.714 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1 1839197386 SUBQTDWIVGPNDO-CRAIPNDOSA-N 493.351 0.851 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(NC(C)=O)c1ccccc1F)CCO2 1839233739 LJHXDPOLTRNIOU-YSZBQJHXSA-N 499.967 0.887 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1839964205 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NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cc(F)c1F)CCO2 1840718544 ANLXGSMHDSNGBY-QFIPXVFZSA-N 493.442 0.486 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cccc(=O)n1O)C2)NC(=O)NCc1ccccc1 1845038430 BAMGCLQWGUYRGF-UHFFFAOYSA-N 468.514 0.249 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC2(CCCN2C(=O)[C@@H](Cl)COC)C1 1846363905 KSEREJYWEYLGMH-KRWDZBQOSA-N 450.960 0.530 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1 1846950983 UYQVWIMBBONNEH-UHFFFAOYSA-N 469.347 0.751 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1C(=O)C=CC1=O 1848098742 UQRNOOUSRZCQGC-IHRRRGAJSA-N 454.911 0.245 50 20 JCGD CN(CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1)CC(=O)Nc1ccc(N2CCOCC2)cc1 16589117 XYSPLFUYBVJQOF-UHFFFAOYSA-N 470.486 0.763 50 20 JCGD COCCCNC(=S)N(C)NC(=O)C1CCN(S(=O)(=O)c2ccc(OC)cc2)CC1 726075230 AMLBZNAVDFUKAH-UHFFFAOYSA-N 458.606 0.970 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)C1 728260601 KKTSBSZAJHCCMI-ZNMIVQPWSA-N 493.629 0.097 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C1 728262589 HAYPAUVHCNCGKW-GASCZTMLSA-N 498.583 0.686 50 20 JCGD Cc1cc(N2C[C@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)CC2=O)ccc1Br 729276644 JQTUEXTXVPMTSJ-WDEREUQCSA-N 461.338 0.196 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2ccc(N3CCCCC3)c([N+](=O)[O-])c2)c(=O)n(C)c1=O 730568778 AYNIUINLGICODN-UHFFFAOYSA-N 461.504 0.620 50 20 JCGD NC(=O)[C@@H]1CCCN(Cc2cccc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)c2)C1 731047332 QXOLZDHNPGJCPF-OAQYLSRUSA-N 494.600 0.921 50 20 JCGD COc1cc(Cl)ccc1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 789911103 GOZFCPJUICUOFX-UHFFFAOYSA-N 456.908 0.783 50 20 JCGD Cn1ccnc1[C@@](O)(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)C(F)(F)F 818650050 UGTPNKDIBPFRPZ-SFHVURJKSA-N 489.476 0.806 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2ccc(-n3[nH]c(CC(=O)OC)cc3=O)cc2)c2ccccc2c1=O 915190603 NPSXTFXEWPMGHH-UHFFFAOYSA-N 490.476 0.686 50 20 JCGD CCN1C(=O)c2ccc(C(=O)NNC(=O)c3sc(N4CCOCC4)nc3C)cc2S1(=O)=O 917520963 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JCGD CC(=O)O[C@H](C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(C)C 1807360007 GDGRGCLOXVZUOD-NNWRFLSQSA-N 467.331 0.669 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nc(CO)[nH]c3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362904 NXVCAYCXRWKPKQ-CYFREDJKSA-N 499.336 0.763 50 20 JCGD COc1nccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1F 1807371099 PUGMNHBCSBYXDK-DYESRHJHSA-N 478.289 0.938 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807376364 YMSCSMVLWYHBFZ-KPDCDPCYSA-N 474.326 0.944 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1808416647 PRNLFFGFWYVZTC-YQPWQLKSSA-N 496.572 0.594 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808418145 ZVNJPWSGHZSRQN-RYKJXZDESA-N 496.572 0.929 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1 1810060407 PBTOBEKSLCNMHI-VGOFRKELSA-N 464.530 0.817 50 20 JCGD COCCOCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810298221 GXFLGVZKEGGHJL-OXQOHEQNSA-N 456.503 0.063 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1 1810303847 ZBVWQBPVJZDAET-IIBYNOLFSA-N 474.525 0.856 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1cncn1 1810306886 BELXBPROEKEWKG-SIXWZSSISA-N 463.502 0.252 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1810539846 GGTVPQBYCQVKAQ-CRAIPNDOSA-N 458.528 0.664 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[C@@H]1c1cccnc1 1813030484 HVMKKUCCJKERLH-QIIPPGSGSA-N 481.962 0.807 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813074618 UPMPUMGZOBZKDO-HGHGUNKESA-N 456.551 0.388 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CCCC[C@@H]2c2cc(NC(=O)[C@H](O)CCl)n[nH]2)N1 1814875402 YILUOVJUVFPZHM-ZGKBOVNRSA-N 498.993 0.182 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)C(F)(F)F)CC2 1817283010 PYHKKPRPDATLCN-QXBUHNKDSA-N 499.475 0.868 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817478888 JVWGEWFDCSHJLM-KRWDZBQOSA-N 456.308 0.985 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc(-n2cccn2)nc1 1820735198 NYOBSWKFYGVCAN-KRWDZBQOSA-N 488.338 0.943 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1824524847 QWACXAHUULKZGP-UZLBHIALSA-N 464.393 0.280 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1n[nH]c3c1CS(=O)(=O)C3)CC2 1825997988 DUXSYCWPOFFTQA-WCBMZHEXSA-N 473.964 0.774 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCc3ncc[nH]3)sc2C1 1826517534 SVPFWFVJQQUEQZ-LLVKDONJSA-N 454.516 0.723 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1 1827050805 ZHDMQHPJEMZXFG-JOCHJYFZSA-N 499.398 0.712 50 20 JCGD CN(C)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828927419 DMPCOUKBQSTLRI-CVDCTZTESA-N 480.993 0.990 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1829093724 NMXBKGNXKILPKC-KXBFYZLASA-N 456.547 0.609 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(C(F)(F)F)o1 1830728736 XJCQJORLMXYSAW-MEDUHNTESA-N 455.817 0.672 50 20 JCGD O=C1CC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)=Cc2ccccc2N1 1830731484 KDZZMWICVBIKSQ-AVRDEDQJSA-N 463.918 0.468 50 20 JCGD CC(C)N(C)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551389 MBQXXWLWNZKIHH-JTSKRJEESA-N 491.029 0.915 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)cn1 1833437150 ZLFVBFZRYNSNOF-SCLBCKFNSA-N 457.325 0.729 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC3CCCC3)CCO2)C1 1834671460 NWPCXVLYTVBDDJ-QHCPKHFHSA-N 459.547 0.726 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc4ccccc4n3)CC2)CC1)c1ccc(B(O)O)cc1 1834798498 CEEFOSHDMJEKHQ-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD O=C(Cc1ccc2ncccc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934341 WEASOKRQNMOKIX-AREMUKBSSA-N 489.337 0.227 50 20 JCGD O=C(NC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1)OCc1ccccc1 1836688958 HIRXDEIVQAFYIN-XMSQKQJNSA-N 495.960 0.502 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3scnc3C3CC3)C2)C1 1837456737 MURBVGZCXVWFCX-JOCHJYFZSA-N 486.554 0.403 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)ccc3F)C2)C1 1837460706 JOQXKUDOIPOQHY-HSZRJFAPSA-N 489.479 0.276 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1837715220 CSHAJJDUSRSDQT-HXUWFJFHSA-N 450.568 0.328 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)nc1)CCO2 1837843675 SWLHJQVTJUVVDB-WGLQLPMYSA-N 472.477 0.425 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 1838568785 LRSSASYBMTYISR-VFNWGFHPSA-N 499.358 0.689 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1839692485 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Cc1c(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)cnn1C 1845038520 MUCQBNURPLIHLM-UHFFFAOYSA-N 453.547 0.892 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1845147009 ZBXGDVOFPGLTIO-MRXNPFEDSA-N 497.593 0.409 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C1)C(=O)NC[C@H]2C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1847100595 NDXKEZQEPDJUIV-DFFLPILJSA-N 484.981 0.163 50 20 JCGD CCn1c(=O)c2ccccc2n(CC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1=O 12702804 DJHKJCFQOQBDRJ-UHFFFAOYSA-N 472.527 0.246 50 20 JCGD O=C(Cn1nnc2ccccc2c1=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 15664621 QGWDDQURMFPSPY-UHFFFAOYSA-N 492.517 0.731 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCCC(=O)N1CCN(c2ccccc2)CC1 726250887 JVRBUQIRFJGSSQ-UHFFFAOYSA-N 458.544 0.547 50 20 JCGD C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728367515 HGQDJGGMBXQRLX-SJKOYZFVSA-N 467.438 0.212 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@H](CC)N=c2nn[nH]n2-c2ccccc2)c2ccccc2c1=O 729258468 XONHAKDJQNVFKW-SFHVURJKSA-N 475.513 0.856 50 20 JCGD C=CCNC(=S)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C/c1ccccc1 825123408 QQYSIAZCEVBGOQ-GLNPCMGASA-N 460.603 0.061 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN(C)S(=O)(=O)c2ccc(C)c(C)c2)n1 904226771 LBBZNXVCPMZWRA-UHFFFAOYSA-N 468.557 0.622 50 20 JCGD O=C(CN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 913606420 LVCRNPBQDOJLRX-IRXDYDNUSA-N 462.528 0.407 50 20 JCGD COCCN1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)Nc3ccccc3OC)c2)CC1=O 914457088 NLDAGUBSVMWUNY-MRXNPFEDSA-N 490.538 0.752 50 20 JCGD CN1CCN([C@@H](CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c2cccs2)CC1 915901317 HIPIOIWWZYNJPF-INIZCTEOSA-N 479.632 0.974 50 20 JCGD Cc1nc2c(C(N)=O)cnn2c(C)c1CCC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 917387501 WXYHERVAOQFUQR-UHFFFAOYSA-N 462.470 0.086 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1cc(C)nn1C)N(S(C)(=O)=O)CC2 917523034 SWANSFFOVMRXGF-HNNXBMFYSA-N 465.532 0.456 50 20 JCGD O=C(NCCSC(F)(F)F)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 918219867 ZIQHZPGUHLOHBL-UHFFFAOYSA-N 456.468 0.905 50 20 JCGD O=C(NNC(=O)c1ccccc1NS(=O)(=O)c1ccc(F)cc1)N[C@H]1CCS(=O)(=O)C1 919883140 AZABFNPMNIOQOJ-ZDUSSCGKSA-N 470.504 0.758 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4nccn4c3)C2)C1 1778011671 QSSFJTGNHVOYGE-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2)c1cccc(N2CCOCC2)n1 1778267374 WAJYDGYAPRWTDE-NJNPRVFISA-N 466.966 0.645 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1ON=C(c2ccccc2)O1 1779261131 ZOLTXANOHDEPDK-DCEDVJGZSA-N 493.325 0.229 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1779321688 HZPIMUYEESJVKW-KOFHJDLBSA-N 451.337 0.898 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1n[nH]c3c1CCCC3)C2 1779373185 LOQFUJUONDPUFN-NTKDMRAZSA-N 481.557 0.728 50 20 JCGD Cc1nc(N)sc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779373365 NTJSJOIASAUWSC-QVKFZJNVSA-N 473.559 0.474 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cnc(Cl)c(Cl)c3)C2)C1 1779493857 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CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Cl)CCO3)C(=O)C1 1785669899 QZPBUCAAIAEECL-UZLBHIALSA-N 476.933 0.430 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c(C4CC4)c3F)[C@H]2C1 1785767179 CAQTUOSIILBFJI-RCBQFDQVSA-N 471.493 0.332 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(C)n1 1786983774 ROFVTRDILLLLJE-PMVMPFDFSA-N 465.359 0.604 50 20 JCGD COc1ccc(F)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786986513 KBWPKPJNVYWXGS-ZRCAFCQKSA-N 456.279 0.421 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnn4n3)C[C@@H]21 1787508823 VXNSUZSVQJEZNR-MDUUWBQSSA-N 478.513 0.457 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCC(=O)N1 1795389128 NFOVLRKMHNRESC-UESRRSCYSA-N 460.443 0.002 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(O)nc2ccccc12 1796913073 DQZGWVRLFZNUKH-MFKICJERSA-N 461.283 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)c(F)c1)C2 1797748717 XCJUXXOQWGVXKZ-LNDDQJNNSA-N 485.491 0.970 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1797923693 VNTUVIRNXFPOTA-PKXHYQAISA-N 460.535 0.015 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnn1C(C)C 1798153796 JQZJTKGEPKEHAE-LLJCUJCISA-N 455.519 0.801 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)N1CCOCC1 1798488817 ILJZKXQAQNOEPZ-DXEZIKHYSA-N 476.486 0.423 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC 1800911107 CLBSHNFHWQOETF-SVZOTFJBSA-N 491.969 0.286 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2 1800979714 WBOLVTUJCGAPCD-STHVQZNPSA-N 465.978 0.465 50 20 JCGD Cc1cc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)[nH]c2cc1C 1801011609 RQEDWNXFILAXQF-VPTLXERWSA-N 456.547 0.756 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(F)CN(C(=O)OC(C)(C)C)C1 1802202059 TZABDQMXYPWAPA-XGUBFFRZSA-N 463.934 0.789 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cn2cc([N+](=O)[O-])cn2)[C@H]1c1cccnc1 1804421187 NLYVHNAPECUKEJ-IIBYNOLFSA-N 472.506 0.265 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364264 DNEXZAWTUVDYPW-WMZHIEFXSA-N 464.331 0.094 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373110 NATCRLVJAWGYEY-GHTZIAJQSA-N 482.346 0.606 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)[C@@H](N)Cc2cccnc2)[C@@H]1c1cccnc1 1808365215 VPYGRGFZBJOWQG-JTAQYXEDSA-N 467.574 0.425 50 20 JCGD CN1CCCn2nc(C(=O)N3CCC4(CCCN(C(=O)c5cccc(B(O)O)c5)C4)CC3)cc2C1 1809980151 KPBZQXDGEOFROF-UHFFFAOYSA-N 479.390 0.557 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)Cc2ncccn2)[C@@H]1c1cccnc1 1810299514 SDCUOYYJLPZVHS-HRAATJIYSA-N 460.498 0.432 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1 1810301769 CBPLSNJACFEIHN-XLIONFOSSA-N 461.482 0.347 50 20 JCGD COCc1oncc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810301872 DJEBUZZGLKPTBK-FOIQADDNSA-N 479.497 0.848 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1ccccc1=O 1810517603 DLIXPNGYEPXNKS-NRJQMVOHSA-N 489.536 0.823 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc2nccn12 1812169421 IKJFOYKICDTRAS-SIKLNZKXSA-N 484.325 0.746 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1812408990 PYXNZGSWMJWEAL-YXJHDRRASA-N 463.878 0.457 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1 1813069507 YQMYPAIAMBRSJW-BBRMVZONSA-N 491.442 0.816 50 20 JCGD COc1cnc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1 1813071076 MKVPVBFDQNJLBT-HRAATJIYSA-N 455.519 0.573 50 20 JCGD NC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1 1813735565 FJPBYDSJKOXZEE-UNMCSNQZSA-N 472.310 0.494 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCCS1(=O)=O)CC2 1817282874 NIUZGBBONJSXCD-MXRJAMCGSA-N 492.583 0.766 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cc1 1817475006 JMDBSWDOGRDULB-LJQANCHMSA-N 461.287 0.808 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4n(n3)CCC4)sc2C1 1819285337 SVYLBWJYPJHBEK-LLVKDONJSA-N 466.527 0.824 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cn3ncccc3n1)CC2 1819797213 QEFBAPATKBBYQD-NSHDSACASA-N 477.510 0.724 50 20 JCGD COCCOCCOCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822255330 RZJFQOWYNAJGHK-FQEVSTJZSA-N 488.350 0.465 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](O)Cc3ccccc3)sc2C1 1825435480 YEIREAMZPBTXDN-KBXCAEBGSA-N 480.550 0.971 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)ccn3C)C2)C1 1830543123 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COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cccnc3C(N)=O)CC2)CC1 1833921008 NLHKHNASRJAJNW-KRWDZBQOSA-N 451.955 0.620 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cocn3)CCO2)C1 1834509304 RBDYTNPFILRSHH-OAQYLSRUSA-N 474.426 0.892 50 20 JCGD COCCOCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1835243502 SFCXVLBJAVUSQU-JOCHJYFZSA-N 495.485 0.253 50 20 JCGD O=C(/C=C/c1ccccc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929597 XWHPHQIKRHTSFM-YDSNZTKKSA-N 450.300 0.150 50 20 JCGD Cc1cc2cccc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2[nH]1 1835930585 NYLUWMLTBGDQJL-VWLOTQADSA-N 477.326 0.540 50 20 JCGD Cc1cc2cccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2[nH]1 1835937425 VRIDQGUBOVEJOA-RUZDIDTESA-N 477.326 0.540 50 20 JCGD O=C(c1ccc(C2CC2)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939563 SZSBGUMPTCPCGI-RUZDIDTESA-N 464.327 0.628 50 20 JCGD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939975 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CN(CC(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1)C(=O)C(=O)O 1837654873 BSUUJEQZMRUFKZ-UHFFFAOYSA-N 462.341 0.313 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)C(C)(C)C 1837710474 ZLDNMZAPVGIULH-WIYYLYMNSA-N 457.644 0.845 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)ccn1 1837713092 HDPKJOVPLPJWAN-NRFANRHFSA-N 464.595 0.962 50 20 JCGD COC(=O)C12CC(C(=O)N3CCC(OC4CCN(C(=O)c5ccc(B(O)O)cc5)CC4)CC3)(C1)C2 1837920900 LUULMBLEALPYLU-UHFFFAOYSA-N 484.358 0.322 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H]3C[C@]3(F)Cl)CC2)CC1 1837921071 XCXNZKMINOGUDP-WIYYLYMNSA-N 452.719 0.903 50 20 JCGD O=C(O)c1cnncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1837945908 PPXWIFOVUDQEQE-KRWDZBQOSA-N 457.281 0.030 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2 1838998894 ZTINUNMLAAGRKB-QFIPXVFZSA-N 475.452 0.347 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049186 BWBPSOXCMBSQFE-UZLBHIALSA-N 480.363 0.902 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839210603 VOWOMEQTMHURSE-ORAYPTAESA-N 484.377 0.522 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccc(C)c34)CCO2)C1 1839612828 VLMGNYBTHQXHJY-LAUBAEHRSA-N 450.923 0.967 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCS(C)(=O)=O)C2)C1 1839967730 WQRTXFNVNRTSDO-BBRMVZONSA-N 455.371 0.051 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)C2)C1 1840155549 AFTPNHWDASVBKV-YWZLYKJASA-N 471.894 0.927 50 20 JCGD Cc1ccc2oc(C(=O)N3CCOC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc2n1 1840183816 BMPKSRDRRPIVTM-HSZRJFAPSA-N 473.530 0.579 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(F)CCCCC3(F)F)C2)C1 1840184561 VMNXPSRMEYCKMO-PMACEKPBSA-N 478.512 0.733 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)n1 1840339035 LHAIJVSBWKKRDQ-DEOSSOPVSA-N 475.590 0.460 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1 1840511926 RNVFJYWJSQNJKL-XMMPIXPASA-N 482.541 0.173 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCOC1)CCO2 1840874444 IOOBJVZQAGCHRM-KTUMRIBQSA-N 461.519 0.003 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@]23COC[C@@H]2CN(C(=O)OC(C)(C)C)C3)C1 1841082635 QRIJNMRLZZHDQH-XDHUDOTRSA-N 493.605 0.446 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C2(C(=O)Nc3ccccc3)CC2)C1 1841640958 RWEFCCRNBFYTDY-UHFFFAOYSA-N 462.510 0.921 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cnn3cccnc23)C1)NC(=O)NCc1ccccc1 1844028773 XMDWWJLDFHWIOQ-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)C1)NC(=O)NCc1ccccc1 1845074555 YTHUFSRUHSPKTL-NHCUHLMSSA-N 496.612 0.937 50 20 JCGD O=C(COC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cccs1 11333531 QVMHWUREJVLQAK-UHFFFAOYSA-N 481.552 0.706 50 20 JCGD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)c1nn(-c2ccccc2)cc1O 105282009 RFMWKNCMXNYUPE-UHFFFAOYSA-N 452.383 0.673 50 20 JCGD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)CNC(=O)c2ccco2)c1 725739900 OONPFZPOAMAWHC-UHFFFAOYSA-N 458.880 0.049 50 20 JCGD C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1C(=O)NC2(CCCC2)C1=O 726495002 FZIYQZLODHGIMB-CQSZACIVSA-N 477.543 0.485 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3ncc4ccccc4c3=O)cc2)CC1 728214446 PBXIGCGTSIAGPN-UHFFFAOYSA-N 456.528 0.476 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2ccc3c(c2)OCCCO3)CC1)C(=O)N1CCCC1 748246585 DDVMDKLOTBMKKX-UHFFFAOYSA-N 480.543 0.018 50 20 JCGD CSc1nc2nc(C)c(CC(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c(C)n2n1 750047353 UULWFONTFACLNM-INIZCTEOSA-N 486.510 0.536 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N(C2CC2)C1)c1cccc(S(=O)(=O)NCc2ccccc2)c1 829959826 NRTOWSWPZWWLHG-QGZVFWFLSA-N 456.524 0.937 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C2CCN(C(=O)c3cccnc3)CC2)cc1 913210658 KRMWQZJJNXZLPC-UHFFFAOYSA-N 473.555 0.710 50 20 JCGD CCn1nc(C(=O)NNC(=O)N[C@H](C)c2cccc(S(N)(=O)=O)c2)c2ccccc2c1=O 916196708 FOCBBGHGJFXSCU-GFCCVEGCSA-N 458.500 0.769 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C 916420301 IPUSPKRNCMOOBQ-RFQHVGNTSA-N 480.543 0.775 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)COC1CCCC1)c(=O)n2Cc1ccccc1 918016840 KORTWLUVBMKTDJ-UHFFFAOYSA-N 468.514 0.535 50 20 JCGD COc1ccc(N2CCN(C(=O)/C=C/C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2)cc1 920254832 QJDRCLQESDHITQ-RQWLHQTBSA-N 466.494 0.887 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc[nH]c3nccc2-3)C1 1777893703 ZGERBSREOOXMKZ-NTKDMRAZSA-N 477.525 0.954 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091115 NUILXUXZLXDQEL-ACEPNWDCSA-N 475.550 0.081 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778094308 FNLXBLNAVXWAAO-KJGJOIRFSA-N 467.954 0.888 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(c3ccc(O)cc3)CC1)CCO2 1779028348 CWBGLEUFJVWBKY-QHCPKHFHSA-N 465.510 0.566 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4sc(N)nc4c3)CCO2)C1 1779030736 GZRORDQYSOEEEB-QFIPXVFZSA-N 481.538 0.634 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccc(F)cc1 1779032137 BWWYNRQUQQIDPL-GBXCKJPGSA-N 498.515 0.145 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCS1(=O)=O)CCO2 1780098703 QRUICOSBBVYCNL-NQIIRXRSSA-N 495.510 0.541 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)ccc1O 1780926105 YOMNESJFUFESOP-ZJSXRUAMSA-N 452.316 0.822 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(=O)C1CC1)CCO2)NC(=O)NCc1ccccc1 1780970220 UYTNIGDPYPBAFO-HSZRJFAPSA-N 457.531 0.142 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1781054397 LXOHNGVMYKGMOF-PUOZZTSBSA-N 484.557 0.351 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782210856 SHRHGIMJXAILTP-GEQKSPFYSA-N 460.579 0.769 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@]2(CN(C(=O)CNCP(=O)(O)O)CCO2)C1 1782863821 ABYAVPUKPZDNGU-VZLLQYAHSA-N 484.396 0.426 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1 1783880804 GWRBKHIVRSHNIU-HNAYVOBHSA-N 462.927 0.927 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1OC 1783934285 CIXXDRMWSKFUOR-QFIPXVFZSA-N 466.510 0.659 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(N(C)C)ccc1[N+](=O)[O-])CCO2 1783935382 OOGYJTUNGUPIOT-QFIPXVFZSA-N 476.534 0.477 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1784245789 MFEFLXOPZMKSEN-RUZDIDTESA-N 480.569 0.827 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1[N+](=O)[O-] 1785181480 XGSKEQYXVZLSBQ-QFIPXVFZSA-N 484.469 0.359 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)OC(C)(C)C)C[C@@H]21 1787507591 HCSLFUQKHBTJIK-HRZAHRDASA-N 490.561 0.625 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nc(CO)[nH]c4c3)[C@H]2C1 1787874534 WSTMKMPWGJKXSM-BXWFABGCSA-N 472.546 0.022 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788609705 BRDHJXSSHCOCRA-JBYOLUDKSA-N 485.516 0.669 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21)n1cncn1 1791612989 LFMHMKZAXWDOGL-VMXMFDLUSA-N 498.588 0.165 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1792221128 FENQDSCMWLGTGN-JNNCMOEMSA-N 459.971 0.869 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCCO1)NC(=O)NCc1ccccc1 1792564811 LIAXWSRBAJHPNJ-IIZPIQPGSA-N 473.574 0.491 50 20 JCGD O=C(/C=C/C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)NCc1ccccc1 1793072333 VODXOJZYBAEZPU-BMIFERRUSA-N 461.327 0.491 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nc1F 1794247275 XKMSBNWKPBDTFU-CULMDFNYSA-N 462.869 0.390 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1794314122 WLQOCZFBMSVWER-CCWDJLKJSA-N 496.524 0.162 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn(-c2cccc(F)c2)n1)c1cccc(B(O)O)c1 1794585030 ZEZOCIJPVPJHOY-FNLKRUPLSA-N 463.278 0.652 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1cccc(N2CCOCC2)n1 1796617894 ABNKLXCVGDSHNT-RMHZUWNSSA-N 471.327 0.812 50 20 JCGD Cc1cc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)no1 1797833937 XUPAACHVQXTTTI-QCBJBGFGSA-N 496.568 0.932 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl)[C@@H]1SC(=N)NC1=O 1799275313 PKKCXCFUZROOGJ-JJFBLWEHSA-N 451.376 0.615 50 20 JCGD Cc1ccccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1800613465 HTGOUMWBVSLMQC-OPMZPASUSA-N 451.527 0.830 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1cccnc1)C2 1800640174 MFUQWENCXNJUMC-JYYAWHABSA-N 453.337 0.575 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1800759474 ZSNBRSMCFIINLA-BCDXTJNWSA-N 466.303 0.906 50 20 JCGD COCCOCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2 1800848898 UVQXAGBNADRGNN-WQDJSCAQSA-N 485.405 0.509 50 20 JCGD CCOc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](Cl)COC)cnc2c1cnn2C 1800975549 QQOYLGSYMAHNKF-RMHZUWNSSA-N 465.938 0.824 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)C1 1801052200 OEOLWVKVUYPTNA-FKEXNYPISA-N 490.395 0.733 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1804190812 NZJQSMPSNFWEQY-KEYYUXOJSA-N 466.336 0.813 50 20 JCGD CN(C)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1805108556 LDERHVHMPPVGRG-CVDCTZTESA-N 473.342 0.856 50 20 JCGD O=C(CCN1CCCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1806645922 XIPKPCTZIHVJGI-URXFXBBRSA-N 464.375 0.957 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363754 PLLXJHLZSUPHCM-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD Cc1nnc(CCC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1 1807369737 UBQWABQTLSBUHZ-XMSQKQJNSA-N 479.371 0.874 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCc2cncnc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371054 OXZAQKFZWMSEPX-REWPJTCUSA-N 459.315 0.504 50 20 JCGD COc1cnc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1807371304 SDCFHGHWHIYDNX-DYESRHJHSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(O)ccc2O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374552 ZZEMIHLDLBOLTO-VGSWGCGISA-N 461.283 0.806 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1cccnc1 1810640962 XJAVDXDIDPCLQI-FZKQIMNGSA-N 479.457 0.345 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(O)nc2)[C@H]1c1cccnc1 1811462269 YIZAMWROQDBKJK-FOIQADDNSA-N 461.482 0.814 50 20 JCGD COc1cccc(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815336801 FJGJJKTVQNOGNO-INIZCTEOSA-N 466.328 0.695 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(O)c([N+](=O)[O-])c1)CC2)c1ccc(B(O)O)cc1 1815343631 FUEQFIRKTARABD-CQSZACIVSA-N 482.283 0.976 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC[C@H]1c1cc(NC(=O)C(F)(F)C(F)(F)C(=O)O)n[nH]1 1815564876 ACMJBVITIUTUAK-ZDUSSCGKSA-N 486.187 0.751 50 20 JCGD O=C(/C=N/N1CCCCC1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819392986 BAYRUMRWLLOKFC-IERINAHZSA-N 452.324 0.867 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2 1819793674 RABHFGFTAWYMOM-SNVBAGLBSA-N 485.486 0.172 50 20 JCGD CCn1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819795541 OADPBABNJPCWQL-LLVKDONJSA-N 454.516 0.898 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1819828675 QZSVXJXYIDUOBB-WFASDCNBSA-N 466.332 0.339 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccnnc2O)n[nH]1 1820056101 SLGRDBJPJKDOEQ-HNNXBMFYSA-N 451.447 0.524 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1824467240 TZQPMYPMVDLCNZ-LJQANCHMSA-N 450.366 0.034 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCCS3(=O)=O)sc2C1 1824931521 HTVBWWCUKZWJEC-KRKRZFJASA-N 492.583 0.766 50 20 JCGD CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1825218429 UQTDSQQESCFJSP-UFOJRKAESA-N 459.532 0.714 50 20 JCGD Cc1cc(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)nn1C 1827048889 BTEYAMYFTXGUMV-QFIPXVFZSA-N 452.364 0.884 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1827401386 KYSHGZDDNGJMJA-HIFRSBDPSA-N 451.915 0.300 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1 1831188221 ZHCASYASXIFMAO-HXUWFJFHSA-N 496.329 0.370 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CS(C)(=O)=O)CCO2 1831452213 NAYOCNFJBCKZHB-JKIFEVAISA-N 469.398 0.155 50 20 JCGD C[C@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN(CCO)CCO)CC1 1831484198 ZWMJHWGGOATELT-SJLPKXTDSA-N 462.429 0.924 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3nccnc3C(N)=O)CC2)CC1 1833263718 XRZGYPZQMSSVKZ-CYBMUJFWSA-N 481.395 0.792 50 20 JCGD CO[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)c1ccccc1 1835280776 HQXXAFAQSKZQPV-HYTOSZNNSA-N 497.552 0.965 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3)C2)C1 1835937468 YEXPEIWQCJDAJZ-WRALFONMSA-N 498.772 0.894 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3noc4ccccc34)CCO2)C1 1835981540 NQRKLMCXJYBFRL-DEOSSOPVSA-N 494.508 0.139 50 20 JCGD O=C(c1nc[nH]n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1836354150 ZHHZVGZYNWZVQK-OXQOHEQNSA-N 478.347 0.881 50 20 JCGD CC[C@H](C)[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836890866 DNSWIOAOBWLMKZ-MGPUTAFESA-N 461.563 0.704 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@@H]1CNc3ccccc3O1)CCO2 1837355982 IQISZRQSOPZAPA-KOSHJBKYSA-N 489.573 0.079 50 20 JCGD C=CCCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457189 ZKNVARWJMQNGGF-HSZRJFAPSA-N 459.547 0.748 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3Cl)C2)C1 1837460064 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CNC(=O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839801480 MOIUDFUPBXPZHP-DYESRHJHSA-N 482.375 0.585 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCS3(=O)=O)C2)C1 1839967052 YEMPNXTZAKUDFC-ZQIUZPCESA-N 467.382 0.194 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3OCCO4)C2)C1 1840152810 UPFZETWXQFLVRL-IERDGZPVSA-N 454.907 0.782 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OCCCO)cc3)C2)C1 1840154221 PYXSHSPBKMIQEV-DENIHFKCSA-N 470.950 0.772 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(OC4CCOCC4)n3)C2)C1 1840154378 VRSTXWQZXAMPME-JPYJTQIMSA-N 497.976 0.963 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Br)cn3)C2)C1 1840185000 DGACXJALPFMFJM-FQEVSTJZSA-N 498.378 0.287 50 20 JCGD CO[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1840209835 AGXIZJUDRXZQSL-QKKBWIMNSA-N 465.459 0.625 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1 1840437373 JITWRNWTZRIGHC-YJYMSZOUSA-N 457.369 0.819 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1 1840796925 VFJXSGUXBAAOKA-JTSKRJEESA-N 487.981 0.610 50 20 JCGD O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)Cn2cnc3cc(Br)ccc3c2=O)C1 1841647427 UQTKSGBPWJSMRW-HNNXBMFYSA-N 483.750 0.962 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1841919448 SMPULFJERLGRLL-UHFFFAOYSA-N 469.347 0.751 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@]2(F)CCN(C(=O)OC(C)(C)C)C2)C1 1843954889 GBSZDSWUKKBWTF-QFIPXVFZSA-N 469.558 0.912 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038933 KCVWAAGLHPIMPU-SFHVURJKSA-N 480.573 0.827 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CCCNC(N)=O)NC(=O)OC(C)(C)C)C2 1846365771 UWXXTKKVPVQKEW-LSDHHAIUSA-N 490.001 0.785 50 20 JCGD COc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 13359478 MLOPNBNFMQJRTB-UHFFFAOYSA-N 483.524 0.801 50 20 JCGD C[C@H](CN1CCOCC1)C(=O)NN=C1C(=O)N(CC(=O)N(C)C)c2ccc(Br)cc21 750935256 PZPOCNQRTYGAQY-CYBMUJFWSA-N 480.363 0.673 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1sccc1S(=O)(=O)N1CCOCC1 751208422 DEUJNDRQGHUSGD-UHFFFAOYSA-N 458.543 0.022 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@@H](C)NC(=O)C(C)(C)C)N(S(C)(=O)=O)CC2 875695139 XZRYMNNVJNMPEU-CJNGLKHVSA-N 498.602 0.651 50 20 JCGD O=C(Cn1nc2ccccn2c1=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 914164038 PIFCMXZDHZHFJI-UHFFFAOYSA-N 469.461 0.715 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2cccs2)o1 915442270 WNTDJCBFVNZVIQ-LBPRGKRZSA-N 499.523 0.675 50 20 JCGD C[C@H]1CN(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C[C@H](C)O1 916249607 BUVBNOVPOCHZHF-IRXDYDNUSA-N 483.591 0.151 50 20 JCGD CC(=NNC(=O)[C@@H](C)CN1C[C@H](C)O[C@H](C)C1)c1ccc(S(=O)(=O)N2CCNCC2)cc1 916373018 XUMIVOIUBWGLOP-OKZBNKHCSA-N 465.620 0.866 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)nc1 916390320 JNRDTIQCUFVSRP-UHFFFAOYSA-N 489.602 0.982 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCc2ccc(C(=O)N3CCN(C)CC3)cc2)c2ccccc2c1=O 916390843 RTVBBSJOVUOLNS-UHFFFAOYSA-N 491.552 0.948 50 20 JCGD COCCOc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cn1 916512604 LPQABOWOWMGJCU-UHFFFAOYSA-N 451.505 0.501 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@H]1CCN2CCCC[C@H]12 916639689 WYWCEECMGASDJH-VQTJNVASSA-N 479.603 0.597 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1cn(C)nc1C)c(=O)n2Cc1ccccc1 917537707 PHGZFBAXNYPKSS-UHFFFAOYSA-N 492.540 0.637 50 20 JCGD CCOC(=O)c1c(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)n[nH]c1C 917717924 NTCCOCXROXRMJH-UHFFFAOYSA-N 487.560 0.549 50 20 JCGD COc1cccc(NC(=O)COc2ccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc2)c1 919885551 LOPWOFQECLTSTC-MRXNPFEDSA-N 476.511 0.844 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1 920020340 ROQBRJRBUWFBGN-JSNVTFDYSA-N 450.451 0.980 50 20 JCGD COC(=O)c1ccccc1S(=O)(=O)N1CCC(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)CC1 1317732278 OZKUOAULTCOYLU-INIZCTEOSA-N 487.600 0.366 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030716 VIAISEWVWJHSTE-QHCPKHFHSA-N 467.482 0.427 50 20 JCGD Cc1ncc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cn1 1779371015 GPONZXBSHZNTFT-XMSQKQJNSA-N 453.503 0.225 50 20 JCGD N#Cc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1Cl 1780190274 SETKZWKTLRAALX-QFIPXVFZSA-N 468.901 0.967 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2ccoc2cn1 1781198771 UBHSOWVXRPEMFA-ZJSXRUAMSA-N 463.299 0.949 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)CCO2)C1 1781214379 VVLITOLYNXCNAD-ZHRRBRCNSA-N 463.966 0.869 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccnc1C(N)=O)C2 1781903198 OXSGBEOIORUETJ-VLXJIEOASA-N 468.352 0.877 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1782671406 WHMKLPUSXANORK-WRSAYESZSA-N 457.300 0.720 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](CC(=O)OC)NC(=O)OC(C)(C)C)C2)C1 1783603822 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C[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)[C@@H]1SC(=N)NC1=O 1786405870 HKYSCBFGJXJXTB-FGPLHTHASA-N 461.382 0.554 50 20 JCGD COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1 1786421621 FHALPWVKYFVXPO-JBACZVJFSA-N 460.575 0.981 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(F)(F)C(=O)O)C[C@@H]21 1787509153 WMJXCSTUQGOTBU-RJSLJBRQSA-N 469.445 0.210 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21 1789866347 PNKNMRMQQPZNOM-KSSIRIBKSA-N 479.386 0.668 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1791054970 BZYCXFMJKPHCAB-YTFOTSKYSA-N 478.384 0.635 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21 1791059411 ZSHGGNJJMQLDNQ-OSFYFWSMSA-N 464.320 0.466 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1791508388 KYVPBLNVLNRQGB-HILJTLORSA-N 499.996 0.425 50 20 JCGD CC(C)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)C(=O)OC(C)(C)C 1792594681 KGBNWHUALFWESL-RMFSNUHRSA-N 489.378 0.215 50 20 JCGD Cn1c(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc2ccccc21 1792816757 UUIPPPARKPZJDX-GPVSGQMNSA-N 476.537 0.623 50 20 JCGD CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c1I 1792976969 OZUUAGJPSHWVEC-PKCZLINISA-N 496.733 0.380 50 20 JCGD CC(C)(C)OC(=O)NCc1ccnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)c1 1794427388 CEFNPJSROUAFTL-CYGHRXIMSA-N 482.965 0.909 50 20 JCGD Cc1cc(Br)ccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795736276 UYTBWHUCFSLLKG-CWPLJXCYSA-N 487.159 0.954 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CS(C)(=O)=O)nc1 1796074664 WKCSKEJNCQTMHH-JJAZEVLHSA-N 488.404 0.860 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cn3c(nc1=O)SCC3)C2 1796892719 JUNNKLHZQSOFAR-AUHJYUKYSA-N 497.581 0.664 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1797362464 UJWYVQPDNVKGIG-FAQVEIGNSA-N 454.531 0.514 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)C1 1797748637 ODBUPBLCGULNRZ-PHSQPZKOSA-N 487.557 0.258 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)C1 1798442593 FLIXQLKNJLFPIF-QDMKHBRRSA-N 490.536 0.896 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N[C@@H]1[C@H]3COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C3)CC2 1800411857 WNANUFWWECLUNQ-ZHNFZGJGSA-N 478.354 0.383 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCNC(=O)C1 1801065421 OOUKTVMSUHRKGT-LFYQSXPISA-N 472.970 0.234 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CN2CCNC2=N)[C@H]1c1cccnc1 1807114959 GOLUPMDLWZXBFP-RBESNOOPSA-N 479.545 0.061 50 20 JCGD CN(CC(=O)N1CCC2(CCCN(C(=O)[C@@H]3CCC(=O)N3)C2)CC1)NC(=O)NCc1ccccc1 1809316521 ZNUOMXAWGPFNOS-FQEVSTJZSA-N 484.601 0.842 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnn2cccnc12 1809740787 GUFSVOQNIDMUMT-GHTZIAJQSA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@H]1c1cccnc1 1810294870 OZEOCMVKJBDWKA-JPYJTQIMSA-N 493.568 0.802 50 20 JCGD CN1CCN(CCC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1810303948 XYKUNTNIMWPZHV-XXBNENTESA-N 494.600 0.037 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C(C)(C)NCCC#N)[C@@H]1c1cccnc1 1813071431 PXNPFJCODPWFPJ-WIYYLYMNSA-N 457.579 0.742 50 20 JCGD C[C@@](O)(C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(F)(F)F 1815527552 DEKMZDGMNWTBQA-RDTXWAMCSA-N 454.214 0.709 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)n1 1817856945 MIXSWUYKWXOAIV-ZDUSSCGKSA-N 497.298 0.674 50 20 JCGD O=C(CC(F)(F)C(=O)O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1818024388 IQWWIPOFYVLQHL-CQSZACIVSA-N 450.207 0.505 50 20 JCGD Cn1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)cc1O 1819401584 JBZFHEHTYGRHQQ-OAHLLOKOSA-N 453.463 0.467 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1n[nH]cc1[N+](=O)[O-] 1819656594 KJTXPGRPSFLDKJ-CQSZACIVSA-N 453.224 0.341 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)N1C[C@H]2C[C@H]2C1 1819797705 GSEGUHHPAITELR-YIYPIFLZSA-N 469.571 0.708 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CSc1nc[nH]n1)CC2 1819802172 YTXPNABIYTUCFC-SECBINFHSA-N 473.544 0.278 50 20 JCGD O=C(CCc1ccc(O)nn1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1824483382 PNATWRQGLCPDNJ-HNNXBMFYSA-N 467.316 0.177 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCOCC1)CC2 1826085142 GVDBBBXVOHTPNL-CQSZACIVSA-N 452.581 0.150 50 20 JCGD CN1CCN(C2(C(=O)N3CCC([C@H]4CCCCN4C(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1828923951 GJQFLUCBQRERRJ-JOCHJYFZSA-N 497.644 0.698 50 20 JCGD N=C(N)SCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828946174 ODMYYEVKNOGCMM-HRAATJIYSA-N 498.005 0.665 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2nccnc2C(N)=O)CC1 1829509034 TUWBCTGXCXSDOV-RSXURMKNSA-N 494.556 0.943 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)C#Cc3ccc(Cl)cc3)CCO2)C1 1830468798 ZXBXXMNIGAZSIT-DEOSSOPVSA-N 497.939 0.460 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)c3cccc(Br)c3)C2)C1 1830733192 GEBYMGCKLNXSHG-MDZRGWNJSA-N 491.766 0.539 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1N(C)C 1830733260 GOBAUXNGMOWISB-LAUBAEHRSA-N 455.939 0.431 50 20 JCGD CC(C)(C)OC(=O)N1CC(=O)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1830886931 NPSIMRRABNJCNU-AUSJPIAWSA-N 477.917 0.556 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1OC 1832094775 MJWFNAPSZAINFH-JTSKRJEESA-N 470.950 0.693 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1832296492 LUMHDRFXCYOLDK-FQEVSTJZSA-N 451.332 0.821 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2 1832366787 PUENBEUAWMUCSQ-XMMPIXPASA-N 497.527 0.626 50 20 JCGD CN(C)c1cccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1832526025 NHJYWCIYEFNKTK-GHTZIAJQSA-N 455.939 0.188 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1 1833309645 IKXRLNBNSHSWOX-MOPGFXCFSA-N 485.390 0.141 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1833766755 VGABJWKDORQZAI-LIRRHRJNSA-N 462.378 0.392 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccno3)CCO2)C1 1834151713 HIVQZZYJQYLAEJ-OAQYLSRUSA-N 474.426 0.892 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1scnc1C)CCO2 1834266139 WTZVPDGVKXAYPL-MNQDVBFDSA-N 474.543 0.656 50 20 JCGD Cc1cc(CCC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccn1 1834797548 XQCNKNTXRUJCCY-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1834823293 MZZXFZLHSUPGMJ-GOSISDBHSA-N 452.309 0.584 50 20 JCGD CCn1nc(C)cc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1834985504 LWRMUJNTLBFJAL-UHFFFAOYSA-N 461.611 0.770 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccccc3C(N)=O)CC2)CC1 1835738278 RJNCKYLMOYTTSV-UHFFFAOYSA-N 493.568 0.283 50 20 JCGD Nc1nc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)ccc2s1 1835783362 FYNWLTZJXOAROQ-KUHUBIRLSA-N 454.936 0.548 50 20 JCGD Cn1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)ccc1C(F)(F)F 1835936792 DMLACLSLROMAKP-NRFANRHFSA-N 495.263 0.108 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1835937398 UBDVEWUCKJTRJL-QHCPKHFHSA-N 498.732 0.051 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4=O)CCO2)C1 1837135472 JOXREEWRXAARDW-YEJXKQKISA-N 494.342 0.922 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837316266 YOUNJXXTNAZMSL-IAQYHMDHSA-N 475.258 0.579 50 20 JCGD Cc1cccc(C)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460061 RHFXDYJOCJHZLD-DEOSSOPVSA-N 467.526 0.686 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837461399 VMPYXAPKPFMSFG-XDHUDOTRSA-N 482.541 0.029 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839044918 FUHONGDFTJFVOX-JXFKEZNVSA-N 471.341 0.815 50 20 JCGD C[C@@H]1C[C@@]1(C)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839091396 FCEPFSWQQCHPTL-WVQWTBLQSA-N 487.601 0.835 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1839151917 IEEQFPMMRQSEIB-HOTGVXAUSA-N 450.279 0.624 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1840030210 DNRSVXGQMCCHTR-RNCFNFMXSA-N 479.221 0.581 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(=O)OC)cc3[N+](=O)[O-])C2)C1 1840155131 QIANXLUEOXLHSN-HRAATJIYSA-N 499.904 0.705 50 20 JCGD Cc1ccc2nc(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)ccc2c1 1840184224 DNMQJDGSYIGVOR-VWLOTQADSA-N 483.569 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc43)C2)C1 1840185336 OOHMMGKCCJLBQA-YKSBVNFPSA-N 458.559 0.546 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2CC[C@@]2(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012383 JSQLAWBUMHUVSD-IQGLISFBSA-N 483.374 0.831 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014957 UKGMHCOZTGJHKN-OSPHWJPCSA-N 469.347 0.583 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc([N+](=O)[O-])c1OC 1844264974 GAPDXZFMHHAHCZ-UHFFFAOYSA-N 484.469 0.741 50 20 JCGD Cn1nc(SCC(=O)NNC(=S)NCCSc2ccc(Cl)cc2)c(=O)n(C)c1=O 18945236 IGXDINAPMQZEOP-UHFFFAOYSA-N 475.021 0.512 50 20 JCGD Cc1ccc(C(C)C)c(OCC(=O)NNC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)c1 27619306 HVEISODRFJUXPU-OAHLLOKOSA-N 464.544 0.810 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CN(C)S(C)(=O)=O)cc2)cc1 106012643 IKTPQBWKUFVQHY-UHFFFAOYSA-N 484.556 0.539 50 20 JCGD Cc1cccc(O[C@@H](C)C(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)c1C 726710600 IFNODBPZBCDJAJ-SFHVURJKSA-N 469.546 0.930 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CN3C(=O)[C@@H]4CCCC[C@H]4C3=O)cc2)CC1 728213231 HEQQXZWGCBUIKI-QZTJIDSGSA-N 463.560 0.241 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2C[C@H](O)CN2C(=O)Cc2ccccc2F)n1 728727540 IKSGKZRDXXWBEY-HOCLYGCPSA-N 478.502 0.028 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 728890281 KGXATQJQDOLPLQ-UHFFFAOYSA-N 479.588 0.220 50 20 JCGD O=C(COC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O)NNC(=O)c1cccc(Cl)c1 750523419 KTAAMJJNAOBICI-UHFFFAOYSA-N 470.869 0.716 50 20 JCGD C[C@@H](C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 750547848 KCWSSEHSOXFBHI-IHPCNDPISA-N 455.559 0.910 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1sccc1S(=O)(=O)N1CCSCC1 751212667 WDCIWYMKHUFGPC-UHFFFAOYSA-N 474.611 0.738 50 20 JCGD C[C@H]1Oc2ccccc2N(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1=O 761183411 IVGDLZDXSJKREA-AUUYWEPGSA-N 469.450 0.721 50 20 JCGD CCCCn1c(CCC(=O)NNC(=O)CN2CCCC2=O)nc2cc(S(=O)(=O)N(C)C)ccc21 789857504 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1778916880 VWGNNOWCGIOHIL-XMSQKQJNSA-N 477.638 0.996 50 20 JCGD CSc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1O 1779032800 VXPRDXZJSJCXKF-QFIPXVFZSA-N 471.539 0.870 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1 1779062360 AZYRYULKPJGTJQ-FXVMGJAWSA-N 469.542 0.649 50 20 JCGD CCNC(=S)NCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780098915 XSRDDUBYWGQXMM-OAQYLSRUSA-N 493.542 0.448 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780774822 NJWPDHSEVTZMFW-VMUDFCTBSA-N 452.321 0.342 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(O)c([N+](=O)[O-])c1 1780873324 HDNQKJHLBUZHIV-NFBKMPQASA-N 483.286 0.422 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967889 BJEBTWMPKSZWGD-IERDGZPVSA-N 496.406 0.946 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O)C2)C1 1781116031 ZJNZUCNNHMFOEY-YYQBIWNASA-N 490.395 0.828 50 20 JCGD 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CCOC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1812466444 MJSDBGZVPCRULJ-QFBILLFUSA-N 480.525 0.743 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCNC(=O)C2)[C@@H]1c1cccnc1 1813134106 MCBLNHKPWDVMSN-CMWKDUHRSA-N 479.541 0.748 50 20 JCGD N[C@@H](CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1cccnc1 1815172707 PDPPANQXUCBDGJ-IRXDYDNUSA-N 465.344 0.534 50 20 JCGD CC(=O)NCC(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815339784 YGCFXIYOCZCQIJ-GOSISDBHSA-N 455.324 0.558 50 20 JCGD O=C(CNC(=O)c1cccs1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815923978 VDGJGPHZVKWQIL-QGZVFWFLSA-N 481.343 0.887 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)N1C[C@@H]2C[C@H]2C1 1819289544 CSHGFPCEIQFWPE-FKKBTLCVSA-N 451.336 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCSCC1)CC2 1819791933 UNXFJLAWEUWLNG-LBPRGKRZSA-N 475.600 0.416 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1cnccn1)CC2 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COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc(C(F)(F)F)n1 1838521362 QBNTWEJOVUVJTC-FZKQIMNGSA-N 481.855 0.779 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1839156124 BWNXEQRYHZTURL-IAGOWNOFSA-N 484.427 0.539 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4nn(C)cc4c3)CCO2)C1 1839506479 UXBNNPDVBWXXAT-DYESRHJHSA-N 450.923 0.897 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1839965180 PQUNAAKBDISSKT-XHDPSFHLSA-N 475.258 0.722 50 20 JCGD CC(=O)C[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1840129041 HGPPARWSOIZBIB-UACMVNJQSA-N 461.519 0.192 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c(C)cc(C)nc34)C2)C1 1840152588 MVGCAHKYVPQPAC-UWJYYQICSA-N 465.938 0.670 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C2)C1 1840154268 QVTUSOYANFTCNT-KKSFZXQISA-N 495.920 0.002 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(Cc3ccccc3)C(=O)OC)C2)C1 1840156437 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CCN(CC)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)n(C)c1 760844295 RXLCNEGYWZTSRB-GOSISDBHSA-N 494.526 0.200 50 20 JCGD C[C@]1(c2ccc(F)cc2)NC(=O)N(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1=O 818515277 PXDCGXLZGXUSSQ-LJQANCHMSA-N 497.892 0.355 50 20 JCGD COc1ccccc1C(=O)N[C@H](CCSC)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 913154143 LTMOTDPCSMJYLH-QGZVFWFLSA-N 469.527 0.984 50 20 JCGD Cc1c(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)N3C[C@H](C)O[C@@H](C)C3)CC2)cc(C#N)n1C 914762791 XPAJGGIOYOCKOS-HDLISZADSA-N 460.560 0.610 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNC(=O)C2CC2)c1 915906459 MROFERKRLSHFSF-UHFFFAOYSA-N 475.527 0.966 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NCCC(=O)N[C@H]1CCS(=O)(=O)C1 916635993 LNICPQPKFXIWPA-AAEUAGOBSA-N 491.364 0.240 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@@H]1CCCO1)C2=O)c1ccc([N+](=O)[O-])cc1 918547845 WFUWNLAYSQDYAJ-HNNXBMFYSA-N 474.451 0.993 50 20 JCGD Cc1cc(/C=C(/C#N)C(=O)N(C)CC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1C[C@H]1CCCO1 920290095 FFJGZSIQMVHGQX-URYFNUFYSA-N 462.572 0.953 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCS(=O)(=O)c2ccccc2)c1 921247335 DIFQPSHFZXBYKD-UHFFFAOYSA-N 468.557 0.745 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)N1CCOCC1 1318076102 OODQDJCTTHOVQE-CQSZACIVSA-N 491.364 0.055 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Cl)C1 1778022074 COMBPPPZKDDYKW-QGDIXAPHSA-N 451.923 0.920 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(O)ncn1)C2 1778091352 BNNUAVNWTNPDSP-RTPDHJCFSA-N 469.502 0.444 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)CC1 1778114158 AVPZFEPMHGAROG-CJNGLKHVSA-N 470.361 0.178 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1 1778933587 QAPFBBWIRQYUIF-SBUREZEXSA-N 459.547 0.453 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779301041 HLNKSGFMOALRPU-YLJYHZDGSA-N 451.600 0.138 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncc(Cl)cn1)C2 1779371231 VGNDWYFASYPYKS-IIBYNOLFSA-N 473.921 0.570 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(N)=O)C2 1780055376 TYODKDKNNFEPRS-XMSQKQJNSA-N 476.486 0.913 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)COc3cccnn3)CCO2)C1 1780099168 XDVYAIUMAMZTFL-JOCHJYFZSA-N 485.453 0.833 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])C2)C1 1780123256 DLNFWHWIKHFXQK-QFIPXVFZSA-N 476.534 0.477 50 20 JCGD CCOc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)nn1 1780239566 CYMPGKCKXLSRDB-VGOFRKELSA-N 462.551 0.376 50 20 JCGD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c(O)c1 1780321212 UQBGGTDCFMFVSY-ZJSXRUAMSA-N 468.315 0.522 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)COc3cccnn3)CCO2)C1)NC(=O)NCc1ccccc1 1780968910 ITBYZIIGFPZPID-DEOSSOPVSA-N 497.556 0.032 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1781178494 DDZCQFIKIMSIFA-RUZDIDTESA-N 477.301 0.740 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2)C(=O)C(=O)O 1782754442 QTPZXBYHRHTMQC-IERDGZPVSA-N 496.358 0.366 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2)C(=O)C(=O)O 1782754449 QTPZXBYHRHTMQC-KKSFZXQISA-N 496.358 0.366 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1783696591 QZUZFGMTKKYXCJ-QQHIZMLBSA-N 468.290 0.671 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ncn4nc(N5CCOCC5)ccc34)CCO2)C1 1783875342 LYQHAFCAVBUYPY-AOMKIAJQSA-N 492.964 0.263 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1783934701 GIYSYHIEHKVVRK-OAQYLSRUSA-N 466.560 0.280 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccc(O)cc4)CC3)[C@H]2C1 1784142555 WFVBGNIKOBTKIL-VDGAXYAQSA-N 458.559 0.777 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CNC(=O)C3)C[C@@H]21 1785079792 ZTEVSKJDGWACCA-QRJUGERDSA-N 472.970 0.234 50 20 JCGD COc1ccc(OC)c(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1786655707 MRIIZWHIZLGKLJ-APTRMMRNSA-N 496.369 0.610 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccoc1C(F)(F)F 1787593315 NLDAEHCPWAGEKI-JQFCIGGWSA-N 466.221 0.885 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCN(C(C)=O)CC3)[C@H]2C1 1788247444 ACWATULNZODGDJ-XSLAGTTESA-N 473.412 0.304 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3OCC3CC3)C[C@@H]21 1788611729 WKIZNZSIPCUSEN-NDXORKPFSA-N 494.552 0.776 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)n[nH]3)C[C@@H]21 1789222374 XGVNZJTXVNOLAP-QITLCBANSA-N 473.442 0.856 50 20 JCGD C=CCCc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(O)n1 1794490263 ZZWMTLIDVDWNDT-UPHUGPLXSA-N 465.315 0.103 50 20 JCGD CC(C)(C)OC(=O)N1Cc2[nH]nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)c2C1 1794522853 POHPKTXRZBBSEA-VZAMPYOESA-N 483.953 0.463 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1795583311 VGJJTNOPXMVTCV-HLPPOEQASA-N 477.400 0.603 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)c1nc2c(=O)[nH]c3ccccc3n2n1 1797103672 NBXVCNYGNFBZNP-DJBIQUGXSA-N 493.293 0.465 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccnn1)C2 1798522353 QQWCDNHGFCCCIE-HBCWATKFSA-N 458.431 0.015 50 20 JCGD CN(C)C(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F 1800330804 UXAZMHNYUALCGU-AHHPBITISA-N 461.469 0.733 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCNC3=O)C2 1800759597 XOHBLVWHXZHIFG-MCYUEQNJSA-N 454.325 0.003 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)C1 1807359191 FZLHJINTTPLBRN-TWWGPRNNSA-N 479.342 0.670 50 20 JCGD Cc1cnc2c(C(=O)N3CC[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)cnn2c1 1807362413 LPIVTEZCZSOLEJ-UGKGYDQZSA-N 484.325 0.746 50 20 JCGD N[C@H](C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccccn1 1807362474 HEGNCMPTPISXHS-YUXAGFNASA-N 459.315 0.176 50 20 JCGD Cn1cc(F)cc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373935 DRTFCFRPYMFKOR-DYESRHJHSA-N 450.279 0.872 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1)[C@@H](F)Br 1808662617 NINODAKLAPKHRD-ZLKJLUDKSA-N 479.270 0.218 50 20 JCGD C[C@]1(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCCN1 1810305947 RCDWCOJZKCYOOG-XKDCRVNJSA-N 451.531 0.542 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc([N+](=O)[O-])[nH]1 1811612816 UUTBXWWOXFJOIV-JXFKEZNVSA-N 463.259 0.631 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812714023 YXUIKCZXOBDSOE-HHXXYDBFSA-N 471.396 0.405 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1 1813327500 XFISPDVCJYUQRB-JTUHZDRVSA-N 467.574 0.989 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H]2CCC(=O)NC2)n[nH]1 1814523938 RVTCQRUXVAMHCL-MLGOLLRUSA-N 454.491 0.240 50 20 JCGD NC(=O)c1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cc1 1815347622 HGBIHYKXFDBFQJ-INIZCTEOSA-N 464.312 0.461 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](F)Br)CC2)[C@H](O)N1CCOCC1 1819891136 OJHHWXFGTNFPTN-YKHWKNEFSA-N 451.318 0.396 50 20 JCGD Cn1cc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cn1 1822835612 RPTQYYFLISOQQA-QGZVFWFLSA-N 451.491 0.690 50 20 JCGD COCc1oncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826086372 SZLGQEXDMCQLOL-NSHDSACASA-N 450.521 0.876 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)NC(=O)OC(C)(C)C)CC2 1826088891 RCJARVUMXCVLPY-PIGZYNQJSA-N 484.579 0.271 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827056172 UVOVNWQZXPDFPM-OAQYLSRUSA-N 457.380 0.762 50 20 JCGD COc1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)nn1 1829523530 DJBICHIBJSUTHJ-HXUWFJFHSA-N 452.320 0.712 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CC(F)(F)C1)CCO2 1829988337 NYWOICPOJWOMBY-LEEXQRRLSA-N 467.473 0.622 50 20 JCGD Cc1cc(Cl)ccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830118750 AKXYEPMOSLHEGT-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)CCO2 1830828963 YGFRHPXTJVQTKS-PBXXJUDPSA-N 488.585 0.112 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc[nH]n3)CCO2)C1 1831758252 IWJCEISDCTZGQG-MGPUTAFESA-N 471.942 0.612 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1 1832209186 OFBYRXUIIYFUMV-YWZLYKJASA-N 451.911 0.142 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1832545262 NJIASJYPTOLVQA-JTSKRJEESA-N 487.981 0.610 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ncccn3)CCO2)C1 1833168034 MUVQEFUIVPEHLR-QHCPKHFHSA-N 499.480 0.623 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnnc(Cl)c1)CCO2 1833207616 SCIQMHZUCSPROQ-NFCNUSAFSA-N 489.920 0.334 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC1CCN(C2CCN(C(=O)Cn3cncn3)CC2)CC1 1833726820 JZVDUPVLDZSCNX-SFHVURJKSA-N 498.028 0.982 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CC2)CC1)c1cccc(B(O)O)c1 1834800547 KWTDUDHKMQQJRE-GQCTYLIASA-N 496.329 0.766 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3C[C@]3(F)Cl)CC2)CC1)c1cccc(B(O)O)c1 1834801495 PPKVVZBEIRYXTH-WIYYLYMNSA-N 451.735 0.476 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cn3)C2)C1 1834819455 SKYIHOPHIVHKJU-NRFANRHFSA-N 497.390 0.773 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)C1 1834819604 SBVASUVPXHGIEP-KHYOSLBOSA-N 461.353 0.817 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737919 MPGICHYGCUCQJH-KRWDZBQOSA-N 494.600 0.766 50 20 JCGD O=C(c1cnc(C(F)(F)F)cn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836374585 AGOBNBVDRAAMBD-BLLLJJGKSA-N 452.817 0.165 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1836515991 YTTPHGKZVKLPRK-APWZRJJASA-N 466.000 0.276 50 20 JCGD O=C(COc1ccc(O)cc1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836619719 MTJVLXDVFVZQQX-UHFFFAOYSA-N 482.342 0.763 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)C1=O 1837139314 ZYHLRMZTCSSFJW-HNAYVOBHSA-N 484.278 0.582 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c[nH]c3cnccc13)CCO2 1837180287 VOXWGOJQPCUKNO-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1837710115 ITYKRSAMLMULNZ-NRFANRHFSA-N 466.611 0.443 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnn(C)c1Cl)CCO2 1838308013 IHXPGHKUUHJASR-NFCNUSAFSA-N 491.936 0.278 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ncon3)CCO2)C1 1838313937 JOKBKVUYZHYOGC-ORAYPTAESA-N 473.914 0.272 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)c(NC(C)=O)c3)CCO2)C1 1838610869 HKLSEZIAXBPMGB-VGSWGCGISA-N 483.949 0.977 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1839129328 QCDXZWQSURJIAS-GSHUGGBRSA-N 489.997 0.690 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1F 1839468070 LLEXZPYAQBYMRI-OXJNMPFZSA-N 461.893 0.701 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1839874502 XAGWDSTXJVNVLU-HTZUNMPGSA-N 490.985 0.100 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1840033469 GIPDLCDNDDNVPC-QMTHXVAHSA-N 461.231 0.332 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1C 1840071458 ULELWMFVMBWGLV-DEOSSOPVSA-N 476.574 0.376 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCS(=O)(=O)c3ccccc3)C2)C1 1840151650 JPQRKWGOYPNFDY-NQIIRXRSSA-N 488.990 0.561 50 20 JCGD CCOC(=O)N(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)Cc1ccco1 1840340493 NKPLDVJVMGCUAA-UTKZUKDTSA-N 487.937 0.294 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2 1840364223 CQEZURNXWQZEMM-NJSLBKSFSA-N 455.353 0.754 50 20 JCGD C/C(=C\c1cccnc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840413783 YZFXEJBAQJHNET-PMILPSSXSA-N 480.525 0.254 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cnccn3)CCO2)C1 1840484469 RKZKZLLXAMWGIU-JDDKEMAESA-N 453.337 0.977 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CCO2)C1 1840899371 KRKYOKAEUJKWED-ISGGHPHESA-N 489.529 0.437 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1 1840955414 OBPXMJZHZRYFLB-KUHUBIRLSA-N 461.943 0.100 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)[C@H]1SC(=N)NC1=O)C2 1843416036 RVFLYIKTZCDVNG-IXUKHDCHSA-N 459.532 0.126 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)c1cn[nH]c1)C2 1843428941 YPQAACCNLMDTOA-IBGZPJMESA-N 497.361 0.043 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1843819308 AHDSBELLEDLDER-PBHICJAKSA-N 490.536 0.850 50 20 JCGD COC1(CC(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)CN(C(=O)OC(C)(C)C)C1 1846384961 DRNJGUPCYRCJIE-UHFFFAOYSA-N 481.594 0.589 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1)c1cccnc1 1847677561 QQQCSFRYAZDTJO-ACRUOGEOSA-N 494.357 0.843 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)Cn2cnc3ccccc32)c1 17403684 UJYWCHZPDHTKGW-UHFFFAOYSA-N 460.516 0.076 50 20 JCGD Cn1c(CC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(F)cc3)C2=O)nc2ccccc21 26538286 CZDXOSKNTMPQCZ-QFIPXVFZSA-N 452.446 0.870 50 20 JCGD CCN(CCNC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O)C1CC1 726281522 XFJQKKZOBNMQJN-GOSISDBHSA-N 497.618 0.767 50 20 JCGD C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1C(=O)NC2(CCCC2)C1=O 726494999 FZIYQZLODHGIMB-AWEZNQCLSA-N 477.543 0.485 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)cc1 727165389 ZJSLSPSAAYPRDG-UHFFFAOYSA-N 464.280 0.161 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N3CCCCC3)cn2C)n1 728722803 VVHWLFHKTZHAQK-UHFFFAOYSA-N 483.572 0.512 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)C1CCN(c2ncccn2)CC1 728958219 XMVWWDSVWPDQTO-UHFFFAOYSA-N 491.549 0.579 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)C1CCN(S(=O)(=O)c2ccc(F)c(Cl)c2)CC1 789856493 HYXLGDGNNXSPCX-UHFFFAOYSA-N 460.915 0.650 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNC(=O)c1ccc2c(c1)OCO2 802203014 DKHCNGIFSUKLPZ-UHFFFAOYSA-N 463.830 0.812 50 20 JCGD CNC(=O)CNC(=O)/C(C#N)=C/c1cn(CCC(N)=O)nc1-c1cccc(Br)c1 914439998 RHVUQPGBHVTTPT-NTUHNPAUSA-N 459.304 0.957 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc[nH]n1)c(=O)n2Cc1ccccc1 916147715 AKYJHDUMFQPEKT-UHFFFAOYSA-N 464.486 0.248 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NC[C@@H]1Cc2ccccc2O1 916516301 RQKWYTXFTDLIRD-IBGZPJMESA-N 488.566 0.974 50 20 JCGD CN(CC(=O)NNC(=O)c1csc(N2CCOCC2)n1)C(=O)c1ccc(Br)o1 917392294 ZGMRHDDASDYBHI-UHFFFAOYSA-N 472.321 0.868 50 20 JCGD C#CCN1CCC(C(=O)NNC(=O)C[C@@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)CC1 919964006 CYFDALPRGLWHRV-LJQANCHMSA-N 492.598 0.445 50 20 JCGD CCN1CCN(CC(=O)NNC(=O)c2cc3c(C)nn(-c4ccccc4)c3s2)C(=O)C1=O 920426918 HTUDGKWPRIVZSG-UHFFFAOYSA-N 454.512 0.847 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc(C)c1O 1779034640 RAGPPTBKAQPYLN-QHCPKHFHSA-N 453.499 0.765 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)N(C)C(=O)OC(C)(C)C 1781037949 KRMLZTDBTPWTMU-WAIKUNEKSA-N 475.351 0.065 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1781229556 ISYVWQIAIDDFAW-SJORKVTESA-N 456.392 0.478 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCc2ccc(O)nn2)C1 1781470220 ZYIAAYXQZOWVIH-VGOFRKELSA-N 462.551 0.002 50 20 JCGD Cc1cnn([C@@H](C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1782512231 FXFXCDBPGMHIOC-XTQVGHSUSA-N 454.336 0.260 50 20 JCGD CN(C)C(=O)NCC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1782862789 ZWPVFPBGCCDFSI-NAVGAYGYSA-N 461.469 0.973 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1783615582 PGBHLZBWYVGQTK-QHRIQVFBSA-N 466.362 0.990 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1783801157 FGWDNINGZMFEMZ-MHECFPHRSA-N 497.637 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1783933393 JBJYCIRLIXDHTP-YCRPNKLZSA-N 490.001 0.321 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1C)CCO2 1783933421 JGDMWODMZMMRAS-RDPSFJRHSA-N 457.575 0.246 50 20 JCGD CCc1c(Br)c(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)nn1C 1783933923 NFHNQSVSNOYDQY-FQEVSTJZSA-N 499.410 0.562 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)C1 1784084306 PQVSDBDNYAYWJN-WOYTXXSLSA-N 475.970 0.202 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cccnc3Cl)[C@H]2C1 1785166441 RDSIYGZXAXPZIK-WBAXXEDZSA-N 472.933 0.570 50 20 JCGD CN(C)C(=O)NCC(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1 1785929337 NFJXRJBYXXCAFY-UHFFFAOYSA-N 453.503 0.704 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)N1CSCSC1 1786984292 ZPGGNXONMBGCQE-XIVBQZFQSA-N 479.433 0.003 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CNC4=O)C[C@@H]21 1787508614 LGGUNVYQHGGYHX-PVGDUDLWSA-N 492.536 0.657 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788144993 KEKLXXRZYITTTI-HNNXBMFYSA-N 473.360 0.442 50 20 JCGD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(-n2nccn2)c1 1789291418 XCIDPEZKRBRTGH-HARLFGEKSA-N 489.341 0.163 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1nc2cc([N+](=O)[O-])ccc2[nH]1 1790320727 GVDWMHNYUQSCRG-SPGJAERMSA-N 451.867 0.664 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cn2c(F)cccc2n1 1790421269 UGFUNFOIFQFOTH-IEZWGBDMSA-N 466.278 0.060 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1791103213 QGMHWPKIJAXZJW-HAFSJTIUSA-N 479.933 0.957 50 20 JCGD Cc1ccc(OCCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1792709443 PYXUKNJDNOXREP-BBIADKPPSA-N 452.316 0.347 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C\C(=O)NC1CC1)C2 1793880409 ZLYYVRYYYLLUSK-NEXPXWBLSA-N 484.981 0.543 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795737634 DSNZHKNHBCDGMU-PHXJMUFTSA-N 464.327 0.382 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)C2)c1cccc(B(O)O)c1 1795739887 MWWLVWXBINKXBD-HATOLVCRSA-N 460.299 0.274 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796190413 VPINCDMMMYHDKQ-ZINXYGQCSA-N 479.342 0.933 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)c([N+](=O)[O-])c1)C2 1796443855 OJFIKYFOPSKHLT-UYNJTKMTSA-N 484.469 0.638 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cccc(Cl)c1)C2 1797748659 QNASWTFTIORGKX-VTEUUUEMSA-N 473.917 0.621 50 20 JCGD CC(C)(C)n1ncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1Cl 1797749731 LXLDUBDGOYEHME-FVCICTRLSA-N 489.964 0.807 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn(C(F)F)n1 1798162139 FUONINZYUQRLTQ-OQLCOEBBSA-N 463.445 0.615 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799099387 VYPGWFZLMXGCTE-PIBIMKELSA-N 497.600 0.688 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)cc2NC1=O 1799290872 DTRXJZBPDZTEDU-HNKHHVNMSA-N 478.509 0.970 50 20 JCGD COc1cc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1OC 1799703145 UBBZDDZLFJNKPA-USGNIVHTSA-N 483.525 0.528 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCS1(=O)=O 1800388516 BXKSYMXNXQJERA-NPJQDHAYSA-N 494.010 0.285 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802337589 ZJROENAQWIRXSL-DQEVTTJGSA-N 461.538 0.955 50 20 JCGD CNc1nsnc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1802482454 SNFGHUXCZPXMNQ-CXAGYDPISA-N 481.542 0.607 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@](C)(O)C(F)(F)F)[C@H]1c1cccnc1 1803997373 DCIVCSZFEUOEKR-LSBZLQRGSA-N 459.469 0.774 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCc2cn[nH]c2)[C@H]1c1cccnc1 1804502858 ZNHCTQCQIIZRMY-LAUBAEHRSA-N 462.514 0.756 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ncc(Cl)cn1 1805233033 VVUZIDANUVPLIN-QFBILLFUSA-N 465.706 0.838 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)[C@@H](N)CCC(N)=O)[C@@H]1c1cccnc1 1807056760 WBCHCHPSHUSQBQ-JKQORVJESA-N 454.369 0.854 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807363142 NWOJCPMZBOWNJU-PXNSSMCTSA-N 463.303 0.137 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 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C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810295692 VNEHBQAKVFUJFJ-FQPQFMITSA-N 477.525 0.258 50 20 JCGD Cc1noc(N)c1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810301819 CPBOEHPPBHXKRG-RDTXWAMCSA-N 464.486 0.592 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCc2cnccn2)[C@H]1c1cccnc1 1810309460 QYZWWLRZRHKEJB-VGSWGCGISA-N 474.525 0.823 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnn3c2CCC3)[C@@H]1c1cccnc1 1812143670 BGZUFAIAKSFPIY-JTSKRJEESA-N 453.547 0.917 50 20 JCGD CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1 1814770222 RQEKSXBWVCUCNL-DTWKUNHWSA-N 469.298 0.953 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc3c(n1)OCCO3)CC2)c1ccc(B(O)O)cc1 1815340025 BPINCUPWBXWOLY-AWEZNQCLSA-N 480.311 0.529 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815356627 KLBCXGRANLDCRW-INIZCTEOSA-N 495.370 0.349 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1)c1ccc(B(O)O)cc1 1816942068 MTVBRMLCWMLTGG-AWEZNQCLSA-N 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CC[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1792127269 OOPWIIFIHYXPLR-FFGOWVMKSA-N 489.378 0.263 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)C(C)(C)S 1792982531 GXCYTDZFXFSRBN-AIEDFZFUSA-N 480.027 0.777 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(C(F)(F)F)n1 1794070085 OXGOFQPWRYGWAU-VTEUUUEMSA-N 471.480 0.606 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794384844 CSVVHBXJLNNUNV-APIJFGDWSA-N 460.535 0.004 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1 1795737144 XEERQHYFFUERPT-NLFJOSALSA-N 464.327 0.682 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1scnc1C(F)(F)F)C2)c1cccc(B(O)O)c1 1795737467 JRXKXGKKPVDQDF-DABQJJPHSA-N 469.250 0.359 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(-c3ccccn3)nc1)C2 1797749474 ARMKCGHIQMZRTM-CWPLJXCYSA-N 488.508 0.054 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1799366096 RROLHCNVGIQZIN-UMPJEAMMSA-N 478.384 0.637 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cc1)C2 1800975135 JTIPMNQJNSFTCJ-PIKOESSRSA-N 451.951 0.980 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1802617627 MKPMFBXOZMBKCZ-RDGPPVDQSA-N 485.346 0.544 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1 1803132516 XKJHHHFHYDKQRI-PBNJOUANSA-N 479.342 0.670 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ncc(Cl)cn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369438 JWYSBGWLIOMADO-APWZRJJASA-N 465.706 0.838 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)C[C@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1808291321 HCGMWNMJURWIOT-QPWUGHHJSA-N 456.330 0.922 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@H]1c1cccnc1)C(=O)C(=O)O 1808678931 PZIQFKSJSJEMQA-BNOWGMLFSA-N 459.272 0.321 50 20 JCGD CC(C)=NO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808846470 YCVFZQJFQHGCDE-OZOXKJRCSA-N 452.320 0.882 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1 1809988169 UOIBFLRMHURGBD-IIBYNOLFSA-N 474.525 0.856 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1C 1811629444 VKAGIEMMTYYFIA-UWJYYQICSA-N 463.303 0.137 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1ccnn1 1812397245 FIDMRLXWZVIWCI-IDHHARJASA-N 463.502 0.252 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnn3ccncc23)[C@H]1c1cccnc1 1813069672 AJTBBXMKJIXHBC-JTSKRJEESA-N 464.530 0.817 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1813334438 GHBBIZXXZAIHIP-NQYYFHDYSA-N 462.938 0.158 50 20 JCGD CCOC(=O)c1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)ccn1 1815343637 GIJZDCYOAMTHEF-MRXNPFEDSA-N 494.338 0.934 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348441 OBOSJMNTUNXSPF-RISCZKNCSA-N 461.305 0.610 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1817977836 SUHCOTRABNBHCJ-WMZOPIPTSA-N 468.348 0.422 50 20 JCGD O=C(CC(F)(F)C(=O)O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1818024266 AESRSRNTZQQHHX-CQSZACIVSA-N 450.207 0.505 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cnc4ncccn34)sc2C1)c1cccc(B(O)O)c1 1818434389 GXRLAIHRBSLRMR-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD O=C(O)c1cnncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819760974 QQMWLTGUQONWHH-QGZVFWFLSA-N 464.247 0.197 50 20 JCGD CCOC(=O)C1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)CC1 1821803738 STNNWUCPDDHJMH-KRWDZBQOSA-N 454.292 0.739 50 20 JCGD CC[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(CCO)CCO)CC2 1825451737 PWVUWMGYNSNEAM-NWDGAFQWSA-N 463.398 0.515 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826886159 IHDHBPMXQNIEGH-CZUORRHYSA-N 466.328 0.911 50 20 JCGD C[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)N1CCN(C)CC1 1827052611 RLAZGMRHDKWOQD-XXBNENTESA-N 470.423 0.236 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C[C@@H]2C[C@@H]21 1830719599 GOKFUKDRCFAPKR-VMDVDIMUSA-N 487.981 0.440 50 20 JCGD O=C(c1cc(Br)ccc1O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830730656 BSYCUFXOHXHZKO-YJBOKZPZSA-N 477.739 0.824 50 20 JCGD COC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1 1832549796 SDQNHVNRUWITLR-YCRPNKLZSA-N 477.986 1.000 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833024524 QNBGSILBJUOBGQ-RQVMVGKASA-N 482.965 0.857 50 20 JCGD COc1cccc(CCC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1833790312 BEVOYKFACWMQAV-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD Cc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834798535 IMWMCIBUYAVJLR-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4ncncc4c3)CC2)CC1)c1cccc(B(O)O)c1 1834800149 STLWZSHSPBVUCJ-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD CN(CC(=O)N1CCC(N2CCC(NC(=O)c3nc[nH]n3)CC2)CC1)NC(=O)NCc1ccccc1 1834952026 RPSRSKXUYRECOF-UHFFFAOYSA-N 497.604 0.336 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H]3CCCS3)CC2)CC1 1835737325 IKVQFEYXQXFIBG-IBGZPJMESA-N 460.604 0.766 50 20 JCGD O=C(c1ccc(OCC2CC2)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835940816 BFXAXJSYMJGFKJ-SANMLTNESA-N 494.353 0.539 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835941975 VEYOBLORCWIZDB-KDLSMAQYSA-N 495.297 0.058 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cc4cccnn4n3)CC2)CC1 1836079562 MZHDZNAJULNQFE-UHFFFAOYSA-N 470.578 0.288 50 20 JCGD COc1cc(OC)cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1836276932 CJUGKPOZVSFASQ-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD CN(CC(=O)NC1CCN(C2CCN(C(=O)c3cc[nH]n3)CC2)CC1)NC(=O)NCc1ccccc1 1836343886 MMXUOXHLIZFCFY-UHFFFAOYSA-N 496.616 0.941 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836717045 FYUYBIDBQBWUTJ-KSSFIOAISA-N 467.954 0.193 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cnccc3[nH]1)CCO2 1837106342 RRADDVRAIFNFTN-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)C(=O)c3ccco3)CC2)CC1 1837111136 TWLNCPJJAQHIDU-UHFFFAOYSA-N 469.498 0.773 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n1 1837658863 DCXXNKZTMISBOL-HNAYVOBHSA-N 489.342 0.434 50 20 JCGD CN1CCN(C2(C(=O)N3CCOC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)CC2)CC1 1837714888 QWQRBYDYPFTJKW-OAQYLSRUSA-N 468.671 0.074 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1838418456 ADTHDLGDRRTDGO-GUYCJALGSA-N 489.323 0.517 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc3ncnn3c1)CCO2 1839048629 KVKVBCFCBHBWAA-NRFANRHFSA-N 461.595 0.580 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1 1839199152 RMMUYZNJEVIYLI-AEFFLSMTSA-N 460.300 0.780 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1840031973 JFZNEKJRQVFBDK-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccn4c3C)C2)C1 1840152506 KDXYCDUZZRGUGP-KKSFZXQISA-N 450.923 0.967 50 20 JCGD O=C(c1cccc(N2CCOCC2)n1)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840187446 BFXODRQWPXIPDY-HXUWFJFHSA-N 473.357 0.792 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1 1840494593 JCZSCJKJFRCUGF-KUHUBIRLSA-N 456.337 0.817 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cc2)CC1 1841036199 UTZBYJATMUQAJD-UHFFFAOYSA-N 477.569 0.568 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264897 WCIBURFNDXOKAV-UHFFFAOYSA-N 476.534 0.043 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCc2ccc(O)nn2)C1)NC(=O)NCc1ccccc1 1845755489 IBVAANSMZWDLED-UHFFFAOYSA-N 481.557 0.664 50 20 JCGD COCCOCCOCCOCC(=O)N1CCCC12CN(C(=O)CCBr)C2 1846256535 OGUQKXHHYHPJGT-UHFFFAOYSA-N 451.358 0.671 50 20 JCGD CC(C)(C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)S(=O)(=O)c1ccc(Br)cc1 726137954 HUBHBGKHMMHLAK-JTQLQIEISA-N 467.363 0.584 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)COC3)c2ccccc2c1=O 726372935 NLZMVPXFSVULLM-UHFFFAOYSA-N 485.522 0.576 50 20 JCGD COc1ccnc(NNC(=O)NCCc2ccc(OCCN3CCN(C(C)=O)CC3)cc2)n1 728134850 OHYWBVWTKFCEFV-UHFFFAOYSA-N 457.535 0.897 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2cc(Br)c[nH]2)C1 728203141 GZHJBYAVTCBNHL-LLVKDONJSA-N 473.353 0.979 50 20 JCGD Cc1nn(C)c(C)c1-c1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)n[nH]1 728329220 KZVAYYQUZJETQC-QGZVFWFLSA-N 454.443 0.571 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)n(C)c1 728848142 WZWOYOQXHAPQDZ-UHFFFAOYSA-N 463.564 0.523 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)Cc2cccnc2)c1 728852484 CKEOKQASURGIJF-UHFFFAOYSA-N 475.571 0.952 50 20 JCGD CSCC[C@@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 729276612 ISKRHHYMZKUDIJ-ZWNOBZJWSA-N 495.421 0.386 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCOCC1CC1)N(S(C)(=O)=O)CC2 731119464 SJHDJNJOTRNGPG-QGZVFWFLSA-N 484.575 0.710 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1 744446585 FDFYYVBPDRNVHV-UHFFFAOYSA-N 464.466 0.778 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCNC(=O)Cc2cccc(F)c2)nc1 749015006 QFJKGGCQMSXGTM-UHFFFAOYSA-N 452.512 0.892 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN2C(=O)CCOc3ccccc32)cc1OC 749674669 QCFHBDOTHUXZJM-UHFFFAOYSA-N 457.439 0.824 50 20 JCGD COC(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)c1 751283191 UVBKHFCOZIOZCX-VOTSOKGWSA-N 467.456 0.223 50 20 JCGD O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 802579314 NZOBFZPZOSZXIF-CQSZACIVSA-N 475.552 0.666 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccc([N+](=O)[O-])cc1 912764822 APCNLJDBRILDGS-UHFFFAOYSA-N 450.429 0.496 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)NC2CC2)cc1)[C@@H]1COc2ccccc2O1 912979466 XDQREEWPSFCCSA-KRWDZBQOSA-N 453.498 0.277 50 20 JCGD O=C(CCCN1C(=O)CCC1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 915618502 RIILUIJVDSGBOZ-UHFFFAOYSA-N 450.517 0.551 50 20 JCGD CC(C)CN1CCO[C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1 915922624 WHEXJUSTBHNRLB-GOSISDBHSA-N 467.592 0.772 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@H](C)C(=O)N(C)C)c2)cc1 916577541 KYOWQTKCMAQMEM-CYBMUJFWSA-N 463.516 0.917 50 20 JCGD CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)cc1 919779469 STAXJNDVJFYGRE-GFCCVEGCSA-N 454.530 0.703 50 20 JCGD C[C@@H]1CCc2c(sc3nc(CCC(=O)NNC(=O)N[C@H]4CCS(=O)(=O)C4)nc(O)c23)C1 919883403 CRZDRNVSSJTSHZ-MNOVXSKESA-N 467.573 0.972 50 20 JCGD CN(C)C(=O)COc1ccccc1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 920357873 IZMIHJIXSDVQCY-UHFFFAOYSA-N 474.539 0.938 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4sccc4[nH]3)C2)C1 1778701261 WBVLHDFTNIXKIH-NRFANRHFSA-N 454.512 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ncn(-c4ccccc4)n3)CCO2)C1 1779030179 HWDDSNDFDZFWTG-QHCPKHFHSA-N 476.497 0.023 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(C(F)(F)F)[nH]3)CCO2)C1 1779031797 FVNDYCUGDBZAAY-IBGZPJMESA-N 466.420 0.789 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779032232 HFZDXFIWBXDOFO-QHCPKHFHSA-N 487.488 0.599 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2 1779036091 WZJPGDZQWZNXPU-QHCPKHFHSA-N 467.501 1.000 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779277969 KRPYXDJDYWIGJD-GXZWQRSESA-N 472.970 0.639 50 20 JCGD CSCC[C@@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968452 LUQSLFQJSZEWIR-AUSIDOKSSA-N 493.630 0.277 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cn(C)cn1)CCO2)NC(=O)NCc1ccccc1 1780969941 OZAHDXUFWXQSDS-QHCPKHFHSA-N 469.546 0.210 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781325674 PNHDSHPSPMSNHU-XXLXZOJFSA-N 486.338 0.686 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782176041 VWSSYQSEBLZWTP-JXXFODFXSA-N 453.927 0.066 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)c(C#N)c1 1782211991 AGNAEFWQCDCIMA-PXDATVDWSA-N 485.585 0.996 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782538081 RXVJPEWIXYLIDF-LSRZYVKLSA-N 482.541 0.675 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCO)NC(=O)OC(C)(C)C)[C@H]2C1 1784197208 LJPRDJFLFVPDOO-WOYTXXSLSA-N 477.986 0.496 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)N1CSCSC1 1788682538 BYXWLEXRBRDDMX-USJZOSNVSA-N 494.643 0.321 50 20 JCGD CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1C 1788998116 WIIFOPPKMMCSSN-FNHZYXHNSA-N 455.519 0.117 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN(C)C(C)=O)C[C@@H]21 1789220739 IWPGYYGVLNQAKU-LRQRDZAKSA-N 490.513 0.982 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(CO)on3)[C@H]2C1 1789377131 XFOUFKIUHNMEDU-ROOHIHILSA-N 488.453 0.908 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN(c3cc(NC4CC4)ncn3)C1)C2)[C@H](O)CCl 1792978442 BVFAMIAMPUBBHJ-QQSMOKJMSA-N 493.008 0.457 50 20 JCGD O=C1CN(c2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Br)C4)n2)CCCN1 1794507039 ZZHKELLXKCSAPP-JGTCGTHISA-N 498.353 0.302 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)c2n1 1797753053 RQHKRTCHLYBRDH-DBWKPXFBSA-N 479.497 0.087 50 20 JCGD CC(C)Oc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1C#N 1797754397 UWKIZJDGTIJDBD-OPMZPASUSA-N 492.536 0.861 50 20 JCGD COC[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095473 ZPVJUFOCGUSTDT-ROPHOZQPSA-N 461.563 0.205 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)[C@H](F)Br 1799350535 VUKMQYMGPQKAAU-VVJJBPBLSA-N 454.343 0.127 50 20 JCGD COc1cccc(Cl)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801800520 GJRZGGLGGVPURS-DBWKPXFBSA-N 473.917 0.864 50 20 JCGD O=C(CCN1CCCCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1806645931 XIPKPCTZIHVJGI-ZJSXRUAMSA-N 464.375 0.957 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807363130 BDVGMUNSJFOVLU-SIKLNZKXSA-N 461.331 0.745 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363722 NQWKLTAPCADDKQ-DYESRHJHSA-N 467.722 0.631 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2CCCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370888 MRVXTEHCXRPFBF-NZQKXSOJSA-N 450.348 0.567 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CNC(=O)[C@@H](N)CN)[C@@H]1c1cccnc1 1808268608 YUJNDJVEIWFZGL-QSFXBCCZSA-N 470.486 0.521 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)CC2)C1 1809972676 ZGVFDWLBRPLRNF-XMMPIXPASA-N 477.326 0.946 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc[n+]([O-])cc2)[C@H]1c1cccnc1 1811194265 UGDSONWMRUFLRE-YLJYHZDGSA-N 461.482 0.347 50 20 JCGD CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1812319582 GVZBQDIVBGYZEH-RILKCQEDSA-N 465.514 0.440 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)[C@@H](N)Cc2cccnc2)[C@@H]1c1cccnc1 1813071953 ZXIYWOCCASYHIQ-ZRCGQRJVSA-N 467.574 0.425 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1 1813072405 CWYRJTGTTSJFDR-HTAPYJJXSA-N 454.531 0.473 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354611 MARBDDGIJKBHGO-IRXDYDNUSA-N 465.344 0.014 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1 1816943958 AEEVRRGLKDWWAW-LLVKDONJSA-N 477.510 0.724 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1821660466 VALKCNOIJZQBEM-MGPUTAFESA-N 490.329 0.609 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C(=O)Nc1cccnc1)CC2 1826088373 WZCUSASCGICTAN-LBPRGKRZSA-N 459.532 0.462 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053744 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ncc[nH]3)CCO2)C1 1833718931 FFDCKCHJMLWDHJ-NRFANRHFSA-N 473.442 0.627 50 20 JCGD COc1cccc(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834797537 WDAZBGKZFMHJMJ-UHFFFAOYSA-N 480.374 0.198 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)C(F)(F)C(F)F)CC2)CC1 1835737242 ZQDCQRMNUCRGJN-UHFFFAOYSA-N 474.459 0.771 50 20 JCGD COc1ccccc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927249 NAELJAANTJHRPV-VWLOTQADSA-N 482.342 0.078 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)s1 1835927556 SRQPLCHIGXXBQI-QHCPKHFHSA-N 472.372 0.439 50 20 JCGD O=C(CCc1ccc(F)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939715 FOKDZVMGHHVFTJ-DEOSSOPVSA-N 470.306 0.208 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)CCO2 1836638259 FUNFVERMHGZZIB-HYFFOGBASA-N 489.997 0.954 50 20 JCGD O=C(Cc1ccccc1O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920268 UBVHGNIXFDLNLJ-UHFFFAOYSA-N 466.343 0.927 50 20 JCGD O=C(c1cccc(OC2CCOCC2)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838353180 GRMLGXOYBZQOIJ-AVRDEDQJSA-N 483.949 0.309 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)c1 1839408253 KZHHNCASJNTPSQ-VWLOTQADSA-N 497.552 0.694 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1839801064 SDWSQJVZTXDVGA-GHTZIAJQSA-N 488.990 0.079 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC(=O)Nc3cc(C)on3)C2)C1 1839964059 DQMLXINBYFYWJI-KUHUBIRLSA-N 487.351 0.942 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)[C@@H]2C1 1840009532 KLVIZHJXKLXVRX-BSQBWSPESA-N 487.981 0.155 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3OC(C)(C)C4)C2)C1 1840184021 NTPJAROVWMJZKI-VWLOTQADSA-N 488.585 0.843 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1Cl 1840187354 VFUSCYBCZZVSQY-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCCc1cccnc1)CCO2 1840513461 BPEXKKZGVAFERI-HSZRJFAPSA-N 461.563 0.234 50 20 JCGD COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1C 1840645258 LJISMVZROHVXAY-HSZRJFAPSA-N 462.547 0.447 50 20 JCGD Cc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(C)c1 1840672073 MDTJDFLBOHTYNT-VWLOTQADSA-N 466.343 0.675 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)CCO2)C1 1840771532 CJNCKWGMVXXUJR-JPYJTQIMSA-N 491.928 0.440 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cl)COC)C2)C1 1840806053 LMFUVTODVITHED-QYWGDWMGSA-N 477.986 1.000 50 20 JCGD O=C([C@H](O)CCl)N1CC2(CCCN2C(=O)[C@@H]2C[C@H](O)CCN2C(=O)OCc2ccccc2)C1 1843846009 KZQQINXSTBNSRX-CEXWTWQISA-N 479.961 0.952 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCc1cncnc1)C2)NC(=O)NCc1ccccc1 1845038802 VMDQCLVJDMOHCX-UHFFFAOYSA-N 465.558 0.959 50 20 JCGD COC(=O)[C@@H](CC(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1)NC(=O)OC(C)(C)C 1846386157 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IUHAUUJOYLYWRP-UHFFFAOYSA-N 486.959 0.613 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2c(C)nc3c(C#N)cnn3c2C)cc1 914781701 LNWDVXQWMOZDTN-UHFFFAOYSA-N 483.554 0.927 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccccc2F)o1 915059546 BJMDWODQYVARBX-AWEZNQCLSA-N 483.474 0.975 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)c1 915164240 JIAIGEQZMJIBFP-UHFFFAOYSA-N 487.581 0.176 50 20 JCGD COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1 916041284 WPGWXTHVKOQGPW-QGZVFWFLSA-N 477.605 0.076 50 20 JCGD Cn1nc(C(=O)NNC(=O)N[C@H](CN2CCOCC2)c2ccccc2)c2ccccc2c1=O 916216907 WPPHWXBCRFZWHH-LJQANCHMSA-N 450.499 0.951 50 20 JCGD O=C(NCc1ccnc(N2CCN(c3ccc(F)cc3)CC2)c1)NNC(=O)C(=O)NC1CC1 916514765 MRJLJMDSJZVADI-UHFFFAOYSA-N 455.494 0.656 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCS(=O)(=O)Cc3ccccc3)nc2)CC1 916635435 OKRJAHQGUAJTED-UHFFFAOYSA-N 496.615 0.259 50 20 JCGD CC(=O)N[C@@H](CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(Br)cc1 919886702 YWKGCDLISCYWMV-KGLIPLIRSA-N 461.338 0.534 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ncn(-c4ccccc4)n3)CCO2)C1 1779030178 HWDDSNDFDZFWTG-HSZRJFAPSA-N 476.497 0.023 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)N1CSCSC1 1779031603 BULAPZQDSMMQEF-VLIAUNLRSA-N 480.616 0.172 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779032660 QBZVKVASOLRDMB-HSZRJFAPSA-N 497.512 0.417 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)N2C[C@H]3C[C@H]3C2)C1 1779254873 ZUELDJDXRGINKJ-HGWXKVLFSA-N 484.601 0.975 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cnc3ccccn13)C2 1779371103 DCGZSERBDTWRCQ-CJFMBICVSA-N 491.552 0.703 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781334114 VJSWAWURZKYNRO-MJGOQNOKSA-N 499.374 0.593 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1781395662 OTTBHWAXBFUWOK-YADARESESA-N 488.589 0.963 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1cccs1)C2 1782208998 GAWUFKICCFZGNN-VGOFRKELSA-N 479.603 0.365 50 20 JCGD Cc1nccn1CCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1782490997 JNTVOUYGZVJMQX-AUSIDOKSSA-N 462.595 0.859 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(=O)n3[nH]nnc3n1)CCO2 1782863832 AOYQMJLYHGGOLO-LGQSSRTCSA-N 496.434 0.141 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3c(=O)n(C)c4ccccc43)CCO2)C1 1783534828 ZMKPBFDPQKLXTH-XOBRGWDASA-N 465.348 0.953 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1783963928 FVKUOTVHHSUEBQ-QXKUPLGCSA-N 492.411 0.883 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3F)C[C@@H]21)c1ccc(B(O)O)cc1 1786983655 OUTZXWJZAGEUJP-LRQRDZAKSA-N 458.270 0.481 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)no1 1787492614 HGRDZVGLTYVJTQ-CENBSLRLSA-N 461.288 0.982 50 20 JCGD COCc1c[nH]c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)c1 1787508287 CYCGRPRBRGHWRH-USIWJDQSSA-N 470.530 0.888 50 20 JCGD CC(C)(C)c1cnc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cn1 1787786942 XGRMFOFPOLMSAF-FNHZYXHNSA-N 481.557 0.680 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4nccnc4c3)C[C@@H]21 1791291234 PABHQHPCGVVAKK-ZWOKBUDYSA-N 454.531 0.596 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792983958 WCOUHYRXOYHGEP-PTIUUAQKSA-N 455.914 0.062 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)COc2ccc(Cl)cc21 1793774204 OHVCZCUIZBPWCE-UHTBIJDUSA-N 486.352 0.909 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2c(=O)[nH]c3ccccc3n2n1 1797103969 ZKUKXRMZTADOKB-ZWUHOBOKSA-N 458.906 0.791 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)c(F)c1)C2 1797748714 XCJUXXOQWGVXKZ-BEJVLZFQSA-N 485.491 0.970 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])cc1F)C2 1797753129 UWBDZODPMNIYND-KSPBDQMDSA-N 472.433 0.249 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Br)ccc1O 1798838122 MIURMHYEHQZMNR-DBWKPXFBSA-N 483.363 0.731 50 20 JCGD CC[C@@H](C)[C@@H](N)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095002 PHHKFXZCXYRITD-ILMFXRJHSA-N 474.606 0.296 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)CCOC1 1799349302 SKJANKFKEVKKIU-QEAYJNAZSA-N 494.358 0.950 50 20 JCGD C[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)Oc1ccccc1 1800340583 GNOOZNQJUUVIHU-CVFMPKEZSA-N 452.316 0.427 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1800643093 LJNMGAOILFZJMN-ZWUHOBOKSA-N 471.308 0.520 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)c1cccc(Cl)c1)C2 1801013309 MQGUNRSZNAQGQK-VZJWBNGJSA-N 451.955 0.302 50 20 JCGD COc1nccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1F 1807366462 ZEFQHAPFBKRIOB-UWJYYQICSA-N 478.289 0.938 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)Cn2ccccc2=O)[C@@H]1c1cccnc1 1807443038 RJVZDLWPLBKLJY-JPYJTQIMSA-N 454.531 0.322 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807943299 TVCCAEQEEQDAIU-WBMJQRKESA-N 475.307 0.312 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1 1813072227 CFNVARACJNEKHS-RCBCJABQSA-N 457.579 0.932 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1814122715 DIQGGRQSEAAPMW-HJNYFJLDSA-N 466.347 0.386 50 20 JCGD Cc1noc(N)c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1814906540 SOBKQGIHCHQSBB-VIFPVBQESA-N 456.488 0.560 50 20 JCGD CN(C)c1ncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)o1 1815337294 RBJMQYAMRKIHOB-CYBMUJFWSA-N 455.305 0.417 50 20 JCGD CCOC(=O)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1 1815348438 NYHUFVBJEJYZLN-CQSZACIVSA-N 457.317 0.392 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cn3ncccc3n1)CC2)c1cccc(B(O)O)c1 1815356736 NRZRMPKESGKEMT-CQSZACIVSA-N 462.300 0.405 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)C(=O)NCC(C)C)sc2C1 1817323095 GZCQTXURRJFETQ-NSCUCBQXSA-N 473.559 0.961 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817475355 OEEIMOMBVYRBOA-FQEVSTJZSA-N 464.335 0.988 50 20 JCGD CCOC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)CC1 1824864664 VYSDVOFGRPKHGB-NSHDSACASA-N 472.527 0.711 50 20 JCGD C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2 1825642224 PTBLLJUAVCAVAZ-RNFRBKRXSA-N 467.309 0.278 50 20 JCGD Cc1nn(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)c1F 1830535375 NDHOKTOFTYJMLV-KZULUSFZSA-N 461.332 0.969 50 20 JCGD Cc1nnc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)s1 1830538600 KQNZQINXXQQEDG-SJCJKPOMSA-N 461.382 0.876 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1830575526 VUFJMZWJGFFHKN-AVYPCKFXSA-N 463.959 0.346 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1F 1830736616 VFLHOKNDWWLGDM-JXFKEZNVSA-N 461.893 0.701 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1F 1831313785 NBMAKLWGQSRRRS-VWLOTQADSA-N 484.333 0.517 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)C1 1831646531 MLHZZEFGOBTBCM-AUUYWEPGSA-N 474.967 0.316 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nc(Cl)ccc1F)CCO2 1833243019 UGCOIIUIANBVEO-NRFANRHFSA-N 492.895 0.256 50 20 JCGD COc1cccc(CCC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1833791474 YAQRYACTERBEIQ-UHFFFAOYSA-N 488.633 0.967 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(C(F)(F)F)c1)CCO2 1833794367 FKJSAZCKMXFHFL-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccncc3F)CC2)CC1)c1cccc(B(O)O)c1 1834799913 DNEAOXVQNPQKJR-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3noc4c3CCCC4)CC2)CC1)c1cccc(B(O)O)c1 1834799988 MFOYTNMTQRFOBD-UHFFFAOYSA-N 480.374 0.732 50 20 JCGD COc1cscc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800191 XWUWVSNKSKKAHX-UHFFFAOYSA-N 471.388 0.936 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1C(F)F 1834800926 ASUMZDVHGGYYHU-UHFFFAOYSA-N 489.332 0.765 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc2nccnc2c1 1835401811 BXUQSHAICSSVBN-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835712888 JFZKKZCLQZWUIF-NRFANRHFSA-N 457.380 0.125 50 20 JCGD CCn1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c2ccccc21 1836339812 QWSNVPWJQLVFJW-LAUBAEHRSA-N 450.923 0.726 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCN3C(=O)C=CC3=O)CC2)CC1)[C@@H](F)Br 1836413304 ACJLYGAKRYTATA-GOSISDBHSA-N 473.343 0.564 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838418598 GEQKODBYRBTYDT-DJJJIMSYSA-N 454.936 0.843 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)N1CCN(C)CC1)CCO2 1839105949 MMEUAAIUNVUZEI-QKLQHJQFSA-N 475.428 0.110 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1OC 1839399343 YBKSMBMBMNVJEC-RUZDIDTESA-N 498.341 0.076 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1c[nH]c3c(Cl)cccc13)CCO2 1839589036 GXAGOGSADUCRJD-XMMPIXPASA-N 497.744 0.885 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CC3)C2)C1 1840184408 KIMVGGDGANEZTE-QGZVFWFLSA-N 450.458 0.158 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CC1Cc3ccccc3C1)CCO2 1840932458 CKMZEDUTUUTJPV-VWLOTQADSA-N 472.586 0.621 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)[C@@H](F)C1 1841516937 XMDHYYXGLBFECP-MOPGFXCFSA-N 489.353 0.779 50 20 JCGD CC[C@H](CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)NC(=O)OC(C)(C)C 1843011966 OXETYZPBGLQJBX-GOSISDBHSA-N 459.352 0.877 50 20 JCGD CCC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)[C@H]2CSCN2C(=O)[C@@H]2CCC(=O)N2)C1 1845873501 ZFAFAQLAFYSGDZ-SOUVJXGZSA-N 456.996 0.777 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1846143508 HUHYHOUCRGLWFS-FFZOFVMBSA-N 483.374 0.971 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)O[C@H]2C1 1846148837 LJWYORXCLMUPKY-FPCVCCKLSA-N 457.955 0.814 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](Cl)COC)C1 1846365825 XOMYJYRTDAYJGP-KBPBESRZSA-N 461.943 0.900 50 20 JCGD N#Cc1ccccc1OCC(=O)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 9755036 KHJJGDYFVUFJQV-UHFFFAOYSA-N 473.511 0.489 50 20 JCGD O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 9931048 VEYDWPLIHBGHFZ-SNVBAGLBSA-N 472.317 0.407 50 20 JCGD NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)CNC(=O)c2cccs2)c1 725742091 ZQLDADRZFPKGFZ-UHFFFAOYSA-N 461.319 0.349 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCN(C(=O)c2ccccc2OC(F)F)CC1 725871119 GLEKVJJNJGZZPP-UHFFFAOYSA-N 465.413 0.810 50 20 JCGD O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1cccc(S(=O)(=O)N2CCOCC2)c1 726867835 WMJUCKFCFKFIHR-UHFFFAOYSA-N 480.568 0.905 50 20 JCGD Cc1ccc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1S(=O)(=O)NCC#N 726883741 HDJLLCRXHMSBIR-UHFFFAOYSA-N 478.556 0.473 50 20 JCGD CN(C)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1F 728330079 LRHZSROVWOGGGT-MRXNPFEDSA-N 481.458 0.220 50 20 JCGD CCN(C)C(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 729166113 NSMOPOJBXHWDQH-UHFFFAOYSA-N 474.539 0.874 50 20 JCGD COC(=O)c1ccc(OCCNC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 731283431 FIVMTTJGCLVIGH-UHFFFAOYSA-N 478.527 0.812 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c1ccccc1C#N 769185390 TVUGXFZFTQVCIV-UHFFFAOYSA-N 480.886 0.503 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)c1 915077191 IYMGLUCOBILSAO-QBFSEMIESA-N 451.526 0.832 50 20 JCGD CNS(=O)(=O)c1ccc(Br)c(C(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)c1 1117827084 RYDPESWFTNNISG-JTQLQIEISA-N 454.368 0.463 50 20 JCGD Cn1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1C(F)(F)F 1778252296 KZXOYTHDFIYCRG-IIBYNOLFSA-N 494.279 0.560 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1778382992 YDPQDZPESILHFR-XIKOKIGWSA-N 454.325 0.244 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3[C@H]1O)CCO2 1779029810 ZHFARIVSESOBBO-HWHXTQLESA-N 479.537 0.425 50 20 JCGD COc1cc(F)ccc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779035020 ZZEBBVYNNHPDRH-JOCHJYFZSA-N 457.462 0.590 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(F)cc(F)c1F)CCO2 1779035187 AQTGORPQJQPMEV-OAQYLSRUSA-N 463.416 0.860 50 20 JCGD COCCOCCOCCOCCC(=O)N1CCO[C@@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779299489 AJRDKSCECBYVIG-JOCHJYFZSA-N 490.670 0.754 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1 1779663886 QUUJMVCVBZYRGL-FQEVSTJZSA-N 478.431 0.856 50 20 JCGD CSc1ncccc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779839571 GATAWPXQAUXDQZ-NRFANRHFSA-N 456.528 0.559 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097732 GYWZUEZELLOTOL-DYESRHJHSA-N 494.457 0.028 50 20 JCGD COc1c(Cl)ccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1780172098 SRSQWIOIFOWMLS-WZONZLPQSA-N 487.749 0.865 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1782989507 UIWBBBJIRAZXCG-RCZVLFRGSA-N 479.342 0.766 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H]3COCCN3C(=O)OC(C)(C)C)CCO2)C1 1783874347 DBHPLLUDLLALTE-XFQAVAEZSA-N 475.970 0.706 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935404 QTCUNUQDVODQBC-OAQYLSRUSA-N 467.954 0.950 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CCCN(C)C(=O)OC(C)(C)C)C2)C1 1785588687 UUBNJTNLHPRADA-QHCPKHFHSA-N 483.610 0.836 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3CS(C)(=O)=O)[C@H]2C1 1785685518 RIRUSJFKHQEKQO-SCNOPHJPSA-N 473.979 0.473 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2CO[C@@H](CNC(=O)C3(C(F)(F)F)CCC3)[C@H]2C1 1786757676 YUBCDGOVDOQPHH-XIRDDKMYSA-N 454.254 0.692 50 20 JCGD COC(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)s1 1789688778 LPMZKGXPLAFRHF-SNRMKQJTSA-N 486.355 0.051 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1)n1ccnn1 1789726681 MTHINUVYXDBYIS-HZEGPAAWSA-N 498.588 0.165 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1 1789921806 XKWIUPVVSVTKPI-YYFQZIEXSA-N 496.374 0.932 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1789929158 JCBNDDUZFZHKFJ-SBJFKYEJSA-N 496.374 0.932 50 20 JCGD NC(=O)NCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)Cc3ccccc3)[C@H]2C1 1790780201 VFQDXZYRSLKWFI-QAETUUGQSA-N 467.364 0.641 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)ccc1F 1791944990 OTVSKZUBLHGYOT-MDKPJZGXSA-N 456.279 0.421 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1COc2ccccc2O1)c1cccc(B(O)O)c1 1793476907 CFNKVJJUWOAVOP-IYWMVGAKSA-N 450.300 0.848 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)CC1 1793845602 IYOPMJOTDWDBCG-RDSHKEJNSA-N 457.531 0.916 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793879269 UCLWQEIZMVZRJV-KRXQYRFLSA-N 490.001 0.081 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)n2[nH]cnc2n1 1796183537 UZXUFPSRLFTGOD-XFMPKHEZSA-N 493.952 0.802 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccc(C)c13)C2 1796443707 CQVLUTAMZGROEL-XSLZEOFGSA-N 477.525 0.980 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cnc2ccc(Br)cn12 1797571863 VXRAPKCVYJQCLG-YHYOWMERSA-N 471.739 0.900 50 20 JCGD Cc1nn2cc(CC(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)nc2s1 1798439539 HCBKTYGMGPNYGZ-YOWGUQMCSA-N 468.543 0.592 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1OCC1CC1 1799698410 KUGGALKVXCNRJR-IRJINJETSA-N 494.353 0.681 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccnc2c(O)cccc12 1800096528 MWNCGNITAMVNLB-VPTLXERWSA-N 461.283 0.137 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1nc2c(Br)cc(F)cn2n1 1800126436 JPTAXDIVOARSOD-OTMMVIPVSA-N 490.717 0.434 50 20 JCGD COc1ccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(F)c1 1800835565 RQOGQLRJQSMDGT-CIQMAITOSA-N 483.500 0.749 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2 1800979715 WBOLVTUJCGAPCD-WMDQAZIPSA-N 465.978 0.465 50 20 JCGD COC(=O)CSCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1803581293 WCLZJPYYUJKRPF-KKSFZXQISA-N 465.576 0.367 50 20 JCGD Cn1nc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c2c1CCC2 1807362486 LZSVBDLTKSFLMU-WZONZLPQSA-N 473.342 0.617 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374503 ZTMIYMKWIFCLGU-BHYGNILZSA-N 464.100 0.772 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](C)NC=O)[C@H]1c1cccnc1 1808417416 YSEMWESTXLEVMA-FOGVZHARSA-N 453.503 0.356 50 20 JCGD CC(=O)O[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(C)C 1810302091 GCBGTMHGJYMBNN-YYWHXJBOSA-N 482.541 0.987 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303202 QRHFDCDBCYNLLX-WJPUGNRLSA-N 489.540 0.690 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810305401 LDZDNIKMYXFZTH-ZAAXVRCTSA-N 465.514 0.021 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN(C)C(=O)C(=O)O)[C@@H]1c1cccnc1 1812868705 KEQUUBRWBHKXRM-CORIIIEPSA-N 455.309 0.414 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@@H]1c1cccnc1 1813071483 UCZVVGAFFLJUAQ-IIBYNOLFSA-N 473.509 0.870 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)n1cccc1C=O 1815339935 VRTQOXJOQSUVJC-CZUORRHYSA-N 466.328 0.924 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347948 YZKMTSGATMBNOE-BBRMVZONSA-N 453.333 0.582 50 20 JCGD Cn1cccc1C(=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361496 HFDVXOOZAQLULQ-AWEZNQCLSA-N 452.301 0.270 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3[nH]nc4ccncc34)sc2C1)c1ccc(B(O)O)cc1 1816857487 IORWWMRWIKVTPN-ZDUSSCGKSA-N 462.300 0.634 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C=N/O[C@@H]1CCCCO1)CC2 1819797442 BUAGJHIIUVUNCA-RQAOHGNXSA-N 487.542 0.896 50 20 JCGD O=C(Cc1ccccc1O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1825299625 JQRNXJLOIUAQQY-INIZCTEOSA-N 451.313 0.997 50 20 JCGD COc1cnc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1 1826176339 ZWJFIOVMCXLTOS-FQEVSTJZSA-N 452.320 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)CC1 1827272764 CBXJKQMNYJXRMH-SFHVURJKSA-N 494.618 0.444 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H]2CCCS2(=O)=O)CC1 1828924295 NCZIZEJHEGTBQO-OALUTQOASA-N 477.587 0.496 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCn2cncn2)CC1 1828924995 CKQJGGNAYYGAIO-IBGZPJMESA-N 454.535 0.600 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1Cl 1830108330 OJVVILWOLYTXQR-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CS(C)(=O)=O)C2)C1 1830535871 VQNXWOHVRJFCHZ-JKIFEVAISA-N 469.398 0.155 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733798 TZARJDMKHULYSQ-AVRDEDQJSA-N 480.949 0.578 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)C(C)(C)C 1831086299 POEHSXQMYIZRLP-VQIMIIECSA-N 462.385 0.779 50 20 JCGD CC(C)[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)N1Cc2ccccc2C1=O 1831344305 AMQBFXBTDMNAGK-MZLICYQSSA-N 493.988 0.723 50 20 JCGD O=C([C@@H](F)Br)N1CCC([C@@H]2CCCCN2C(=O)CN(CCO)CCO)CC1 1831489688 GVVDRKAYMMMSHR-DOTOQJQBSA-N 452.365 0.583 50 20 JCGD Cc1nc[nH]c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549468 QGLYIAQMKANWOT-BTYIYWSLSA-N 485.969 0.920 50 20 JCGD CC(C)c1nc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)no1 1832792278 XRCJDEOWOLXZLJ-SCLBCKFNSA-N 459.341 0.975 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832793133 DWTLLIYXMVQTGW-CXAGYDPISA-N 474.312 0.279 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1833212416 DEIHQBRCZQAWBR-CZAAIQMYSA-N 495.020 0.337 50 20 JCGD Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)co1 1834204766 GFVCVQZQDRQIKX-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)c3ccccc3)CC2)CC1 1834581030 FLGWVPABCOLFLN-QFIPXVFZSA-N 480.569 0.604 50 20 JCGD NC[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccc1 1834798098 ZONCRNMQTNLZBM-DEOSSOPVSA-N 478.402 0.294 50 20 JCGD O=C(NCC(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)c1cccs1 1834819529 USXGREPYRVWHGB-GOSISDBHSA-N 474.377 0.719 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cc3cnc[nH]3)CC2)CC1 1835117859 SLSZNTJPIBYZOP-LQKURTRISA-N 468.562 0.658 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@H]3Cc4ccccc4O3)CC2)CC1 1835479314 RCXDCWFKCVORGJ-JOCHJYFZSA-N 471.602 0.935 50 20 JCGD CCCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835931399 QWZHGNLTURMXJM-RUZDIDTESA-N 466.343 0.703 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1835937105 OMAXFMICTZTRGX-XMMPIXPASA-N 481.289 0.371 50 20 JCGD COCc1c[nH]c(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c1 1836105369 AKDAPKNYINSXRG-UHFFFAOYSA-N 462.595 0.719 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)C3(N4CCN(C)CC4)CC3)CC2)CC1 1836376253 JCOUOADSOOZHSM-FQEVSTJZSA-N 470.058 0.592 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccc(Cl)cc1)CCO2 1836597522 NGPHRZADOOJUBI-HWBMXIPRSA-N 498.772 0.894 50 20 JCGD O=C(NC1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1)OCc1ccccc1 1836688954 HIRXDEIVQAFYIN-AVRDEDQJSA-N 495.960 0.502 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921394 GUIPEECNYQIOMS-UHFFFAOYSA-N 472.347 0.488 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838395443 QZATXHFBKPETLC-UHFFFAOYSA-N 497.600 0.890 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1839152438 ZEDUJHYUGJPRRU-MSOLQXFVSA-N 486.418 0.105 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1839210151 GAIFWHMCDKISOR-MUKKUYKPSA-N 467.922 0.253 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ccncc13)CCO2 1839507466 AMRAJMBNBOPTRI-VWLOTQADSA-N 475.310 0.298 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1839962822 RPDIEJUGYFUTRJ-FZKQIMNGSA-N 458.309 0.329 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3O1)CCO2 1840139027 IFQXHVVAJNWGKS-YKSBVNFPSA-N 474.558 0.210 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(CC(C)C)nn3C)C2)C1 1840151960 SIYXSTPLSWFGPL-LAUBAEHRSA-N 456.971 0.942 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3NC(C)=O)C2)C1 1840156195 KGLDNWGFDMRZQG-UTKZUKDTSA-N 453.923 0.969 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(NC(C)=O)cc3)CCO2)C1 1840728107 LAPWMBIAWQFTNR-RXVVDRJESA-N 453.923 0.969 50 20 JCGD O=C(c1cc(Br)ccc1O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011701 IEABCOQWJQPKSN-UHFFFAOYSA-N 459.105 0.965 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2nc3ccccn3n2)C1)NC(=O)NCc1ccccc1 1843230712 PNDHINFXOPFJEM-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1846354564 CPHDXEBJZLZMHE-UHFFFAOYSA-N 480.326 0.864 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1ccc(S(C)(=O)=O)cc1)C2 1846384679 VYDBRVRBSTWOJU-UHFFFAOYSA-N 450.561 0.209 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1CCc2sccc2C1 1848107773 KPINBOBUJCOICJ-ROUUACIJSA-N 454.556 0.620 50 20 JCGD Cc1nc(N2CCOCC2)[nH]c(=O)c1CCC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 14280233 YANLTTODKWLFHD-UHFFFAOYSA-N 497.600 0.207 50 20 JCGD CS(=O)(=O)c1ccc(N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 15486278 RZEZJKLDXDGCLZ-UHFFFAOYSA-N 479.490 0.721 50 20 JCGD O=C(NNC(=O)c1ccc[n+]([O-])c1)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 22024184 XNYNNBQVVMRXFW-UHFFFAOYSA-N 495.561 0.901 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN1C(=O)OCC(F)(F)F)NNC(=O)[C@H]1COc2ccccc2O1 728345783 QWYMOEHNWRIRFZ-SMDDNHRTSA-N 475.376 0.680 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](NC(=O)c2cc(Cl)ccc2F)[C@H](C)O)n1 728729997 YDHOCFPTSNQRLP-BTDLBPIBSA-N 486.909 0.657 50 20 JCGD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1 729258454 XBFCPCRIJPJZBN-HNNXBMFYSA-N 455.475 0.762 50 20 JCGD CC1=C(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C(=O)OC1(C)C 748553344 PKULTXAAQGGPKX-UHFFFAOYSA-N 465.528 0.439 50 20 JCGD CC(C)(C)OC(=O)NCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 749344380 JUEDFBFNEXWOOI-UHFFFAOYSA-N 455.537 0.940 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CNc1ccccc1 823328605 OQZKDKZUSGVLDH-KRWDZBQOSA-N 468.557 0.028 50 20 JCGD C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)Cn3nc(C)cc3C)nnc12 913025853 JIKYNWNPHKKMOZ-UHFFFAOYSA-N 466.527 0.983 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)NCCCN1C(=O)NC2(CCCC2)C1=O 915906084 HKWZLIRMCZADRP-UHFFFAOYSA-N 485.589 0.784 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1C 916232008 CDMDFRGGEFANGL-UHFFFAOYSA-N 495.583 0.855 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)c2ccc(Cl)nc2)c1 917253299 BPYJZAXIGRTDEG-UHFFFAOYSA-N 467.935 0.897 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccnc(C)n1)N(S(C)(=O)=O)CC2 917393529 OIZOQQKZOFEPQO-MRXNPFEDSA-N 463.516 0.512 50 20 JCGD O=C(COC(=O)CN1C(=O)c2ccccc2S1(=O)=O)NNC(=O)c1cccc(Cl)c1 921177252 REMXPJZCKXZMDL-UHFFFAOYSA-N 451.844 0.489 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1778934238 VTHCHOREWSNSMN-NTKDMRAZSA-N 465.315 0.073 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)nc1 1779029613 ZTMKFXSMRRMRRZ-QHCPKHFHSA-N 452.515 0.465 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CCSC(=N)N)CCO2)C1 1780097054 OIGLUTPAMKMTSU-FQEVSTJZSA-N 479.515 0.980 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cncc(S(C)(=O)=O)c1)C2 1782170896 FDTYSYRUTNJPKE-SQGPQFPESA-N 473.979 0.866 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1783500505 ILHNQSGHWLLTFM-IRTFSXLWSA-N 457.955 0.529 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)c1ccccc1F 1784091986 BNDTYLUVMGAHCW-VJPUMCBESA-N 469.941 0.756 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CC1 1785317319 RNNGVPHKYRUUTO-IERDGZPVSA-N 457.955 0.983 50 20 JCGD COc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1786010116 KBYKRTOEXIGOFP-YKNBRYRPSA-N 468.514 0.818 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N(C)C)cn3)C[C@@H]21 1787509108 ZZUWAXOQMNBTFQ-YUCXHDEDSA-N 481.557 0.875 50 20 JCGD COC[C@H](NC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1789655315 UTHYNCJGPBQFHO-FQEVSTJZSA-N 453.304 0.265 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCn3cccc3)[C@H]2C1 1791664188 OWQTXDRBLJFMHR-VDGAXYAQSA-N 454.531 0.560 50 20 JCGD CN1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]32)C1 1791792940 OGTRNRGBIKJHTJ-HJWJTTGWSA-N 458.987 0.660 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793879590 HHOFJQGWQCGDKS-QEOTZNIISA-N 474.986 0.623 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794111371 MQHJVEIVANLTAW-NQUGEPOWSA-N 469.336 0.366 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@H]1NC(=O)NC1=O 1794205229 HXXVZSORJYRNOJ-ITGHMWBKSA-N 471.942 0.355 50 20 JCGD CC(C)(C)n1ncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1Cl 1794432266 CUXSPNDMKIUNHC-FVCICTRLSA-N 489.964 0.807 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)cnc2s1 1797602682 ZOKGIDGELCFFNY-BJWYYQGGSA-N 466.328 0.310 50 20 JCGD CCn1nccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799095141 VHBIHMUSNVASGP-HATOLVCRSA-N 483.573 0.452 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@]1(F)Cl)C2)NC(=O)NCc1ccccc1 1799097569 PLIFSRWARPJBQF-KFFFPCEGSA-N 481.956 0.847 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccc3n(C)c1=O)C2 1800757486 MADAMYAGGPJHNU-NFFDBFGFSA-N 463.332 0.920 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1804183431 NTHXSZBTNCSTNJ-SUYBPPKGSA-N 466.336 0.670 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)C[C@@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1804354467 OSIMWHNYTBMWDS-CFLYGVGMSA-N 456.330 0.922 50 20 JCGD O=C(CCNC(=O)c1ccc[nH]1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804460823 LOEPXAZSZMRLOJ-CVDCTZTESA-N 489.341 0.229 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1805304854 JCIPDSSVHDTQOU-BEFAXECRSA-N 478.513 0.456 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1807352515 GIBWNBJRWQJWRX-YXJHDRRASA-N 477.974 0.592 50 20 JCGD CN1CCC(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1807363812 FQXWDEPIDNLSDF-ZJSXRUAMSA-N 464.375 0.813 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)n1cccc1C=O 1807371330 SRLGAWDQFSBTSS-LLBVYWAGSA-N 474.326 0.956 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cn2cccnc2n1 1809776561 FVKHWWGBGPXGBV-WIYYLYMNSA-N 470.298 0.438 50 20 JCGD Cn1nc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)c2c1CCC2 1810302462 KIWYIYVYJLDRCX-AOMKIAJQSA-N 488.552 0.936 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C[C@H]2NC(=O)NC2=O)[C@@H]1c1cccnc1 1812864209 GDJHPOZTLOALTH-MUYACECFSA-N 452.309 0.469 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)NC(=O)c2cnccn2)[C@H]1c1cccnc1 1813030972 IDGVKPUBJQQSMD-XPYUAMARSA-N 474.949 0.950 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C[C@@](C)(O)CC(=O)O)[C@H]1c1cccnc1 1813066407 AMCHGXGILODZCP-NPFVIJTESA-N 463.535 0.076 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccn3c(O)nnc13)CC2)c1ccc(B(O)O)cc1 1815340956 RAYIQZHXWCEIFO-CYBMUJFWSA-N 478.299 0.111 50 20 JCGD COc1cnc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cn1 1816611458 ZWBNUZWZWFEEEY-MRXNPFEDSA-N 465.474 0.827 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC(=O)N1)CC2 1817280420 VRMLGKBILKYFGT-COMDQNFDSA-N 457.516 0.468 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1820117768 BJAIXUGPBXQCQJ-STQMWFEESA-N 452.581 0.733 50 20 JCGD CCOC(=O)C(C)(C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1823483193 HMSYIBFUDPIYDI-QGZVFWFLSA-N 456.308 0.985 50 20 JCGD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827058042 POXBEDRGDGFDIV-KRWDZBQOSA-N 455.280 0.545 50 20 JCGD O=C1CC[C@@H](C(=O)N2CCN(C(=O)OCc3ccccc3)[C@@]3(CCN(C(=O)[C@@H](O)CCl)C3)C2)N1 1828877658 ILUDUEGNZVODLN-IUKKYPGJSA-N 492.960 0.317 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830363782 KWHBRQSTDSSBGE-OPAMFIHVSA-N 492.013 0.984 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732475 YZEHHYPPAZEDJT-CEQIKUNHSA-N 453.923 0.306 50 20 JCGD O=C([C@@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1 1831189427 ORHWLEZVMLSHTC-WBVHZDCISA-N 454.911 0.976 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1832005707 PXWCVSSKEXCGJD-JLTOFOAXSA-N 496.388 0.882 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc(C(F)F)no1 1834908896 LUTITXQAWWFFCP-UHFFFAOYSA-N 476.289 0.791 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1835737055 UMKDQOXWFFKLLA-UHFFFAOYSA-N 481.395 0.655 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3ccccc3=O)CCO2)C1 1835991940 CUBCAMLFXAOFHF-DNVCBOLYSA-N 456.337 0.336 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccnc3)CCO2)C1 1836154506 PNXWPIKZYDIFQW-OINMWHHXSA-N 468.514 0.215 50 20 JCGD Cc1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1837364390 WMKDSOAHKZWNML-UHFFFAOYSA-N 452.320 0.391 50 20 JCGD Cc1ccn2c(C(=O)N3CCOC[C@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)cnc2c1 1837459314 CMNAFGDMBHCALQ-DEOSSOPVSA-N 493.524 0.025 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)nc1Cl)CCO2 1837824292 LXRIXFMEWFIOFR-NRFANRHFSA-N 494.140 0.452 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1 1837920032 DUGGYMXFAUBCHR-FPOVZHCZSA-N 497.401 0.380 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCC(OC3CCN(C(=O)C(Cl)Cl)CC3)CC2)CC1 1838301249 YCJUVNKQCGOSQV-UHFFFAOYSA-N 463.406 0.953 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1839044715 UEGXZRFDOHISHB-MGPUTAFESA-N 470.979 0.365 50 20 JCGD C[C@](O)(C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)C(F)(F)F 1839198657 MKTBHOWCUZMIRT-ICCXJUOJSA-N 451.211 0.447 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839649615 ZIGMKUMGIPLYJC-LIRRHRJNSA-N 471.352 0.602 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1840077709 HHGYCRJLBQCDMS-PMACEKPBSA-N 485.405 0.749 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2 1840115158 FSDPBORFZXZEGU-RUZDIDTESA-N 493.564 0.877 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C2)C1 1840182439 JINFLZRGKMSING-HYBUGGRVSA-N 487.557 0.009 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccc4c(F)cccc43)C2)C1 1840182772 UBEOSUTVYYKQLN-DEOSSOPVSA-N 489.548 0.610 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccc3C(F)(F)F)C2)C1 1840185790 SQYDTBDLXNPRBT-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840911480 FZSYNBASZHZHRU-FVMGUFKOSA-N 487.981 0.440 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)[C@H]2C1 1846141893 XUMDRQWUYCYVBA-HSALFYBXSA-N 499.373 0.065 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1847013584 BRNXERKJCZIQHC-NRFANRHFSA-N 467.306 0.070 50 20 JCGD Cn1c(CCC(=O)NNC(=O)c2ccccc2O)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 17526456 WKQRMIRBINOAAK-UHFFFAOYSA-N 487.538 0.694 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(N2CCCC2=O)c1 28028347 NDPVIOFMQCWVLB-UHFFFAOYSA-N 472.523 0.909 50 20 JCGD COCCCN1CCC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 727030976 FYWYUCIMLCWUOM-UHFFFAOYSA-N 483.591 0.152 50 20 JCGD COCCCN1CCC(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1 727031568 UROLMHAWZFKGEK-UHFFFAOYSA-N 469.612 0.145 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)C1 728203494 KHKAIWAPRWUDBN-PBHICJAKSA-N 463.516 0.415 50 20 JCGD CC(C)OCCCn1c(NNC(=O)c2ccc3c(=O)n(C)c(=O)n(C)c3n2)nc2ccccc2c1=O 729279415 BPLFGCSWMUYVKO-UHFFFAOYSA-N 493.524 0.914 50 20 JCGD COCCNS(=O)(=O)c1ccc(C)c(C(=O)NNC(=S)Nc2ccc(OC)nc2)c1 729693182 MUHQDMPUGLSHHV-UHFFFAOYSA-N 453.546 0.955 50 20 JCGD CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(I)cc1 730569084 MOZZMIVIPKHTLF-UHFFFAOYSA-N 473.296 0.716 50 20 JCGD CN(CC(=O)NNC(=O)[C@@H]1Cc2ccccc2CN1Cc1ccccc1)[C@@H]1CCS(=O)(=O)C1 747900640 TVMQCSWXGMCQCS-YADHBBJMSA-N 470.595 0.880 50 20 JCGD COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 751291727 YQWOPDVVDWNWTM-UHFFFAOYSA-N 490.538 0.486 50 20 JCGD CC[C@@H](C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CCOC)n(Cc2ccccc2)c1=O 818032173 RXVVWIXUUDUSQP-OAHLLOKOSA-N 456.503 0.248 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)NC[C@H]3CCCO3)c2)cc1 913455257 VGXDWAMMXLLRFS-GOSISDBHSA-N 458.496 0.856 50 20 JCGD COc1ccnc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)n1 914762980 ISBKVWLKUXVSBC-UHFFFAOYSA-N 462.532 0.550 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NN=C2C(=O)Nc3cc(N4CCOCC4)ccc32)c1 915944282 DRJWPTZPEJWEJH-UHFFFAOYSA-N 457.512 0.860 50 20 JCGD O=C(NCCc1nnc2n1CCCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916235106 ACRBHONUKAEANK-UHFFFAOYSA-N 491.574 0.212 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NC1CCN(C2CC2)CC1 916240223 YJKVVXLQWKSNSR-UHFFFAOYSA-N 451.549 0.278 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C 916562101 LFCLADAYADUZQY-UHFFFAOYSA-N 460.512 0.724 50 20 JCGD CCC(=O)N[C@H](C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 920433087 MWFBBWBKPZCRMU-MRXNPFEDSA-N 497.556 0.126 50 20 JCGD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)NCCc1cccs1 920860534 KMMIVVVGESHTOR-UHFFFAOYSA-N 458.587 0.946 50 20 JCGD CC(C)NC(=S)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1 1317773840 NMODZFQSPSUKJW-UHFFFAOYSA-N 471.605 0.061 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)c3cncn3-c3ccccc3)cnc21 1318189353 SRMCVKFGCZEXAR-UHFFFAOYSA-N 471.275 0.539 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCCCC1(F)F)CCO2 1779029783 YUXMTMJFJPGSTR-JXFKEZNVSA-N 451.474 0.954 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CNc3ccccc31)CCO2 1779030485 AUTKGBSBRYDBKI-WZONZLPQSA-N 450.499 0.338 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1779316819 FFTYWGAUDYMXSX-IPJJNNNSSA-N 496.402 0.974 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc4c[nH]c5nccc-5c4n3C)C2)C1 1780040651 ARWXEJUDSVYANA-XMMPIXPASA-N 481.557 0.823 50 20 JCGD COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)ccc1O 1780445838 WIFHHFNUVBCKOG-AUSIDOKSSA-N 462.547 0.901 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)Cc3c(F)cccc3F)C2)C1 1780798466 HJYUBJYWZJTLOJ-QFIPXVFZSA-N 459.453 0.650 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCCN1C)CCO2)NC(=O)NCc1ccccc1 1780968515 MMEMCTVPNGDLEQ-BWKNWUBXSA-N 486.617 0.647 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783021803 BVQGDXOQLPTLAF-CSODHUTKSA-N 481.391 0.415 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CNC(=O)c3cc(C)on3)CCO2)C1 1783349720 RTXYVMUFECVTRO-UGSOOPFHSA-N 457.325 0.716 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)cnc3O)[C@H]2C1 1783399689 FXLWLUVREATFNI-GOPGUHFVSA-N 474.905 0.346 50 20 JCGD CCSc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1783412037 VUOBTEMDIUUJDG-VDGAXYAQSA-N 469.372 0.781 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](C)Br)C3)C2)n1 1783533685 FGVQGBWTHZNZKN-LIRRHRJNSA-N 455.353 0.900 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2NC1=O 1783934475 ASCYGSSURJAEGT-NPMXOYFQSA-N 473.530 0.223 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783937460 RSINXWBTNPNRAM-JOCHJYFZSA-N 460.510 0.598 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=O)c3cccnc3)C[C@@H]21 1783969867 QLYGWRBCYJKDFD-HJWJTTGWSA-N 467.364 0.822 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)[C@H]2C1 1785331303 RJVLXILIHOYNSK-QYOZUGBQSA-N 452.939 0.990 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(C(F)(F)F)cn3)C[C@@H]21)c1cccc(B(O)O)c1 1786984398 KKJZBMRPXGVRSM-QRTARXTBSA-N 478.236 0.082 50 20 JCGD Cc1cccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)n1 1788611684 QGCWTDLBEVXLQI-NDXORKPFSA-N 466.542 0.615 50 20 JCGD Cc1ccc(C(=O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1 1791171280 QQVIBTAOXUEZKT-JBACZVJFSA-N 450.300 0.151 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc4ccccc34)C[C@@H]21 1791291604 ZXNOYZOTQSGVQS-QSFXBCCZSA-N 469.542 0.907 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2 1792873193 OJPGFPAOLQRYEN-NJBDSQKTSA-N 464.407 0.467 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188303 NKFOVUSLTUYQEP-MHORFTMASA-N 479.770 0.750 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1F 1796192921 YKKSOBGSIDEOGR-BCDXTJNWSA-N 474.319 0.475 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(F)cn13)C2 1796443956 SDAVCBZEWLEZGF-DFZQMDCHSA-N 481.488 0.811 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1F 1797752730 BSJLOKNXEQPLBF-VTEUUUEMSA-N 499.499 0.518 50 20 JCGD Cc1nc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)o1 1798141951 CXNBVIUBVPOVNT-CEQLMSFQSA-N 484.557 0.841 50 20 JCGD O=C(Cc1ccc(F)c(C(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800431284 DNGAPTDPSZGLDI-VPTLXERWSA-N 494.250 0.970 50 20 JCGD CC(C)c1nc(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)no1 1804411965 BAYPJLXSMIWPSA-GCJKJVERSA-N 477.330 0.830 50 20 JCGD CCOc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cn1 1804918588 YSLYTZWZLFDJIW-HRAATJIYSA-N 490.524 0.902 50 20 JCGD COc1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1 1807360279 JUWLLXDZWVJQQZ-UTKZUKDTSA-N 461.287 0.193 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2ccc3ncnn3c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372773 HQDBSGCVDNCDOT-YKSBVNFPSA-N 484.325 0.366 50 20 JCGD CN1CCC[C@H](C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1 1807373909 VGCDWRBIFJXQAE-ONTIZHBOSA-N 450.348 0.423 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc(O)n3c2CCCC3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374291 GXAHMLGWYZSCOF-PGRDOPGGSA-N 489.341 0.633 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3cn[nH]c3cn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376035 RFMAPPSFLPZILE-VGOFRKELSA-N 470.298 0.666 50 20 JCGD Cc1nnc(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1 1807531551 ANENPJXCWZUMJV-LAUBAEHRSA-N 465.344 0.484 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCCC4(CCN(C(=O)[C@@H](O)CCl)CC4)C3)n2)CCCN1 1807826152 CFSFHROWCCBTAT-SFHVURJKSA-N 477.993 0.852 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2csc(N)n2)[C@@H]1c1cccnc1 1810303604 SSJBBAUUVYTYFJ-SUMWQHHRSA-N 466.527 0.752 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccn(C(F)F)c1=O 1810603978 UXCKGAQQEYFIOS-YLJYHZDGSA-N 496.279 0.952 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1815162733 NYXVPFHTALMHIV-BLLLJJGKSA-N 492.562 0.042 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccnc3c1OCO3)CC2 1819797797 KKBVPFTVZBIKFS-JTQLQIEISA-N 481.494 0.805 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1ncc[nH]1)CC2 1819801253 HKGGWNSJZCUYEB-LLVKDONJSA-N 454.516 0.723 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2)n1ccccc1=O 1820132207 ULPKUFKQJFZIGV-KGLIPLIRSA-N 460.560 0.851 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1)[C@H](F)Br 1820932262 FHTSGZZDXHMXQA-SKDRFNHKSA-N 456.209 0.817 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(C)C(=O)C(=O)O)n[nH]1 1821715554 ZRDIGFFQRVZMOR-ZWGXDWAISA-N 486.489 0.079 50 20 JCGD O=C(CCCn1ccnc1)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826683702 CULITSHQZWAUMP-MRXNPFEDSA-N 453.333 0.726 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1828761670 JCFQACPJTFKJMR-BYJPVGMQSA-N 490.561 0.805 50 20 JCGD CCNC(=S)NCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1831091841 ODOVMJBZQVDNBB-SFHVURJKSA-N 475.619 0.402 50 20 JCGD CC(F)(F)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831678925 GKFNLUOFFMFVGX-OAQYLSRUSA-N 454.279 0.118 50 20 JCGD O=C(Cc1ccc2c(c1)CCC2)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832503600 GNFCPAWEKXPTRK-AREMUKBSSA-N 478.354 0.168 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549499 SIEZSWYMFGIEFL-WIEQDCTASA-N 490.985 0.086 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832724032 KCJYBLIXIUCGSB-UWJYYQICSA-N 452.939 0.675 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898258 IHCANRHELJFDIL-SFHVURJKSA-N 489.428 0.460 50 20 JCGD CN(C)CC(=O)NC1CCN(C2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1834466830 KJXGKBRBCMPQJU-UHFFFAOYSA-N 487.649 0.466 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801100 LLZLQZCGOGNYBV-UHFFFAOYSA-N 495.414 0.883 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccn2cncc2c1 1835605182 YVINNYPLXOFLHX-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@](C)(Cl)CCl)CC2)CC1 1835645198 YBEYSDXTILGZRU-VQIMIIECSA-N 467.394 0.859 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)N1C[C@H]2C[C@H]2C1 1835678157 POVPBAQLKWFZKL-QRVBRYPASA-N 462.639 0.271 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3coc(Cl)n3)CC2)CC1 1835736964 CNMMRPNVUTZWQU-UHFFFAOYSA-N 475.937 0.826 50 20 JCGD CCc1oncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737226 YEFVNMMNPDDTBG-UHFFFAOYSA-N 469.546 0.735 50 20 JCGD O=C(c1cc(F)cc(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933961 KFIHGNQIOSCQKS-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835934131 LUFNWXZIINKHLU-UUOWRZLLSA-N 452.316 0.240 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)ccc1C 1835939223 IBBHTMVILZNCPB-RUZDIDTESA-N 495.341 0.017 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3(c4ccc(F)cc4)CC3)C2)C1 1837456991 UYOAPJZSNQEIJE-XMMPIXPASA-N 497.527 0.626 50 20 JCGD O=C(CCCCn1cccc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837620829 QCKJOJMCRMHKFX-DEOSSOPVSA-N 469.347 0.108 50 20 JCGD COCCOCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528057 CBSIJTJBEYXCGQ-QFIPXVFZSA-N 495.485 0.253 50 20 JCGD O=C(C1CCC(CO)CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199014 QDFXAQDUCPQVGH-PPPKJHQXSA-N 451.333 0.932 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C=CCN3)C2)C1 1839801884 HEUPHUFAMVSSNH-IPJJNNNSSA-N 478.387 0.977 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1839967069 ZJQDEGZEXHCBKS-ACJLOTCBSA-N 473.324 0.191 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1840032654 GJVFTDGRQDVSTK-URLQWDBASA-N 455.353 0.191 50 20 JCGD Cc1ccc(OCCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)cc1 1840183373 ZPGTXSBZBWMMKK-XMMPIXPASA-N 476.574 0.593 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)n(C(F)F)n1 1840185224 HJPUWAKMJDBMLY-FQEVSTJZSA-N 472.493 0.030 50 20 JCGD COc1ccc(F)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187214 MSTIRKRCPOYACY-QFIPXVFZSA-N 466.510 0.277 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1847026223 HPTOVXJGQAPWJE-UHFFFAOYSA-N 472.546 0.759 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc(N3CCCC3=O)cc2)c1 28808067 BXCVOLOMMQIMFY-UHFFFAOYSA-N 466.541 0.687 50 20 JCGD COc1ccc([N+](=O)[O-])cc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)CN(C)C)cc1 727761475 HNQXOSITZXEWFX-UHFFFAOYSA-N 451.461 0.727 50 20 JCGD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)N3CCOCC3)cc2)C1 728262343 DPLHVZPDABRGAE-HUUCEWRRSA-N 460.578 0.588 50 20 JCGD Cc1ccc(CCC(=O)NCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 728340827 NWUAWXPSYCNIEW-IBGZPJMESA-N 455.467 0.574 50 20 JCGD CCCCN1C(=O)CC[C@H](C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)[C@@H]1c1ccccc1OC 729275097 KYLGMOPHTKBLNZ-QOKNQOGYSA-N 468.576 0.860 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1sccc1S(=O)(=O)N1CCc2ccccc2C1 812188105 DDXCKEHACFHLER-UHFFFAOYSA-N 450.542 0.781 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2F)c2ccccc2c1=O 913597013 IJRDLWWECIPWCU-UHFFFAOYSA-N 461.475 0.685 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(F)c(S(=O)(=O)NC3CC3)c2)c1 914595748 RUAADGNUOVBSSY-UHFFFAOYSA-N 484.531 0.592 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@@]23C)c1 914829969 KPNMZUMIZMXMLB-QHCPKHFHSA-N 499.549 0.697 50 20 JCGD COCc1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 916424813 AXAJLWMJLQFWRA-UHFFFAOYSA-N 462.528 0.998 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2ccc(Cl)cc2O)c1 918357368 DGVZTWJDOGHKGM-UHFFFAOYSA-N 456.908 0.699 50 20 JCGD C[C@H]1CCCCN1S(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 919885814 RUZRNCURIYVLNT-DZGCQCFKSA-N 458.562 0.381 50 20 JCGD O=C(NNC(=O)c1ccc(Cl)c(S(=O)(=O)N2CCCCC2)c1)N[C@H]1CCS(=O)(=O)C1 919886539 UQLPHNMGVWQYIB-ZDUSSCGKSA-N 478.980 0.646 50 20 JCGD Cc1cc(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)CN3CCCC3=O)CC2)c(C)c1 920825896 LXONBOQFZWXJMD-UHFFFAOYSA-N 450.561 0.782 50 20 JCGD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)[C@@H]1COc2ccccc2O1 1317699943 ZEOBFHDJCUCRKJ-INIZCTEOSA-N 467.525 0.299 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnn3cccc(F)c13)CCO2 1779037347 WRYJYKVUGCRBAV-QFIPXVFZSA-N 467.461 0.229 50 20 JCGD CCc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n[nH]1 1779373154 IBDSYXYOTFPIRO-XMSQKQJNSA-N 455.519 0.412 50 20 JCGD O=C(C/N=C/c1ccco1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1779442663 YQRXEIWYOSMUDN-OXZVPYCZSA-N 453.304 0.206 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccncn1)C2)NC(=O)NCc1ccccc1 1780559474 OUJKBAKXRZDBAY-PXDATVDWSA-N 495.584 0.950 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cncc(O)c1)CCO2)NC(=O)NCc1ccccc1 1780967875 AHSCPAIRRXLAOS-XMMPIXPASA-N 482.541 0.577 50 20 JCGD COC[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968964 LDHJINNNXLHYPS-WZONZLPQSA-N 461.563 0.445 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)Cn2ccncc2=O)C1 1781488208 VYDVWJMPXNSNCS-SPYBWZPUSA-N 455.353 0.931 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Cl)C3)N1 1781600716 CAZLVRSYTQEZIA-GJIZYBQMSA-N 490.985 0.215 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccn(C(F)F)c1=O)C2 1782214222 IOPFAMIHGQKXFS-OPAMFIHVSA-N 483.516 0.744 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782550152 BLCYOJKVLRFMEN-ZJSXRUAMSA-N 468.363 0.087 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1 1783872817 HQKNBWOFTLKFLH-KXBFYZLASA-N 459.952 0.324 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)CCO2 1783936190 RWZVDIANANOCBX-HXOBKFHXSA-N 481.594 0.446 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)CNC(=O)OC(C)(C)C)CCO2 1783940128 RMWWYRRYKFACGF-QHCPKHFHSA-N 483.610 0.740 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C2)C1 1785223955 UDDHLHSSYCZKAQ-VGSWGCGISA-N 461.902 0.813 50 20 JCGD CCc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)co1 1787508430 ISHKWMHGPINETB-SAVYNJCVSA-N 456.503 0.964 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)CC)[C@H]2C1 1790960374 DGQODTUYUJGMAJ-AIUMHDJVSA-N 450.330 0.204 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21 1791254606 XTLHTEFGJRSXCK-TUUVXOQKSA-N 470.979 0.125 50 20 JCGD CC(C)(C)OC(=O)N1CCC(F)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)CC1 1792529798 UKEWUHNEJVWESU-FZKCQIBNSA-N 477.961 0.915 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H]1C1CC1)NC(=O)NCc1ccccc1 1792851962 BAHKWIIOXUBJNA-FPQOSCNCSA-N 469.586 0.968 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)[C@H]1SC(=N)NC1=O)C2 1792868291 TVQRMYKUAXCUPB-JOLBHGKHSA-N 461.382 0.409 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C 1793088724 KFPBIDPTCOHCIP-XYTFPVCRSA-N 488.379 0.938 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(F)(F)F)NC(=O)NCc1ccccc1 1795407063 OSAIJCQOPLLVNO-HGKCTWBKSA-N 471.480 0.875 50 20 JCGD C[C@@H](Sc1cccs1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795738740 DHXNWYHSYHCDPF-JNNRSPCRSA-N 460.386 0.812 50 20 JCGD COc1ccc2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCC(=O)NN(C)C)C4)ccc2c1 1797004179 WLCKEYQGFKYXFN-GPVSGQMNSA-N 469.542 0.820 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)n[nH]1)C2 1798522327 PCMRRJOSZGEBAB-KSPBDQMDSA-N 459.415 0.466 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl)[C@H]1SC(=N)NC1=O 1799275311 PKKCXCFUZROOGJ-IBDUMEDKSA-N 451.376 0.615 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(N)=O)C2 1800335695 CRZKSCRLKQLRCJ-INHOUBOVSA-N 476.331 0.614 50 20 JCGD COc1ccc(Cl)c(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1F 1801080112 TWVPQPANUNQKEP-YEZVWNJWSA-N 490.724 0.613 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802340025 XSWLXFGACQAPQC-YYIAUSFCSA-N 497.593 0.454 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)ncn2)[C@@H]1c1cccnc1 1803745040 RYPNQVHVDCKTPP-KUHUBIRLSA-N 462.470 0.209 50 20 JCGD C[C@H](Cn1cccn1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804715262 IEWZPRKKLCHUIZ-PIPMEXSNSA-N 461.331 0.614 50 20 JCGD O=C(CNCP(=O)(O)O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1 1807026097 QGMMSBURWSIRJR-IACUBPJLSA-N 467.232 0.503 50 20 JCGD CC(C)(NCCC#N)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807144772 ANVCPFNUYJCZTN-PZJWPPBQSA-N 463.347 0.363 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807365845 PPWPCKIARPUWPE-HJNYFJLDSA-N 450.348 0.565 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807374850 JRFXFOMOCXADHS-KNQAVFIVSA-N 484.325 0.746 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807376867 WXYHSXMSGJSFHQ-AKIFATBCSA-N 473.342 0.046 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809977520 CFWYRKNWEKGQKX-UHFFFAOYSA-N 494.353 0.674 50 20 JCGD Cc1ncncc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810302236 GYJMIIJNSCRKHH-OXJNMPFZSA-N 460.498 0.812 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n(C)n1 1813070742 LOMNYOCOIJXGPL-KKSFZXQISA-N 457.535 0.516 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)n1ccccc1=O 1813074914 WONARVCPVOHTPR-FHJLPGHOSA-N 468.558 0.883 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3ccncc13)CC2)c1cccc(B(O)O)c1 1815356703 MOXMCFBRJJKENR-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)no1 1817471900 VLMQKFWKCZXFPZ-KRWDZBQOSA-N 480.290 0.721 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccnc3c2OCO3)[nH]n1)c1ccc(B(O)O)cc1 1817472640 XQTNQCCBVKCWPX-QGZVFWFLSA-N 463.259 0.833 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=N/N2CCCCC2)[nH]n1)c1cccc(B(O)O)c1 1817476053 BWJUSFRLFPOOFL-IERINAHZSA-N 452.324 0.867 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)C1CCC(O)CC1)CC2 1819801898 VCFDIDHRODSLEB-OTTFEQOBSA-N 458.544 0.919 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)nc4cccnn34)sc2C1 1821268680 WNRAEOAPEVZTDL-LBPRGKRZSA-N 484.542 0.145 50 20 JCGD CCCNC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826083964 WKTIKKVHQJMHQM-ZDUSSCGKSA-N 452.581 0.735 50 20 JCGD O=C(c1cc(=O)nc2cccnn12)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057457 FVOXBCFMCXGEKM-FQEVSTJZSA-N 489.341 0.316 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1827679145 NVJUMUHUQBKLNB-YOGNZGIYSA-N 488.589 0.891 50 20 JCGD CCN1CCC(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1 1828348505 OZOFRRNGBREBEY-KRWDZBQOSA-N 456.377 0.781 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C3CC3)C2)C1 1829000551 JNOVWHRVAWRFOF-SANMLTNESA-N 491.353 0.842 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3cccnn3n2)CC1 1829565834 UJJRNONXKWCTDR-QFIPXVFZSA-N 461.331 0.956 50 20 JCGD O=C(c1nn(-c2ccccc2)c2c1COC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830723870 SMKHDKQKJMIRSU-CVDCTZTESA-N 490.944 0.572 50 20 JCGD O=C(c1cn2c(Cl)cccc2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728262 RHDQCXGLJQOPPQ-AUUYWEPGSA-N 457.314 0.657 50 20 JCGD CC(F)(F)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1831678901 GBNIPOHDIDYWGE-OAQYLSRUSA-N 454.279 0.118 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1833262510 RIXYNRHESWNKQH-CYBMUJFWSA-N 483.344 0.314 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)nc1 1833599864 UGKRYUCNINERDS-QGZVFWFLSA-N 466.343 0.359 50 20 JCGD CC(C)n1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1C(=O)O 1833608914 ZMTPKLSKHQFPQX-KBXCAEBGSA-N 491.314 0.923 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CCN3C(=O)C=CC3=O)CC2)CC1 1833615988 PTDWCIDALKMBHT-AWEZNQCLSA-N 469.380 0.657 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cccs3)CC2)CC1)c1ccc(B(O)O)cc1 1834797868 FUEHYVWNNNLUAB-UHFFFAOYSA-N 455.389 0.856 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)C(C)(C)C 1834798112 SRSSAGWZUKYDES-QFIPXVFZSA-N 486.422 0.102 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1835929175 FLLRWHMOENLYGS-JOCHJYFZSA-N 473.722 0.107 50 20 JCGD O=C(c1ccc(C(F)(F)F)nc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935661 YBRALNOFTQLCGS-NRFANRHFSA-N 493.247 0.164 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1cccc1C=O)CCO2 1835953635 FOCQOONMILPBQB-JVBIRTMNSA-N 498.540 0.452 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3cnccc13)CCO2 1837035789 LCHCEWYBTUZALQ-XMMPIXPASA-N 469.542 0.678 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1837459804 XKQZJEXZLQRZBS-FQEVSTJZSA-N 496.446 0.416 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837638331 BCXOZFQSWRSGPV-VOTSOKGWSA-N 458.320 0.098 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Cn1cncn1)CCO2 1837648806 UVZSTCFVBLAYIG-VKJFTORMSA-N 458.357 0.544 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1837842174 QRLSRMLMYPNESD-ZFWWWQNUSA-N 451.337 0.268 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837921043 UXTDITYAPRIUHX-UHFFFAOYSA-N 467.331 0.200 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)/C=C\C(=O)NC3CC3)CC2)CC1 1838361943 FRKUNMTWKWSZFA-ARJAWSKDSA-N 484.557 0.132 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc3c1OCO3)CCO2 1838475669 SDSQPKVNXOKCSK-SFHVURJKSA-N 456.293 0.665 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc(C(F)(F)F)n1 1838521360 QBNTWEJOVUVJTC-ACJLOTCBSA-N 481.855 0.779 50 20 JCGD O=C(c1nn[nH]c1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1838767421 HVKJPTMRZGWNDS-MFKMUULPSA-N 474.209 0.584 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1839146740 VCSNHYLLPDSWQS-FOIQADDNSA-N 451.911 0.418 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@](C)(O)CC(=O)O)C2)C1 1839155238 PELBCLINUKLIHL-KURKYZTESA-N 455.335 0.295 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)C(=O)c1ccccc1 1839198562 ITMSRSBSIKKSDQ-XLIONFOSSA-N 486.338 0.906 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1839389458 QEGYBJNKLKXDDM-ZZODWALSSA-N 484.347 0.998 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2 1839739273 WTAIVCIPORNWBC-PJFSTRORSA-N 494.898 0.854 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)C2)C1 1840032826 LIMRZKHILUIFET-UWCDFFNFSA-N 477.381 0.029 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N(C)C)cc3)C2)C1 1840185756 WXRXSRRHHZFDEN-QHCPKHFHSA-N 461.563 0.196 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCC=C1F)CCO2 1840949906 ZNYKSQUSEBHSNH-YADHBBJMSA-N 479.484 0.501 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)O[C@H]2C1 1841353887 WHBBUSUZAQDMNG-QXSJWSMHSA-N 457.955 0.814 50 20 JCGD O=C([C@H]1Cc2[nH]nc(C(F)(F)F)c2C1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014964 VAKNYVGIEPEIPW-CYBMUJFWSA-N 462.237 0.340 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2 1843416778 ZQTQTESBIPQEEN-KSXCTLEASA-N 490.561 0.600 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1844508978 VCTIKLGAVDEEPS-UHFFFAOYSA-N 451.409 0.568 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)Cn3ccc(=O)[nH]c3=O)cc2)cc1 15662496 QLUMOTTWDIGARX-UHFFFAOYSA-N 485.522 0.127 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc1OC 18021860 AYUHCXYCIJHASA-UHFFFAOYSA-N 490.494 0.089 50 20 JCGD O=C(CCN1C(=O)CCC1=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 22259737 DMXXSNUJGQHSML-UHFFFAOYSA-N 450.498 0.849 50 20 JCGD CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)N([C@H]3CCS(=O)(=O)C3)N(C)C)c2)CC1 728176503 FVYCRYOLBPOXRT-HNNXBMFYSA-N 493.051 0.772 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)n[nH]c3C)C2)cc1OC 728204223 ZBQMCEDQEPIQKD-HNNXBMFYSA-N 465.532 0.906 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1cc(F)ccc1Br 728549458 MNCGUVUILZFNJZ-KOLCDFICSA-N 462.297 0.385 50 20 JCGD CN(C)C(=O)NNC(=O)CCCCCNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 746012747 JAZWFEHJVDZBEQ-UHFFFAOYSA-N 489.620 0.612 50 20 JCGD Cn1c(=O)nc(O)c2nc(CCC(=O)NNC(=O)COc3ccc(Br)cc3)[nH]c21 746231200 HTGLXLQNKRPXSE-UHFFFAOYSA-N 465.264 0.284 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1sc(S(N)(=O)=O)cc1C 746621248 XEYPAXSIUNZOEK-UHFFFAOYSA-N 461.905 0.984 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cnc3c(c2)c(C)nn3C)c1 751259817 GRXRKDKERBICMN-UHFFFAOYSA-N 480.572 0.931 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)c1ccccn1 821892658 LHDAHDSXCJTVMN-OOXMNIKJSA-N 466.541 0.236 50 20 JCGD Cc1ccc2c(c1)C(=O)N([C@@H](C)C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C2=O 892686786 OAISZTLHJUSSRA-JTQLQIEISA-N 464.887 0.742 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@H](NC(N)=O)c2cccc(C)c2)cc1 913687046 NYSOABCFTIQXGQ-SFHVURJKSA-N 461.544 0.871 50 20 JCGD COCCS(=O)(=O)CC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc(C)cc2C)c1 915636517 NVIGJRSMTQSFHF-UHFFFAOYSA-N 483.568 0.926 50 20 JCGD C[C@@H](CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N1CCC[C@@H](C)C1 916450449 OPNGNJFXGBYUOW-SJORKVTESA-N 467.592 0.772 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@H]1COc2ccccc2C1 916636107 UFEUUBUQKDSQMS-QGZVFWFLSA-N 460.512 0.655 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)c1cc(S(N)(=O)=O)ccc1N1CCOCC1 920213443 QGPYUBVAZXXESV-UHFFFAOYSA-N 464.500 0.019 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnnc4ccccc34)C2)C1 1777726440 ZZXVZHQDJPIFLN-QHCPKHFHSA-N 461.482 0.386 50 20 JCGD O=C(C1=NO[C@H](c2ccccc2)C1)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1778173594 WPBZBLXYUGOSCD-URXFXBBRSA-N 463.299 0.328 50 20 JCGD NC[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)c1ccccc1 1779373549 YMNWPSUKZKEBCK-DZRGJMJISA-N 480.569 0.555 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1779566423 AZUBIRQHHGASMC-YZZKKUAISA-N 460.579 0.769 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)no3)C2)C1)NC(=O)NCc1ccccc1 1779676504 FLUMWQFSFXGOOS-JOCHJYFZSA-N 472.502 0.170 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(-c2ccccn2)[nH]n1 1779770669 BVVGAWNWMHQABF-RCZVLFRGSA-N 489.341 0.593 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780098130 CSGBIIXRDMEIRQ-ZSEKCTLFSA-N 462.459 0.488 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CC[C@@H]3CCC(=O)N3C2)C1 1780608467 APFKBKHXPHTHTN-SRIQFFGBSA-N 498.584 0.214 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1780931378 NKGHJIFEYYTRDG-LZJOCLMNSA-N 491.894 0.581 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968274 ICKLIELRPGPSKS-KOSHJBKYSA-N 488.589 0.029 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CN3CCCC3)CCO2)C1)NC(=O)NCc1ccccc1 1780970410 XTKKQXNQEICCEL-XMMPIXPASA-N 472.590 0.258 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(Br)c(O)c3)C2)C1 1781697960 FNNSRDYQTNGAJP-FQEVSTJZSA-N 483.363 0.971 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cl)COC)C1 1782171749 CWDXZZWCFKEFHJ-OIPACUDHSA-N 453.989 0.082 50 20 JCGD COc1ccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1 1783781317 BOOTUMLKNDPQJY-JHVJFLLYSA-N 483.525 0.366 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)CCO2)C1 1783879749 XODNSBRZLUMCDQ-VTJXTGGHSA-N 491.969 0.527 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)SCC(=O)N3)CCO2 1783934626 JCTFYKKORFEIIN-JOCHJYFZSA-N 475.571 0.547 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(N(C)C)ccc1[N+](=O)[O-])CCO2 1783935381 OOGYJTUNGUPIOT-JOCHJYFZSA-N 476.534 0.477 50 20 JCGD C=CCCc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(O)n1 1785774695 YLQOFKNVRFEBGH-VDGAXYAQSA-N 473.574 0.872 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(O)cn3)C[C@@H]21 1787508491 YUYMYOVVLSXQML-SJQXZKBRSA-N 468.514 0.443 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc(OC)ccc3[N+](=O)[O-])[C@H]2C1 1787751602 LDSAKDNDHSAFGL-XPCVCDNBSA-N 456.883 0.846 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccn4ccnc4c3)C[C@@H]21 1788611381 XMHOWSFIAMTCOQ-SNRMKQJTSA-N 463.498 0.240 50 20 JCGD COc1cc(N2CCC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](F)Cl)C4)CC2)ncn1 1793132256 VVMXBYLWBHRPIY-LTCOOKNTSA-N 455.918 0.826 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncnn1C 1794571996 VSDGQEWGYADFPN-FVCICTRLSA-N 458.431 0.166 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(C(F)(F)F)cc1)C2)c1cccc(B(O)O)c1 1795737399 CGVBLKYDUYQQMU-UPHUGPLXSA-N 476.260 0.831 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3c(s1)CCCC3)C2)c1cccc(B(O)O)c1 1795738986 KYJRKVRQQYCBQP-UPHUGPLXSA-N 454.357 0.824 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(C(F)(F)F)c[nH]1 1796545229 HYNKBJSQGDQRJE-FVCICTRLSA-N 451.210 0.230 50 20 JCGD COC(=O)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1 1798443637 QTSAEQKYGDGLCS-BCDXTJNWSA-N 465.510 0.966 50 20 JCGD COC(=O)c1ccc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)s1 1799808557 DAAZLHCTYDQIFO-BJWYYQGGSA-N 456.329 0.709 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)C2)C1 1800720755 AHWZSGOKQABKLH-YYIAUSFCSA-N 471.982 0.823 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1800738892 SLKDHQKEHGYJEH-HAOOACFXSA-N 471.982 0.823 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCNC(=O)C1 1801067880 UHONYFANAJDBQU-CJXDPKRBSA-N 474.470 0.250 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)nc3cccnn23)[C@@H]1c1cccnc1)[C@@H](O)CCl 1803141338 MZFATPPGWCZKNR-URLQWDBASA-N 456.890 0.404 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1 1806342787 LHUZCNFHZRUHMS-SZMVWBNQSA-N 455.353 0.523 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1806343866 ZUCDOCLDHQZLDR-DYVFJYSZSA-N 452.309 0.424 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CSC(=N)N)[C@@H]1c1cccnc1 1807002468 SEXGGLRNHJGWFR-FRXQJERCSA-N 470.559 0.848 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370500 GDYIASRFBYPFCI-DYESRHJHSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376838 WRQHMSOAHQGIDE-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1n[nH]c2c1CCCC2 1808042609 KQCKINNNJLWPBH-MBSDFSHPSA-N 473.342 0.997 50 20 JCGD O=C(CC(F)(F)C(=O)O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808286580 GEFXBVMIZYCDAP-CRAIPNDOSA-N 461.230 0.191 50 20 JCGD CCn1ccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810299971 VZHCKJOAHNFPQN-OXJNMPFZSA-N 462.514 0.930 50 20 JCGD O=C1Cc2cccc(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)c2N1 1812209015 WASRULOEOFADKR-DVECYGJZSA-N 484.321 0.889 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1 1813071650 WBFVNNHDGBUPAJ-YADARESESA-N 472.590 0.863 50 20 JCGD C[C@H](CBr)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2C(=O)CNC2=O)[nH]n1 1814778898 KJBJGSAZTODJNY-ZYHUDNBSSA-N 455.313 0.985 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CC(c3ccccc3)=NN1)CC2)c1ccc(B(O)O)cc1 1815348292 KKIDNVKGVRDJAT-XLIONFOSSA-N 489.366 0.815 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nc3ncccn3n2)[nH]n1)c1ccc(B(O)O)cc1 1817471943 YFBATEGIDMAYAX-MRXNPFEDSA-N 460.263 0.147 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnn2ccncc12 1818733739 QOYZCFOFBQFKOG-GOSISDBHSA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNC(=O)C(F)(F)F)[nH]n1 1819404764 XVLOJTRSTHOSHA-ZDUSSCGKSA-N 482.423 0.393 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1cccn1 1819801381 KTNGEVFJYWPDLI-VXGBXAGGSA-N 454.516 0.825 50 20 JCGD CC[C@@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1 1822092322 YHZAMLLBRBUTQD-HIFRSBDPSA-N 460.373 0.862 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc(=O)n2[nH]cnc2n1 1823002255 CBFSLMAPERSHRD-KBUNVGBDSA-N 470.284 0.790 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1)c1cc(=O)n2[nH]cnc2n1 1823002268 CBFSLMAPERSHRD-KSBSHMNSSA-N 470.284 0.790 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)CC2 1826083899 VAKZSKYOKNCEEJ-NSHDSACASA-N 464.508 0.233 50 20 JCGD O=C(c1ccc2ncnn2c1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052066 NOYRZPAELRDWGN-NRFANRHFSA-N 461.331 0.956 50 20 JCGD O=C(c1cc(O)n[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551469 PNYAOAMMJCLIEA-JTSKRJEESA-N 491.932 0.781 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1828953512 PDCIPKZRHMMBAH-FCHUYYIVSA-N 488.346 0.095 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cnn(C)c3)C2)C1 1830538967 WUTITEHKVGSPAA-BEFAXECRSA-N 457.369 0.840 50 20 JCGD CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737839 HTOGLRGGLMNXQX-HOIFWPIMSA-N 492.013 0.982 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1 1831872989 BUBNVVZWFPMIEP-NRFANRHFSA-N 478.638 0.143 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833312052 JFLDLOUKHJGHJN-DTBYZMGXSA-N 466.966 0.928 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C(=O)O)ncn1)CCO2 1833494561 INASGVKGUSALOQ-LJQANCHMSA-N 452.540 0.096 50 20 JCGD O=C(c1cnc(OCF)cn1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1833573250 ZHAVKLMKRQAZIY-XJKSGUPXSA-N 465.251 0.543 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834800689 YYAJAMCUOXUVLL-KRWDZBQOSA-N 467.379 0.318 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737067 UZTJEPLAICLSGZ-YWZLYKJASA-N 459.595 0.244 50 20 JCGD CN1CCC[C@H](C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)C1 1835738237 OCMZRAZJFYYTDK-KRWDZBQOSA-N 471.606 0.212 50 20 JCGD O=C(CCc1cccs1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927023 BQZVEXPINKJKRN-QFIPXVFZSA-N 458.345 0.131 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(F)c1F 1835941163 JJDOMUHCKQKYHP-QHCPKHFHSA-N 474.269 0.337 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c2ccccc21 1836717051 GDCMKFWMTQNYBA-HXUWFJFHSA-N 478.977 0.938 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1837180897 URJDPAKGGMZQIW-UHFFFAOYSA-N 462.595 0.872 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1838943943 YEVOBXZUHUWXQJ-DEOSSOPVSA-N 467.526 0.686 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839184118 UWKUDQJLPVVSTE-GEQKSPFYSA-N 497.976 0.605 50 20 JCGD Cn1c(=O)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)nc2ccccc21 1839201418 XICKZXLRPPFXDB-JXFKEZNVSA-N 497.321 0.694 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1839964053 DQDKIRXGXBAPJX-AUUYWEPGSA-N 482.335 0.678 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3COc4ccccc4O3)C2)C1 1840182850 WNQGCMUYWYDKDT-KOSHJBKYSA-N 490.557 0.046 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1 1840587514 XDAGYXKNRRVIPW-OCAHMQCSSA-N 475.546 0.394 50 20 JCGD Cc1cc(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1F 1840706551 BDEICEQLMCUEKO-QHCPKHFHSA-N 474.269 0.337 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1840892209 NATBRUQTXGQHAI-MZNJEOGPSA-N 467.526 0.559 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)c2cnco2)C1 1841729467 RLRGECGYNOOEAV-SFHVURJKSA-N 498.345 0.307 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c1 1843014373 CPCWUXDQRGEVTC-UHFFFAOYSA-N 452.276 0.471 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846165650 OLBCLGDCYYQQNZ-QGZVFWFLSA-N 465.315 0.498 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc(=O)n2[nH]cnc2n1 1848099856 ZWPCAFIFFMMVOT-IHRRRGAJSA-N 479.925 0.365 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)NNC(=O)COc2ccc(OCc3ccccc3)cc2)n(C)c1=O 15886900 MCIMVTRYQWQGJL-UHFFFAOYSA-N 492.492 0.239 50 20 JCGD CC(C)NC(=O)CNC(=S)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 727275287 PUVJAGBLRMHKJQ-UHFFFAOYSA-N 463.585 0.799 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=S)NC1CCOCC1)c(=O)n2Cc1ccccc1 727780244 HDTIWOPPVNYLEH-UHFFFAOYSA-N 485.570 0.102 50 20 JCGD O=C(CCCCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)N1CCOCC1 745992899 MLCWVZMNGHBWOR-UHFFFAOYSA-N 456.521 0.370 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@H]2Cc3ccccc3O2)o1 748271833 HPPLEROTGSUCON-RHSMWYFYSA-N 477.495 0.761 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCC1CCOCC1)N(S(C)(=O)=O)CC2 749187343 BLLMLTLJRQAIDM-QGZVFWFLSA-N 484.575 0.710 50 20 JCGD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1 759794389 PYYOAVMVUMIWPX-LBPRGKRZSA-N 470.529 0.060 50 20 JCGD COCCNC(=O)CN1CCN(C(=O)CCC(=O)C(C#N)=C2N(C)c3ccccc3N2C)CC1 920435523 PBOLRIYUQMPOML-UHFFFAOYSA-N 468.558 0.564 50 20 JCGD CN1CCN(c2ncccc2CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CC1 921199323 GYGHDBHUJKFZDJ-UHFFFAOYSA-N 450.503 0.869 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1ccc(S(C)(=O)=O)cc1 1317751438 VHAYOWWZCKYFAU-UHFFFAOYSA-N 460.559 0.315 50 20 JCGD Cc1ccc(SCC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1778088676 KEJWDEPGHABGMG-QHCPKHFHSA-N 454.357 0.911 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1778934237 VTHCHOREWSNSMN-DVECYGJZSA-N 465.315 0.073 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1sc3nccnc3c1N)CCO2 1779031623 UORUJYSUJHSXJG-OAQYLSRUSA-N 482.526 0.029 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)CS[C@H]3CCCCO3)CCO2)C1 1779032780 YIGKUANCJRDDRZ-RXVVDRJESA-N 463.560 0.388 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2=NNC(=O)C2)C1 1779303387 DFNPPSGYEHVPOY-PDSXEYIOSA-N 485.969 0.508 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1CCCCC1)C2 1779371080 MJXYVCXGOYSQHU-HYBUGGRVSA-N 472.590 0.689 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(-c2cccnc2)[nH]n1 1779754308 RFRHHJVPPSEJGI-RCZVLFRGSA-N 489.341 0.593 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1779954184 RYLCHADZIRYWCV-WBMJQRKESA-N 459.297 0.890 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780097734 GYWZUEZELLOTOL-UTKZUKDTSA-N 494.457 0.028 50 20 JCGD CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)C2 1780708715 AJLQKMXILUJSHJ-NEYJZJCJSA-N 453.971 0.988 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)ccc1O)CCO2)NC(=O)NCc1ccccc1 1780968428 KWNXPGUASMJSDF-VWLOTQADSA-N 497.552 0.888 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)C2 1782214239 IVHOQJXOQDVCDQ-PUZWTLIVSA-N 487.557 0.608 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C3CCN(S(C)(=O)=O)CC3)CCO2)C1 1783533672 DPGHPFGERZDOKC-GUYCJALGSA-N 466.398 0.271 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)[C@H]2OCC[C@H]21 1783545528 HEHQYYZLMNOZFB-MRNZGAJFSA-N 487.981 0.440 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3c(I)cnn3C)CCO2)C1 1783874129 CJBUXVYPRYSXPB-BZNIZROVSA-N 496.733 0.722 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(F)cccc3F)[C@H]2C1 1789631678 HQNQSLYBRUKBHV-QOKNQOGYSA-N 452.502 0.860 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)n1 1789926432 XVPHMFZXWMRABC-YXWQFLTLSA-N 473.343 0.957 50 20 JCGD O=C(CCc1ccccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791764358 HIKFDYXIJJTJBT-VCOUNFBDSA-N 454.307 0.732 50 20 JCGD C[C@@H](CNC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792978896 QNHFPFNXMPMJHK-UJCHZGTJSA-N 467.950 0.738 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)C1CC1 1793060902 AMKRLRMPTKRSFD-RIUYPTKQSA-N 459.971 0.869 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(C(F)F)n1)C2 1796441690 QQRILGBRQDWUQM-OQLCOEBBSA-N 463.445 0.615 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccn3c1)C2 1796442170 UPRLOROLQFLBCX-KEMUROEHSA-N 463.498 0.672 50 20 JCGD COC(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cc1 1796445665 HLMLOSIWZITIOK-RHZSSNLCSA-N 495.536 0.739 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC1(F)F)NC(=O)NCc1ccccc1 1797161140 AGXMFMWBAYBJAP-ZMMAXQRCSA-N 465.501 0.577 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccccc1)C2 1797750439 CZRYEGZZMGMCOH-VPTLXERWSA-N 453.499 0.357 50 20 JCGD 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O=C(NC[C@@H]1CCN(C(=O)CC2CCOCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371481 VQFDSAFZMZEYMN-NZQKXSOJSA-N 451.332 0.898 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1808290765 AURXXPHFHCRBTQ-AXHNFQJDSA-N 456.330 0.876 50 20 JCGD COCc1oncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1808822357 SLZABECVQVSEGV-MGPUTAFESA-N 479.497 0.848 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809969518 JKHCOWPLZFOCBZ-JWGURIENSA-N 479.342 0.981 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810294066 HYIFYGWPPDXFJH-GCJKJVERSA-N 476.541 0.913 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1817977834 SUHCOTRABNBHCJ-FUHWJXTLSA-N 468.348 0.422 50 20 JCGD Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3cccc(B(O)O)c3)CC4)c(C)n2n1 1818247680 VGSNZDTWWUYQCL-OAHLLOKOSA-N 491.342 0.417 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(C(=O)O)ncn1)CC2 1819794072 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C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1830539444 GXKSJEDNRFHJNK-IAQYHMDHSA-N 475.258 0.579 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4cccnc4n3)C2)C1 1830540319 PMQUODMTXSSQHB-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830720022 QSSWBCMLNZUCDS-RXVVDRJESA-N 453.898 0.837 50 20 JCGD O=C(CCN1Cc2ccccc2C1=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732448 YHDXIUBMGDZZEN-GCJKJVERSA-N 465.934 0.089 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1831644073 NMTYAEUGICOYTO-FXAWDEMLSA-N 473.979 0.963 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CC1 1833611742 QUMYUNKXKXOULA-KESTWPANSA-N 499.417 0.531 50 20 JCGD O=C(CCCc1ccncc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833844835 OXDLCOIBFGHZCW-UHFFFAOYSA-N 478.402 0.970 50 20 JCGD CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1833895294 SJQDOZLBKIOZSX-QHCPKHFHSA-N 468.514 0.026 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CN3CCCCC3)CC2)CC1)c1cccc(B(O)O)c1 1834801116 PPKBLQRQYWJNFO-UHFFFAOYSA-N 456.396 0.038 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cn2ccsc2n1 1835594988 ZSJCPKKYVNTRRA-UHFFFAOYSA-N 481.387 0.575 50 20 JCGD CC(=O)O[C@H](C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)C(C)C 1835651549 WZXJVNRUTJNBIW-QFIPXVFZSA-N 467.611 0.519 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1ccccc1=O 1835827866 MEXXEQPPHWTKRJ-QGZVFWFLSA-N 495.584 0.293 50 20 JCGD Cc1scc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1C 1835929578 XBFFZDSHTBBDSJ-JOCHJYFZSA-N 458.345 0.429 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C)c1 1835931347 NKWLQMPRSNAUNT-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1837146385 JVSACHHAJWRWMQ-OAQYLSRUSA-N 478.575 0.147 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(OC)c1 1837459542 IYLXZJOHKNRXIO-XMMPIXPASA-N 499.524 0.086 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc4cnccc34)C2)C1 1837459915 OXWUWEJTPHNYEP-XMMPIXPASA-N 491.508 0.012 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921360 DBMLWMQPGURSQC-CQSZACIVSA-N 467.169 0.762 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(-c4ccncn4)noc3C)CCO2)C1 1838492001 BHEJUOODJBNEOE-QVKFZJNVSA-N 479.921 0.764 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)ccc1C 1838986843 JWEWIWNYFLFABR-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CCCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1839014673 FATQQCMZXYGVCE-RUZDIDTESA-N 466.343 0.703 50 20 JCGD O=C(c1cc2n(n1)CCCC2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200480 IHLFJPWDMRSIJE-CRAIPNDOSA-N 459.316 0.980 50 20 JCGD O=C(c1cc2ncccn2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201503 ZIIYPKQHBIBPJO-RHSMWYFYSA-N 456.272 0.490 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839224777 OPANTHOPIPDBNM-HRJSYZDASA-N 476.534 0.378 50 20 JCGD COc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1OC 1839398203 COUQQJZVYRFQCG-HRAATJIYSA-N 456.923 0.682 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC[S@@](=O)CC)C2)C1 1839965458 ZDZAXPGLOYFULO-QAPORCKPSA-N 453.399 0.775 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CC[S@](=O)CC)C2)C1 1839965459 ZDZAXPGLOYFULO-SJUHQFKNSA-N 453.399 0.775 50 20 JCGD O=C(CCc1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840053366 ICWRHMBUTVUABD-XMMPIXPASA-N 470.306 0.208 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1 1840153520 RDQQMRPPEQDWIW-UWJYYQICSA-N 463.922 0.591 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1840154010 HZXVAZNSXNMQGX-GCJKJVERSA-N 484.933 0.160 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3c3ccccc3)C2)C1 1840185269 NIEKHIFSMVGIGH-YOSAUDMPSA-N 458.559 0.620 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(C1)C3)CCO2)NC(=O)NCc1ccccc1 1840598845 CNFCFFMSLBKNNL-LRARRHDQSA-N 485.585 0.589 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CC3CN(C(=O)OC(C)(C)C)C3)CCO2)C1 1840869006 ZFBKBHHDUSXRFH-VGSWGCGISA-N 489.997 0.954 50 20 JCGD O=C1NC(=O)[C@@H](CC(=O)N2CCCC23CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)N1 1841962028 QLKSIIWEHSRZCX-LSDHHAIUSA-N 463.332 0.794 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](Cl)COC)C2 1847046113 XGBQANADDRQRKI-ZIAGYGMSSA-N 461.943 0.900 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)cc1 1847564266 SQDVNMNISHUXOX-VJANTYMQSA-N 469.991 0.950 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2ccc(N3CCCC3=O)cc2)cc1 10689513 INSBHPOPCOBDCK-UHFFFAOYSA-N 488.522 0.405 50 20 JCGD C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(CCC)c(=O)c3ccccc23)c1 17163889 ILAHWAGYDZSUCT-UHFFFAOYSA-N 467.507 0.793 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNC(=O)c2ccc(Br)o2)cc1 17406874 VVMMMHXKTGJCRI-UHFFFAOYSA-N 487.332 0.548 50 20 JCGD COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 24259160 VZULHRVKUPDDFX-UHFFFAOYSA-N 467.525 0.881 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1 728385738 PDWUUAFQSUQZAN-OLXGIWCBSA-N 455.558 0.281 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1cccc(OC(F)F)c1 728510832 WCDJXJJGFMJNDZ-UHFFFAOYSA-N 491.494 0.932 50 20 JCGD Cc1nn(-c2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)c(C)c1Br 729275053 JWZFKBWVFRRMBP-SNVBAGLBSA-N 458.338 0.950 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccccc3N3CCOCC3)nc2)CC1 744887785 ZTISKBNYQHMLMG-UHFFFAOYSA-N 489.602 0.681 50 20 JCGD Cc1c(NC(=O)[C@H](C)SCC(=O)NNC(=O)C(=O)N2CCCC2)c(=O)n(-c2ccccc2)n1C 748247451 OQWCXEVIGARNQF-HNNXBMFYSA-N 488.570 0.314 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 751206082 BNHFCCJBDHROJJ-ZDUSSCGKSA-N 495.539 0.634 50 20 JCGD O=C(CNC(=O)c1ccco1)NNS(=O)(=O)c1cc2c(cc1Br)OCCO2 751283613 YLDXHEHDZFAMNK-UHFFFAOYSA-N 460.262 0.553 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 849119259 OZSPYMDWQDJGEP-UHFFFAOYSA-N 496.929 0.971 50 20 JCGD O=C(CCNS(=O)(=O)c1ccccc1Cl)NNC(=O)c1csc(N2CCOCC2)n1 912852097 KGNRJPZYVZSMDP-UHFFFAOYSA-N 473.964 0.763 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)s2)cc1 916233500 YDJAZFOMSIHSLG-UHFFFAOYSA-N 479.540 0.550 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cc(Br)c[nH]2)cc1[C@@]1(C)NC(=O)NC1=O 917733111 RSTQCEVAFKBDGV-MRXNPFEDSA-N 486.304 0.464 50 20 JCGD Cn1cc(Br)cc1C(=O)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 920050599 FAYAZBLZJDSFKL-UHFFFAOYSA-N 489.308 0.618 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1[nH]cnc1-c1cccnc1)CCO2 1779032518 MFWAMDOZAKPKLW-QHCPKHFHSA-N 476.497 0.228 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3C1)CCO2 1779033612 AAWAUCKAQKNMHO-DFBJGRDBSA-N 463.538 0.934 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1F 1779036221 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3[nH]nc4ccncc34)C[C@@H]21 1787508553 ADJWUUDRGVTIRS-VOSSUDFCSA-N 478.513 0.685 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)[C@@H](Cl)COC)[C@H]3C1)C2 1791257514 LBEZSDQXPYQTJY-QSUVVDIXSA-N 496.992 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4O3)C[C@@H]21 1791292984 DMPDYKZRHZHCIT-MMKMLUHNSA-N 458.559 0.733 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)[C@H]2C1 1792275477 MBNQRYMFKGEIIW-QUSNUVHPSA-N 492.013 0.884 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2 1792867616 IDXWMLIBDLOJLI-IBEHDNSVSA-N 491.427 0.849 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)[C@@H](O)C1 1792981313 JJLKDZRQUXUNFK-KWCBCURJSA-N 489.997 0.184 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(F)c1)NC(=O)NCc1ccccc1 1793555427 ZHOPGCDBEHYIDA-HATOLVCRSA-N 484.532 0.770 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C[C@H](CS(C)(=O)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839150301 IPAYCQCZQIOHAP-KBRIMQKVSA-N 459.392 0.360 50 20 JCGD O=C(c1ccnc(Cl)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200067 CPYHKCLGRUACDP-XHDPSFHLSA-N 451.680 0.891 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1 1839200262 FIIWELJHGQLOFD-KBXCAEBGSA-N 474.283 0.629 50 20 JCGD O=C(c1nn[nH]c1C(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201894 MYLMYVWXOLMOMG-GWCFXTLKSA-N 474.209 0.584 50 20 JCGD Cc1cccc(Cl)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1839338967 HUOXOALBGJIUDC-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3ccoc13)CCO2 1839586876 XEAWFWKDSKWMRW-XMMPIXPASA-N 464.283 0.496 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839988494 SWQVMDDAAZRNKP-SUMWQHHRSA-N 468.320 0.658 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c1 1840186349 KCXSDHIAXZVYPN-KRWDZBQOSA-N 466.343 0.359 50 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NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3onc4ccccc34)C2)C1 1782346723 OQIYGSOBNYYWDN-QFIPXVFZSA-N 450.455 0.584 50 20 JCGD COC(=O)N(CC(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)Cc1ccccc1 1783690540 HLEBFAZJAIELBU-DEOSSOPVSA-N 489.573 0.458 50 20 JCGD CCOc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1OC 1783701597 JOJJTVZKCZZSDP-RUZDIDTESA-N 497.552 0.779 50 20 JCGD CO[C@H](C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783933145 CNYXZXAFCOJHJM-ICPLQIHGSA-N 499.609 0.118 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1785525405 YHAGQERLFFHCIY-QFIPXVFZSA-N 471.250 0.100 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CC3Cc4ccccc4C3)C[C@@H]21)c1cccc(B(O)O)c1 1786986888 QBLXLNXFTBHJHI-XWGVYQGASA-N 462.355 0.765 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(O)O)C[C@@H]21 1790696387 ZFKKTAKERXFXRU-PPZVJCQGSA-N 464.316 0.646 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCN3C(=O)OC(C)(C)C)C[C@@H]21 1791293074 IDSGDIVNFCSBPH-OKYOBFRVSA-N 495.621 0.739 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N[C@@H]1C[C@@H]3CC[C@H](C1)N3C(=O)c1ccc(B(O)O)cc1)C2 1796190395 UMEJNDQLXJZOEH-RSPOEFSDSA-N 494.357 0.254 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2ccncc12 1797058995 GPGOMLSXPIAUCI-RVQRMFQJSA-N 464.486 0.067 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](C)Br)C4)cnc2c1 1797067697 GZJKOGDATXEJSQ-ZJOBFFGXSA-N 463.332 0.990 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2c(=O)[nH]c3ccccc3n2n1 1797105052 VTIWVOTYTIFQDZ-MCYUEQNJSA-N 489.330 0.557 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1797117621 RPQNPBDVOOHOCV-ZTYXSZCMSA-N 463.934 0.523 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1797699531 DLAWXCKKJCBZJT-NFWAQSGPSA-N 491.501 0.431 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797753138 UXWQYXBDHWQLJL-CWPLJXCYSA-N 480.525 0.144 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cn1cncn1)C2 1798524523 FGJAUHSRAHMYDZ-BCEDRHLLSA-N 486.485 0.651 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1nccnc1C(N)=O)NC(=O)NCc1ccccc1 1799040281 YQLVIWBTONKAQD-BCDXTJNWSA-N 494.556 0.174 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnsn1)C2)NC(=O)NCc1ccccc1 1799095352 OMDUDCJTFDPGSC-HGKCTWBKSA-N 473.559 0.088 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c(C#N)c1 1799240716 GTQUWHBWKROWFV-FEJSZKPUSA-N 457.531 0.072 50 20 JCGD Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(F)c1F 1801743924 VLMGOEDAGAHLHY-DBWKPXFBSA-N 459.453 0.789 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)CCC(=O)N3CCCC3)C2)CC1 1806651389 FHUUGDWAADHGGI-UHFFFAOYSA-N 470.574 0.933 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1C 1810302032 DXKJCQASLAHWPG-MGPUTAFESA-N 478.513 0.456 50 20 JCGD Cn1cccc1C(=O)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1813474439 DYJYIKBDBKTNFU-RXVVDRJESA-N 460.299 0.302 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)[nH]n1 1819401796 SLLZQLPDQKEBIX-INIZCTEOSA-N 482.461 0.519 50 20 JCGD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)n1ccccc1=O 1819570685 PLFNUSHCAPQTFR-HNAYVOBHSA-N 463.303 0.818 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1cncnc1)CC2 1819793660 QYGWFGKZBLGNHR-GFCCVEGCSA-N 452.500 0.400 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc3c1NC(=O)C3=O)CC2 1826088272 VRLMBCRVNZZXET-LLVKDONJSA-N 484.538 0.877 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cccnn3)C2)C1 1830546177 PUYCKOIFAHTSEQ-RDTXWAMCSA-N 457.325 0.343 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737760 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C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1838401962 DQNQNIOLXXYEKD-OAQYLSRUSA-N 457.644 0.487 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1838435606 XPMURMMQURAKPT-CVEARBPZSA-N 466.348 0.827 50 20 JCGD COc1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1838875698 HRZCJAYYZZLDMB-MSIOFZDNSA-N 483.525 0.899 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839144849 MGYGKHJVQWNOSG-GCVGFEQUSA-N 453.927 0.594 50 20 JCGD COc1nccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1F 1839199833 VQIXLICYYCMEJB-SUMWQHHRSA-N 464.263 0.990 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)C1=O 1839200301 IDNJNNXPQAAAKT-HNAYVOBHSA-N 484.278 0.582 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1Cl)CCO2 1839323751 HVKAXESMTJSLHO-QFIPXVFZSA-N 491.907 0.861 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(OC(F)F)cc1)CCO2 1839330516 BNBOVSORCAVYLY-HSZRJFAPSA-N 490.268 0.352 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)CCO2)C1 1839789245 SXAGXTIKBQVNKA-UZLBHIALSA-N 473.885 0.987 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1840033180 XADPBEWZKVPPOD-KFFMJTPYSA-N 484.351 0.360 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3COc4ccccc4O3)C2)C1 1840150483 LRUIZSUWOSJGDE-RRMPHLOHSA-N 454.907 0.537 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)C1 1840182381 HYBYIRFHTPLMLI-GLDPYIMESA-N 496.605 0.185 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](O)(C(=O)N2CCOC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1840190697 IMVBWIXMGVMZEA-VQTJNVASSA-N 496.388 0.618 50 20 JCGD COc1ccc(COCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1840254579 ANZMQERZDIKITC-DEOSSOPVSA-N 492.573 0.041 50 20 JCGD CSc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1840303716 CXFIPDVGXKRTOD-HSZRJFAPSA-N 478.615 0.780 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCn3nc(C)cc3C)CCO2)C1 1840346323 RBVBINUEOIJGFZ-BMBTXRBNSA-N 499.572 0.480 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)cc2)CC1 1840774009 HWQITGCGUSWRMM-URXFXBBRSA-N 495.020 0.498 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CN2CCN(C(C)=O)CC2)C1 1843973882 NFXXMNAMEUEORH-UHFFFAOYSA-N 487.513 0.501 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844230668 YFYRTJLPTRUBOG-KRWDZBQOSA-N 473.578 0.244 50 20 JCGD CNS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1 9960354 KRGIAXFKDBGRMG-UHFFFAOYSA-N 458.500 0.771 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc3c(c2)OCO3)C1 16230141 TUVYZAOXOXHHHC-CQSZACIVSA-N 450.473 0.882 50 20 JCGD Cn1c(C[C@@H]2CCS(=O)(=O)C2)nnc1SCC(=O)NNC(=O)c1ccc(Cl)cc1 18667944 XNXUBCOBDDUCBF-NSHDSACASA-N 457.965 0.999 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)[C@H](C)N1CCOCC1 729624189 TXIZFMIGXOGTHP-IRXDYDNUSA-N 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CCc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n(C)n1 1807376460 VOUPBNYDFGZYGJ-PGRDOPGGSA-N 461.331 0.691 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1 1809977922 MGBMBIUEQHAWOH-QFIPXVFZSA-N 466.343 0.953 50 20 JCGD COC(=O)[C@H]1CC=CC[C@H]1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809979757 APNRFLLPQXMWLL-RTWAWAEBSA-N 468.359 0.967 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnn3ccncc23)[C@H]1c1cccnc1 1810303349 QSIPRVMAWJXFFG-KKSFZXQISA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)Cc2cccnc2)[C@@H]1c1cccnc1 1810303628 UDXLGNKDENWHDP-YUXAGFNASA-N 488.552 0.365 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)O)[C@@H]1c1cccnc1 1810305266 JVHOVHMCXNZQCS-IFXJQAMLSA-N 472.527 0.218 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810306137 URKKJDDKFNJSNS-MDYRTPRTSA-N 453.547 0.740 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCS2(=O)=O)[C@H]1c1cccnc1 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Cn1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cccc1=O 1825737251 DFUWXHGHYVNSDF-HXUWFJFHSA-N 451.332 0.612 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@H](N)c1cccnc1)CC2 1826085441 UEIXFDYVRPJPOF-CABCVRRESA-N 459.576 0.913 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)no1 1827052740 CJFYQRHWSLUURO-FQEVSTJZSA-N 482.346 0.925 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923887 CIEUYNBSSJABNC-FQEVSTJZSA-N 494.556 0.231 50 20 JCGD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)n(C)n1 1828925288 IXBKMFLCZCMEQM-GOSISDBHSA-N 469.546 0.974 50 20 JCGD O=C(c1cc(=O)c2ccccc2o1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830307022 UWPMHAVEHPCWBX-HRAATJIYSA-N 450.875 0.463 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CS(C)(=O)=O)CC2)CC1 1833262482 QRLJBWRESRBBHA-ZDUSSCGKSA-N 452.415 0.634 50 20 JCGD Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)sc1C 1834798332 IZGZCNJIHOSDEM-UHFFFAOYSA-N 470.404 0.939 50 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CC(=O)N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)C(C)(C)C 1837710472 ZLDNMZAPVGIULH-NQIIRXRSSA-N 457.644 0.845 50 20 JCGD Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)no1 1837922096 KTQLKJYULXVQNJ-UHFFFAOYSA-N 455.320 0.518 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1 1838536009 HQHRPQLOXFKZTL-HNAYVOBHSA-N 456.337 0.629 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1 1839200615 LCCJMNOQNVVUGP-RHSMWYFYSA-N 491.270 0.759 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200998 UTIOGHSRMQDECK-RVSPLBMKSA-N 460.304 0.424 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839449672 XWEBKGOLNQAKKJ-PXNSSMCTSA-N 470.910 0.331 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](Br)Cc3ccccc3)CCO2)C1 1839802245 POBIRWQULYJCNN-ZWDAVXSWSA-N 496.402 0.974 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1839964378 PWUHYMVKQBCBKU-DNVCBOLYSA-N 466.336 0.973 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCO4)C2)C1 1840033587 KHEWEAVIYAVCLK-ACJLOTCBSA-N 457.325 0.519 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1 1840035583 WMOGTQMGTGDWHL-KNBMTAEXSA-N 455.349 0.830 50 20 JCGD Cc1cc(C)c(OCC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1 1840182290 DZRJEEWETKJBLG-RUZDIDTESA-N 490.601 0.820 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CCCO4)CCO2)C1 1840660114 FYVDMQZXNLMWGQ-VWLOTQADSA-N 495.536 0.394 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015639 RXXOSXKAFRBQMV-KRWDZBQOSA-N 477.392 0.440 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccc3ncnn3c1)C2)NC(=O)NCc1ccccc1 1845039059 YQELUHGRMUODLP-UHFFFAOYSA-N 476.541 0.893 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)[C@H]1COc2ccccc2O1 21191499 XEKPHOAJABWCHN-MAUKXSAKSA-N 495.941 0.861 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)c1OC 27339754 VZLJQQXZAQNFDG-UHFFFAOYSA-N 494.482 0.708 50 20 JCGD CC(C)(C)OC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 725898326 UQMLKLDSVXWGOH-ZDUSSCGKSA-N 469.969 0.978 50 20 JCGD COCCCNC(=S)N(C)NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1N1CCOCC1 726076920 JDWVEHXUFUMQMN-UHFFFAOYSA-N 473.621 0.261 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cc1OC 726710884 WXELJBDRDGWXLD-UHFFFAOYSA-N 471.518 0.567 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNc2nc(-c3cccnc3)no2)c1 728076163 GFWVMUIMYGGLPT-UHFFFAOYSA-N 473.515 0.975 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(CCNS(C)(=O)=O)cc2)n1 753859868 XPDPRJZZPIFSHF-UHFFFAOYSA-N 454.530 0.090 50 20 JCGD O=C(COC(=O)CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1cccs1 765944448 YMHZWICUZBKKLD-UHFFFAOYSA-N 483.524 0.582 50 20 JCGD Cc1ccc(SCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1 906497197 RMJIUGLTNGSQGT-UHFFFAOYSA-N 462.553 0.669 50 20 JCGD O=C(CN1C(=O)[C@@H]2CCCC[C@H]2C1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 912643209 IWWWYPUCDWPOQL-QZTJIDSGSA-N 476.555 0.797 50 20 JCGD CN(C)S(=O)(=O)c1cccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 913445735 DMFLJFZADQIKHW-UHFFFAOYSA-N 485.613 0.819 50 20 JCGD CC(C)CN1CCC(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1 916250707 VFGGKNNJXPMKSD-UHFFFAOYSA-N 453.613 0.764 50 20 JCGD O=C(NCCc1cn2c(n1)CCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916578507 LYBRYZNPRAUYPK-UHFFFAOYSA-N 476.559 0.427 50 20 JCGD CCOC(=O)N[C@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)CC(C)C 916631130 KYJWVHRIRVZHFP-INIZCTEOSA-N 485.611 0.805 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN(C)C(=O)[C@@H](C)n2cccn2)c1 917495869 CMGQBUVUNJYWSE-OAHLLOKOSA-N 464.548 0.394 50 20 JCGD O=C(CN1CCN(S(=O)(=O)c2c[nH]c3ncccc23)CC1)NNC(=O)c1ccc(F)cc1 918740594 RBCPIEUIVSGVAU-UHFFFAOYSA-N 460.491 0.470 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)N(C)c2ccccc21 919889719 RXSSOVPZCABOLG-CYBMUJFWSA-N 460.516 0.175 50 20 JCGD Cn1cc(C=NNC(=O)C(=O)NN=Cc2cn(C)nc2-c2cccnc2)c(-c2cccnc2)n1 920357924 KBNBIHYVMOJMHI-UHFFFAOYSA-N 456.470 0.878 50 20 JCGD O=C(CN1C(=O)[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 920426216 JVYCTHSQYZOVMQ-BLKABHOGSA-N 497.515 0.957 50 20 JCGD CC[C@H](NC(N)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1777982335 WUHGYGBRIXJGAY-ACEPNWDCSA-N 475.550 0.081 50 20 JCGD Cn1cc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)ccc2n1 1779037165 RSRBAKPWIBBYTM-HSZRJFAPSA-N 463.498 0.329 50 20 JCGD O=C1Nc2ccccc2Cn2nc(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc21 1779985511 MHOBWLJVBYFBFP-XMSQKQJNSA-N 473.917 0.540 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(=O)n1C)CCO2 1780095860 YNHOYLJWDZRSJQ-QHCPKHFHSA-N 484.465 0.976 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780095890 YZIVPJBEQOHDLD-NRFANRHFSA-N 495.510 0.870 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)C2)C1 1783787730 XTQHMQLWMDXFLK-PZPWOCDFSA-N 491.969 0.527 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CS(=O)(=O)c3ccc(C)cc3)CCO2)C1 1783876870 SKILSDQAXRWKBJ-PXNSSMCTSA-N 458.964 0.852 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCC3(CC1)OCCO3)CCO2 1783937264 QWCSUAGYKPPKBQ-OAQYLSRUSA-N 452.552 0.123 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784094779 RMORPLJPIUFDAR-WHDKQWSOSA-N 471.982 0.965 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cnn(C)c3)C2)C1 1784575571 GWDIETWSTYTEPX-JOCHJYFZSA-N 471.470 0.940 50 20 JCGD CC(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785078905 DMOSVYNGOLQNJA-SRQBIAJPSA-N 474.986 0.623 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)on1 1785090892 QNJWJQUEEXBELU-BVSLBCMMSA-N 498.584 0.851 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1785607527 OIMLVLKXRWLEGD-LRAJWGHMSA-N 474.986 0.993 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)[S@](=O)c1ccccc1 1786985253 WIVVNPPBPGJHGA-ABTNWWTDSA-N 484.383 0.156 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)[C@@H]3SC(=N)NC3=O)[C@H]2C1 1787498176 NAKUQJDSRVRUHU-OKGQBYDBSA-N 461.382 0.552 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncn3)[C@H]2C1)NC(=O)NCc1ccccc1 1787568273 YMOSJZGEVAKKLD-ZJOUEHCJSA-N 481.557 0.416 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789922295 HYNPWTXIKZIYNJ-RMEBNNNOSA-N 495.390 0.899 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCN(C(=O)OC(C)(C)C)C3)C[C@@H]21 1791291096 YUWIWQLWMZZVEG-VJANTYMQSA-N 495.621 0.596 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)c2c1 1793967536 AHKHFIRTKNHWSX-NHKMSHSESA-N 461.327 0.602 50 20 JCGD CC(C)(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c[nH]1 1794306083 USXPDPCYNHPOSS-CCWDJLKJSA-N 454.531 0.828 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(C(F)(F)F)c1)C2)c1cccc(B(O)O)c1 1795741438 YMJBRRBWTPOPFE-UPHUGPLXSA-N 476.260 0.831 50 20 JCGD O=C(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)Nc1ccc(F)cc1 1796191649 KTZXTVXWENFKDT-ACDBMABISA-N 453.279 0.786 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS(=O)(=O)N1CCCC1 1796440694 KGQNTJXENFGJGD-HLPPOEQASA-N 466.398 0.175 50 20 JCGD C[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)[S@@](=O)c1ccccc1 1797754032 PLJNYHFWGUEQFU-ZCRWQLMLSA-N 485.566 0.085 50 20 JCGD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)N1CSCSC1 1798523453 BAOJINCICPBXTP-APIJFGDWSA-N 464.617 0.980 50 20 JCGD C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3cccnn13)C2 1799276828 MFXQILKMPZWJMP-JZGBQWHFSA-N 454.314 0.529 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCOCC1)C2)NC(=O)NCc1ccccc1 1799864816 PHDXBIYPPORIKQ-WKCHPHFGSA-N 472.590 0.303 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1800180447 GEZWXEWRHWTYRD-FZKCQIBNSA-N 490.561 0.213 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1800714859 DNUFOTMZRROJHU-WHDKQWSOSA-N 471.982 0.823 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(S(C)(=O)=O)ccc1F)C2 1802338617 UCSYARFHXOOYJM-QDMKHBRRSA-N 468.551 0.854 50 20 JCGD O=C(CN1CC(=O)NC1=O)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1 1804190231 JYBNHFMARJHYKF-CQDKDKBSSA-N 456.272 0.330 50 20 JCGD N[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccn1 1807163886 RJWVBYXHEKGRTH-YUXAGFNASA-N 459.315 0.176 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371299 SAIBWVYQGQPLCU-RXVVDRJESA-N 470.298 0.438 50 20 JCGD COCCn1nccc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1808638599 UZCWYMCCNBMTHX-UWJYYQICSA-N 492.540 0.556 50 20 JCGD Cn1cc(F)cc1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1808866838 WDJKQIAJUSOUKX-UWJYYQICSA-N 450.279 0.872 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810294054 HYIFYGWPPDXFJH-AVRDEDQJSA-N 476.541 0.913 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)no2)[C@H]1c1cccnc1 1810303537 UVPCBZONGNSBOO-ACJLOTCBSA-N 451.443 0.407 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@H]1c1cccnc1 1810305038 IQBLGQNCHPNAOD-IERDGZPVSA-N 485.508 0.985 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1810490317 STHKZEXKHZDPAB-WMZHIEFXSA-N 497.600 0.761 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1 1811315595 MMKLTNLDDAJPKI-UZLBHIALSA-N 468.514 0.898 50 20 JCGD COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nc1 1815340243 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N=C1NCCN1CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829051956 GBPDMHWGAOWYOF-XMSQKQJNSA-N 494.955 0.813 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=N/N3CCCCC3)C2)C1 1830539240 FNFCRLHGUNKWMV-CNZVFRIRSA-N 459.385 0.946 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1830998873 QMSQJSPVROVMKH-QNFHRHJVSA-N 489.997 0.736 50 20 JCGD Cc1nn2cc(CC(=O)N3CCO[C@@]4(COCCN(C(=O)CO[Si](C)(C)C)C4)C3)nc2s1 1832109958 VYFRADKMYFRSHJ-FQEVSTJZSA-N 481.651 0.950 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCOC3)C2)C1 1832551174 GSMJOSZVORTZPZ-CKJXQJPGSA-N 475.970 0.611 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@](C)(Cl)CCl)C3)C2)c(=O)[nH]c1C 1833389595 AUYNJOIQXDECML-MOPGFXCFSA-N 461.346 0.693 50 20 JCGD O=C(CCC(F)(F)F)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834593371 MOCKHIYGBCYXOZ-UHFFFAOYSA-N 455.286 0.894 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799108 OFMGLEUTZQKOER-LJQANCHMSA-N 480.212 0.725 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc4ccccn34)CC2)CC1)c1cccc(B(O)O)c1 1834799915 DODSAZJDYISLGV-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD Cc1ccc2nc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)ccc2c1 1835928350 LWWATTVLXJIIPH-SANMLTNESA-N 489.337 0.607 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CCCC3)C2)C1 1835934402 YPHBVCFYBGYJFC-AREMUKBSSA-N 492.381 0.948 50 20 JCGD CC#CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835938133 NAKBCCHEECNVKW-IGKIAQTJSA-N 490.365 0.634 50 20 JCGD Cc1cccc(Cl)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939714 YIAFLHDDKMDIIB-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836716829 SJZQGJVANWYYOG-QZTJIDSGSA-N 491.029 0.827 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836724651 HYGZJFOUTCDGHQ-OAQYLSRUSA-N 472.590 0.782 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3scnc3c1)CCO2 1837066370 NKKUWOHWTONMAN-JOCHJYFZSA-N 475.571 0.739 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3CC(=O)NC3=O)CC2)CC1 1837077706 OIGHUHPSOWDGFE-LBPRGKRZSA-N 459.341 0.320 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(Cl)n3)C2)C1 1837456930 PXXFIWOSBLGRNW-QFIPXVFZSA-N 488.932 0.046 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4nscc34)C2)C1 1837460018 QQYZTJGQORTXQW-QHCPKHFHSA-N 496.549 0.679 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1837710022 CNKWNWJCXANAOI-SFHVURJKSA-N 455.544 0.099 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3C[C@@H]3F)C2)C1 1838528128 GSLYMDNUQNLOPJ-HZUJVAHNSA-N 465.434 0.948 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnc4cc(C)nn4c3C)C2)C1 1839144967 PMCFWSVLELIKOK-YWZLYKJASA-N 450.927 0.829 50 20 JCGD O=C(/C=C/C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)NCc1ccco1 1839200317 IPKLCPRNDUEXPQ-JFZXIXNHSA-N 488.310 0.599 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)C(=O)CC3)CCO2 1839530531 UUCMWXWOKCPZJT-XMMPIXPASA-N 472.542 0.259 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2)C1 1840149485 QVKYAAHZZNAXLC-BXTJHSDWSA-N 463.959 0.610 50 20 JCGD CC(C)c1nc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)co1 1840183500 HZRIPBDEVCLOMJ-NRFANRHFSA-N 451.524 0.241 50 20 JCGD CCOc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840185523 SRYKTLIKSBGWJI-QHCPKHFHSA-N 462.547 0.528 50 20 JCGD Cc1ccc(NCCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c(C)c1 1840185805 TUALKIOXURFLMU-RUZDIDTESA-N 489.617 0.935 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840189381 OHNBJFNKWBRRBA-ORAYPTAESA-N 484.377 0.522 50 20 JCGD CC#C[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccc(O)cc1 1840220482 QQHPBDBWXLOXFP-QMHWCDLVSA-N 464.946 0.945 50 20 JCGD COc1cc(CC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc(OC)c1OC 1843010649 OOCCNFNPTDDERK-UHFFFAOYSA-N 468.315 0.452 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012385 KMVAJMMYBLMJFV-KRWDZBQOSA-N 471.363 0.831 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@H](C(=O)N1CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C1)C2 1843012715 HTFNNXSWBHTLLV-UFYCRDLUSA-N 483.374 0.971 50 20 JCGD CC[C@@H](CC(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)NC(=O)OC(C)(C)C 1843014748 XPTSPJBYVRWKIF-SFHVURJKSA-N 459.352 0.877 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cc(=O)cco1)C2)NC(=O)NCc1ccccc1 1845038536 QELLQBWLGBBLGR-UHFFFAOYSA-N 453.499 0.803 50 20 JCGD C[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 16594058 SWGGMUXBMWOPDR-LBPRGKRZSA-N 488.975 0.718 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(C)c(C)c2)cc1 17405998 GKGJJDPLQOFIKX-UHFFFAOYSA-N 496.611 0.748 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)[C@@H]1CCCN(S(=O)(=O)c2c(C)n[nH]c2C)C1 728205636 UXYYYDQRBDTJJX-OAHLLOKOSA-N 464.548 0.695 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3nc(-c4ccccc4)ccc3=O)cc2)CC1 728216395 ZEEYVYAELRNPPK-UHFFFAOYSA-N 482.566 0.990 50 20 JCGD Cc1ccccc1[C@H](CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)NC(N)=O 728323639 OZOKERSOKGBGJY-YJBOKZPZSA-N 456.455 0.625 50 20 JCGD CC(=O)N1CCN(CCOc2ccc(CCNC(=O)NNC(=O)Cc3cccnc3)cc2)CC1 729052494 KWYMKUPWGXJPFM-UHFFFAOYSA-N 468.558 0.740 50 20 JCGD O=C(CC[C@H]1NC(=O)N(c2ccc(Cl)cc2)C1=O)NNC(=O)c1ccc(-n2cnnn2)cc1 730769252 RHGOHMXSBTUPCM-MRXNPFEDSA-N 468.861 0.982 50 20 JCGD CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1 732307172 AWBPBZAFRBJWBV-CZUORRHYSA-N 493.629 0.067 50 20 JCGD Cc1cccc(-n2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)nn2)c1 751043755 OAZNIIYHFRXLQP-UHFFFAOYSA-N 470.511 0.671 50 20 JCGD O=C(NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)c1csc(N2CCOCC2)n1 892845712 FSSOUZWDRXFHKV-ZBFHGGJFSA-N 479.559 0.723 50 20 JCGD N#C/C(=C/c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)OCC(=O)N1CCNC(=O)C1 914005615 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CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784095473 IQTVHTVEJTXGNB-QXKUPLGCSA-N 480.027 0.822 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)c1 1785280566 YKLHJUVOUQWJDT-DEOSSOPVSA-N 481.509 0.537 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncon3)[C@H]2C1 1789087703 JUYUEWMBHVKEFO-NUTKFTJISA-N 459.415 0.810 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc[n+]([O-])c3)C[C@@H]21)NC(=O)NCc1ccccc1 1789725125 YQTWOSWHNHMOLN-FKBYEOEOSA-N 496.568 0.260 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)c3nccnc3C(N)=O)cc2)CCC1 1789948512 VJKROIVCYGFMJY-UHFFFAOYSA-N 474.481 0.636 50 20 JCGD COC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1 1789982838 PNWAZQDXCYJAEJ-WDSOQIARSA-N 475.546 0.831 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)[S@](=O)c1ccccc1 1790595424 KDCZLGGXZIWIQH-ABTNWWTDSA-N 484.383 0.156 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCN(C)C(=O)OC(C)(C)C)C[C@@H]21 1791292483 UIVULQLMSPNEDS-FHWLQOOXSA-N 497.637 0.986 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC[C@H]3CCOC3)[C@H]2C1 1791814178 ZDXHYYSXQACISP-HQBWOOTPSA-N 459.547 0.917 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(-c4ncc[nH]4)cc3)[C@H]2C1 1792034008 CMKLAFNPVQEBOD-YYWHXJBOSA-N 489.536 0.982 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC(=O)N(Cc2cccs2)C1)c1cccc(B(O)O)c1 1794242551 UHGPFUDYFPMQMT-FFGOWVMKSA-N 481.383 0.728 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCCNC(=O)C2)n1 1794506806 PVWWGLPOGLQBCT-BKEDOTJMSA-N 494.390 0.395 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)ccc(Cl)c1O)C2)c1ccc(B(O)O)cc1 1795736253 RUGYITAWXCMUSB-IVWMJMPLSA-N 479.125 0.896 50 20 JCGD Cc1cc(NC(=O)CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)CBr)C3)no1 1796417720 FSBFCAAJKDGNMX-AKENFEQQSA-N 457.325 0.932 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOc1ccc(F)cc1)C2 1797748676 ROTOVOGUXWANOJ-USGNIVHTSA-N 471.489 0.497 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1797972313 WAAJLLHGEFCLJK-YNWZIUHOSA-N 476.480 0.612 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc(C(F)(F)F)c1 1798902630 CQUWZTHTSFDGTE-HGKCTWBKSA-N 462.233 0.902 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)NC(=O)OC(C)(C)C 1799684753 OLOMDRSVFCPVNW-OKWIKPQFSA-N 464.357 0.593 50 20 JCGD Cc1ccc(COCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1C 1801011441 NJKKFPUSXMNZSH-IRJINJETSA-N 460.575 0.783 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@](C)(O)CN1C(=O)OC(C)(C)C 1802056978 KLRFWIFYMBUWQR-JCHKBEJOSA-N 495.621 0.758 50 20 JCGD C=CCNC(=O)/C=C\C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1802480280 BVEBOZMIEUOVHH-CHBUMTKESA-N 477.525 0.258 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1803162141 ZUMUAVSJRXDINQ-KSEOMHKRSA-N 450.348 0.565 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1 1804817929 YVUPBHVUCOJWBW-HRAATJIYSA-N 467.530 0.268 50 20 JCGD Cc1cc(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1C 1807360198 OYQDTYGKYZBCQS-CVDCTZTESA-N 461.331 0.366 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361134 HKZAUPBCIQRQGA-UTKZUKDTSA-N 470.298 0.666 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303199 QRHFDCDBCYNLLX-HZUJVAHNSA-N 489.540 0.690 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(C(=O)CNC(=N)N)[C@@H]1c1cccnc1 1811362126 WYOJQXSWAHFKMQ-MGPUTAFESA-N 483.485 0.718 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C[C@@](C)(O)CC(=O)O)[C@H]1c1cccnc1 1813073600 KTBRZBWAORFCBI-WQTXXOFMSA-N 463.535 0.076 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1 1814870353 PSTSFQMZCYJCLO-IHRRRGAJSA-N 459.931 0.887 50 20 JCGD Cc1noc(CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)n1 1815562776 RJHCSQDXBRZOTP-JTQLQIEISA-N 456.488 0.302 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3Cc4ccccc4CN3)sc2C1)c1cccc(B(O)O)c1 1817030490 LANMELVEYZPMEP-ICSRJNTNSA-N 476.367 0.763 50 20 JCGD Cc1nnc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)s1 1819797224 RCEIBHDQOVHGHU-SNVBAGLBSA-N 472.556 0.770 50 20 JCGD CC[C@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1 1822092321 YHZAMLLBRBUTQD-DZGCQCFKSA-N 460.373 0.862 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cnnn1)CC2)NC(=O)NCc1ccccc1 1822518227 HCGFZQSMPANUQK-OAHLLOKOSA-N 498.573 0.088 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](Cl)COC)sc2C1 1825994082 HKGLZLHWNCUPRG-VWYCJHECSA-N 452.986 0.637 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525478 RYJFNHBICGEVEN-JLTOFOAXSA-N 484.347 0.533 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923746 ABGSYZZINVXRFC-PMACEKPBSA-N 474.562 0.070 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(CO)on2)CC1 1829814231 CDORDMMSLXVCNL-LJQANCHMSA-N 456.503 0.713 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)c1ccc(OC)cc1)CCO2 1830220213 HUPQZFXUDSJXFX-BBTUJRGHSA-N 456.923 0.439 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1830358644 QBQUVQKWQIRNIZ-HXUWFJFHSA-N 473.979 0.820 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830720021 QSSWBCMLNZUCDS-NQIIRXRSSA-N 453.898 0.837 50 20 JCGD CCc1nn(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1Br 1830723452 NUKMRRCJXKGHBQ-UGSOOPFHSA-N 493.786 0.415 50 20 JCGD CC(C)[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1830862482 ZHSXEMUPLHFDDL-QYWGDWMGSA-N 477.986 0.592 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2ccncc2=O)CC1 1831105375 DYLFRUALTVUDLA-AYQSFACRSA-N 481.557 0.997 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)nn1C 1834114302 NWEXFIDFFFNGTJ-JTSKRJEESA-N 499.996 0.931 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n[nH]1 1834923332 JAOJQOXHBFNRNB-UHFFFAOYSA-N 468.562 0.470 50 20 JCGD CNCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835660440 ZOSQJNXASXENPQ-KKSFZXQISA-N 477.002 0.575 50 20 JCGD C[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1ccccc1=O 1835827865 MEXXEQPPHWTKRJ-KRWDZBQOSA-N 495.584 0.293 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835851067 NDXQDDOECODFMF-SFHVURJKSA-N 473.622 0.827 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)ccc1C 1835931909 GNYGPNMXBYQSNY-RUZDIDTESA-N 495.341 0.017 50 20 JCGD C[C@H](Br)C(=O)N1CCC(N2CCC(NC(=O)c3nccnc3C(N)=O)CC2)CC1 1836051498 LPHNDHCPSKUSST-LBPRGKRZSA-N 467.368 0.544 50 20 JCGD COc1cc(C(=O)NC2CCN(C3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CC3)CC2)nn1C 1836202506 KXYYYRVKXXJERK-JVWAILMASA-N 498.588 0.748 50 20 JCGD C=CC[C@H](C(=C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837308867 CINPCXUUQGATQP-UZUQRXQVSA-N 457.531 0.524 50 20 JCGD CN(C)c1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459581 KYBZRKYDAKGWTM-DEOSSOPVSA-N 482.541 0.135 50 20 JCGD O=C(/C=C/c1cnc[nH]1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922144 QRXISVUIXFJWFT-SNAWJCMRSA-N 452.320 0.415 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)n1cccn1 1837922151 RHWVKERRAMVOBH-KRWDZBQOSA-N 454.336 0.436 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1cncn1 1838395543 ZOVRXBOEKLPVEH-OAHLLOKOSA-N 470.534 0.150 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1 1838430080 RGEOWBZKIUEVEC-UGSOOPFHSA-N 452.309 0.583 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H]3CCN(C(=O)OC(C)(C)C)C3)CCO2)C1 1838505448 FUNFVERMHGZZIB-GSHUGGBRSA-N 489.997 0.954 50 20 JCGD O=C(c1cccc(-c2cnccn2)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838589629 XLAOTMONTMPSJV-DENIHFKCSA-N 460.918 0.813 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1839150855 ZNDBDYCZWCURPY-WOJBJXKFSA-N 475.373 0.827 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)c(F)c1)CCO2 1839272466 PDMRHIHVBLLSOM-NRFANRHFSA-N 470.929 0.922 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3occc3c1O)CCO2 1839564292 CUYKUHRFVUVWMD-DEOSSOPVSA-N 480.282 0.202 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1840031207 ISLLMEQFYYXILX-MLGOLLRUSA-N 460.285 0.031 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1 1840033931 VCYDPTYNOYDUIL-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840038706 QCDXZWQSURJIAS-JLHGSKIFSA-N 489.997 0.690 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)C2)C1 1840155547 AFTPNHWDASVBKV-QRWLVFNGSA-N 471.894 0.927 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3NC(C)=O)C2)C1 1840156196 KGLDNWGFDMRZQG-UWJYYQICSA-N 453.923 0.969 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3occc3Br)C2)C1 1840183967 KWHKFFKCHFKFMW-LJQANCHMSA-N 487.351 0.485 50 20 JCGD CNc1nsnc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841052237 FNAASKBWPGUDRY-UHFFFAOYSA-N 472.575 0.743 50 20 JCGD CNC(=S)NCCC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844267358 PUFYKUGKEBGIBV-UHFFFAOYSA-N 475.619 0.020 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)COc2ccc(O)nn2)C1 1845772655 QBSGMDYCTVZFDY-UHFFFAOYSA-N 471.426 0.912 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)cc1OC 12695765 XWBLVJIGJGFTQA-UHFFFAOYSA-N 472.502 0.473 50 20 JCGD Cn1c(=O)c2c(ncn2CCC(=O)NNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n(C)c1=O 21286963 RCUDMNLUXSPVBK-UHFFFAOYSA-N 455.353 0.894 50 20 JCGD CC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)=NN1c1ccccc1 110081685 JPEPMOICEWPOTA-IBGZPJMESA-N 457.512 0.922 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCSC)N(S(C)(=O)=O)CC2 726279623 VOSJRYWIDKFEDL-CQSZACIVSA-N 460.578 0.646 50 20 JCGD O=C(CCc1nc(-c2ncccn2)no1)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 727704069 BJTOJPHFVRXDMV-UHFFFAOYSA-N 471.499 0.705 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)C1CCN(c2ncccn2)CC1 729050394 UMDRQBNSPCEQQD-UHFFFAOYSA-N 481.561 0.157 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)c1 729839081 AADPPDRUYVEXRA-UHFFFAOYSA-N 473.479 0.884 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1 751208590 GFWMLIRUTMTUMP-UHFFFAOYSA-N 469.545 0.331 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3c(c2)C[C@@H](C)N3S(C)(=O)=O)n1 762194984 LDLDNUISDZEZMY-GFCCVEGCSA-N 466.541 0.709 50 20 JCGD O=C(COC(=O)c1ccc2c(=O)n3c(nc2c1)CCC3)NNC(=O)[C@H]1COc2ccccc2O1 849174186 LVQUJUKNXNREQI-GOSISDBHSA-N 464.434 0.487 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1 912918686 BMVZVZVQCYIQPR-GASCZTMLSA-N 454.549 0.204 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1nnc(O)c2ccccc12 913580619 ATDRBHRWPWAGSX-UHFFFAOYSA-N 473.467 0.236 50 20 JCGD COc1cc(C(=O)NNC(=O)CCc2c(C)nc3c(C(N)=O)cnn3c2C)cc(OC)c1OC 916725421 GRTWFONIIYSJPV-UHFFFAOYSA-N 470.486 0.865 50 20 JCGD CCCCNC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 920823191 UVODQBMQRXYYAH-CQSZACIVSA-N 468.985 0.552 50 20 JCGD COc1ccc(C(=O)NNC(=O)NCCc2cccs2)cc1S(=O)(=O)N1CCOCC1 920860638 WWFVISSGRQAGRU-UHFFFAOYSA-N 468.557 0.964 50 20 JCGD Cn1ncc2c(O)nc(CCC(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)nc21 935846125 YOJWZAHLRNFKNZ-UHFFFAOYSA-N 473.515 0.247 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2Cc3ccccc3O2)C1 1778840176 CUMOHBJEJLTPQC-DCLXLUIPSA-N 458.559 0.877 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1c[nH]c2cnccc12 1779175359 RSDUQEWMXYOTSO-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD O=C(c1ncn2c1CNS(=O)(=O)c1ccccc1-2)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Cl)CCO2 1779947089 GJCGTNJVOSYTGH-FXAWDEMLSA-N 497.936 0.642 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3cc4cc[nH]c4cc3F)C2)C1 1780160334 NBJTWLGOFNQLLN-HSZRJFAPSA-N 451.263 0.744 50 20 JCGD Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c(O)n1 1780273585 XPRFECLDWXINEY-RUZDIDTESA-N 496.568 0.885 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781331144 LODFJBAKSTVICH-JAYKYRCESA-N 458.288 0.641 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1781352678 FAEBIQYXUJNYLM-KKSFZXQISA-N 473.643 0.944 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1781853432 DXWMJNHGQGGHRS-CXAGYDPISA-N 450.330 0.444 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)N1CCN(C)CC1)C2 1782003348 JZSUBLBPHFCAHC-TVKQPGBESA-N 459.429 0.920 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1 1782351822 DJFILZNMOQRKBE-JEWPKMHUSA-N 478.513 0.615 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCNC(=O)C3)C2)C1 1784037329 DOJLTBJYZBPDRK-IVZQSRNASA-N 474.470 0.490 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1785576120 HEUWUPQPYUICDL-HXOBKFHXSA-N 479.578 0.106 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)CCC(N)=O)[C@H]2C1 1786804186 ZZFGIACSDQHFAC-KNTDACPZSA-N 475.496 0.444 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1N(C)C 1786984773 ICPWFVLSZGOQDP-LEDOBFOHSA-N 481.358 0.348 50 20 JCGD Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(C(F)(F)F)o1 1787483480 ZPSBOVVNXROOLQ-CQDKDKBSSA-N 496.446 0.907 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ncccn4n3)[C@H]2C1 1787937695 XYVPBNPNECJIOQ-XUXIUFHCSA-N 451.325 0.749 50 20 JCGD C[C@@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)[C@H]1SC(=N)NC1=O 1788634263 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463.498 0.672 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc2nc(CO)[nH]c2c1 1796872615 VVSOZUOPAVOHQC-OXUXUCFPSA-N 455.284 0.949 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(F)cc1Cl)C2 1797748561 ILRXXLKTDZXJRR-VTEUUUEMSA-N 475.908 0.924 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(C(F)(F)F)n1)C2 1797749853 ZDAFRIRQSNSYEN-DBWKPXFBSA-N 492.458 0.545 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2 1797785911 KVBRIZKESKJVHQ-URXAQBOPSA-N 463.325 0.102 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CS[C@H]1CCCCO1 1797791109 BRGIGOPLFJNNKW-NLCLCXLOSA-N 477.587 0.970 50 20 JCGD COc1cncc(CCC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)c1 1798440616 FNROVMLJFMPNAR-BJWYYQGGSA-N 452.515 0.973 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(=O)n1C)C2 1798522588 BAAIIUSFGMPGOX-USGNIVHTSA-N 484.465 0.736 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C(=O)OC)cc1[N+](=O)[O-] 1799823091 GYINITWDIGLCGV-YXPYIKCWSA-N 469.878 0.838 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1800856644 PQEUKMXVYNOSIT-MBWWPZBXSA-N 483.500 0.749 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]13C[C@H]1CCN3C(=O)OC(C)(C)C)C2 1801013101 VMAAQACICDNYBY-AGYLXNLDSA-N 493.605 0.349 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(-n3c(O)nnc3O)cc1)C2 1802336380 LOEFVNDWOHJGDW-ACHSLPGTSA-N 471.518 0.303 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803585331 QYPCIPRNNAZXRD-IDHHARJASA-N 488.570 0.080 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1804582870 WUKDQKGYGZZVIP-PGRDOPGGSA-N 476.541 0.913 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CN2CCOCC2)[C@@H]1c1cccnc1 1806907102 PVRFDNUPFMLVIE-JUAHTANYSA-N 481.557 0.554 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CN2CCCC2=O)[C@H]1c1cccnc1 1806923656 LPVLLHCORWEVNO-IIBYNOLFSA-N 465.514 0.022 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C1=O 1807360249 IXOXOXVJAKGRSN-HTAPYJJXSA-N 498.304 0.530 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807363116 OFWMUKBCRWAMTK-SIKLNZKXSA-N 477.330 0.238 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807363661 CFEDGJNHOXCPHO-AVRDEDQJSA-N 472.310 0.494 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCN2CCCC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374101 IKGATCKIJZUHNM-NFBKMPQASA-N 450.348 0.567 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374506 ZTMIYMKWIFCLGU-UAGQMJEPSA-N 464.100 0.772 50 20 JCGD CCc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1C 1807375861 QLXYKHLCGOPDOI-AVRDEDQJSA-N 461.331 0.691 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc2nc(CO)[nH]c2c1 1809113977 VCIILVPGEVJRIP-CYFREDJKSA-N 499.336 0.763 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cn2ncccc2n1 1809358373 YZJUYJBQDDAVNY-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD Cc1nc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)no1 1810295995 ZGNOTQFLSRSJRG-FOIQADDNSA-N 464.486 0.334 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc3c(c2)CNC3=O)[C@H]1c1cccnc1 1810301699 AGECJXZBANSXRE-JTSKRJEESA-N 499.531 0.957 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810306415 YTYIBGSHZIBMGQ-UZLBHIALSA-N 497.556 0.924 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@H]1c1cccnc1 1810309133 PNYQZCFXFSTUSF-ZHRRBRCNSA-N 475.509 0.743 50 20 JCGD NC(=O)c1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1 1813735562 FJPBYDSJKOXZEE-IRLDBZIGSA-N 472.310 0.494 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815820085 IIDVPQIMJWDTQR-QGZVFWFLSA-N 467.251 0.200 50 20 JCGD C[C@@](O)(C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)C(F)(F)F 1817469855 FLMZBJHTNPNPKI-RDTXWAMCSA-N 454.214 0.709 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817471093 RNWJHCQPQFTIOG-BEFAXECRSA-N 450.308 0.928 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)[C@@H]1SC(=N)NC1=O 1817471954 ZNIJYSRGTMZIGR-CXMBCZLWSA-N 484.347 0.198 50 20 JCGD COCCn1ccc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1 1818259493 NJEFKABKXZMGSA-IBGZPJMESA-N 466.307 0.552 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cn2ncccc2n1 1818711482 OFQPFFGJWKOGCM-GOSISDBHSA-N 459.275 0.752 50 20 JCGD CC(=O)O[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)C(C)C 1819480205 HGNKIHBMXVHCFH-QAPCUYQASA-N 459.333 0.636 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3n(n1)CCCNC3=O)CC2 1826000137 MKJMIMPHYSYSGQ-WDEREUQCSA-N 466.951 0.953 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nn(C)c3c1CCC3)CC2 1826086037 LOQVILHIKUIUPQ-LBPRGKRZSA-N 459.576 0.964 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525289 OAEXALMSXSBFPP-HRAATJIYSA-N 498.374 0.923 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)COc2ccc(O)nn2)CC1 1828924701 YTPACBOFKXUPMU-GOSISDBHSA-N 483.529 0.493 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)no1 1828985817 AXIGIIXAYFALDE-OAQYLSRUSA-N 482.346 0.326 50 20 JCGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1 1830376024 ZPFYEMKWEHWNCO-OCCSQVGLSA-N 470.303 0.736 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C[C@H]2C[C@H]21 1830719597 GOKFUKDRCFAPKR-PXHXRNRRSA-N 487.981 0.440 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@H]3[C@H]4c5ccccc5S[C@H]43)C2)C1 1830731817 PWLOQMVYBJNGJG-YUZRNDJPSA-N 452.960 0.930 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1 1833006102 JYYQLJYPRFTVCN-UHFFFAOYSA-N 464.523 0.746 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccs3)CCO2)C1 1833033157 PTLBWVPRMVSBHM-UGSOOPFHSA-N 474.377 0.718 50 20 JCGD C=CCO[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833475187 JVHKLVSPQINMMJ-MRXNPFEDSA-N 458.563 0.461 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1833483982 BOLHBFCBYIUGTD-WFASDCNBSA-N 470.405 0.929 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1834793560 DETBWPLUMNGROQ-ZDUSSCGKSA-N 494.394 0.634 50 20 JCGD CCOc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798053 PCEZAQSHUWPTOG-UHFFFAOYSA-N 480.374 0.659 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834819240 LKLFVSBQVTYCCI-SFHVURJKSA-N 455.309 0.036 50 20 JCGD CC(=O)Nc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)ccn1 1835262365 PJYKSTGCAJXLBX-UHFFFAOYSA-N 493.373 0.219 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc2ccccn2n1 1835302797 BLYZMGCSDPXCKO-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cnc4[nH]ncc4c3)CC2)CC1 1835525186 ONUAYZRTOSAMMB-UHFFFAOYSA-N 491.556 0.455 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2c1 1835936967 MIAQRLUPEDLJIF-VWLOTQADSA-N 493.325 0.240 50 20 JCGD Cc1cc(F)c(F)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1835939003 BAGXZQCJCADYIH-QHCPKHFHSA-N 474.269 0.337 50 20 JCGD COc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1C 1835939602 BNKLTIKEFXBGAT-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CCc1nc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)co1 1835984441 ZXABAEQDZSLDGT-UHFFFAOYSA-N 454.336 0.416 50 20 JCGD CN(CC(=O)NC1CCN(C2CCN(C(=O)[C@@H]3C=CCN3)CC2)CC1)NC(=O)NCc1ccccc1 1836343925 QZDLGTIHHYCFGY-QHCPKHFHSA-N 497.644 0.432 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3cncn3c1)CCO2 1837121628 URHCDOVIQOKSQM-VNSNFZHPSA-N 493.524 0.538 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccnc(Cl)n3)CC2)CC1 1837919240 SWFWHZYKAWDIKO-UHFFFAOYSA-N 472.738 0.736 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc(Cl)nn3)CC2)CC1 1837921154 GNWVGDLUBUGVRZ-UHFFFAOYSA-N 472.738 0.736 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cccn3)C2)C1 1838528058 CCTYEYUVZBIGJG-JOCHJYFZSA-N 487.469 0.487 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3F)C2)C1 1838528131 GSLYMDNUQNLOPJ-XPIZARPCSA-N 465.434 0.948 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1C 1838942991 LNOPFAYKPWDWNP-DEOSSOPVSA-N 452.316 0.367 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1839043855 WUBHWYZMYFEYPA-OAQYLSRUSA-N 485.006 0.613 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1839149950 XDCMVOHLGKIVKG-ROUUACIJSA-N 454.420 0.728 50 20 JCGD O=C(c1ccc2c(n1)OCCO2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199801 VCANMYHQHSXDNR-KDOFPFPSSA-N 474.283 0.613 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)Br)C2)C1 1839667880 NBXDNJUEGWDFIH-SIFCLUCFSA-N 483.363 0.440 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1840034476 NENBBFBPGSDQIG-QCBUCWTNSA-N 472.380 0.627 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840082746 MYHCBOHERZXVRC-VYXDICFBSA-N 487.981 0.442 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2)C1 1840152580 MRKDXRHYBXSWGR-GCKMJXCFSA-N 493.985 0.236 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)c4ccccc4o3)C2)C1 1840183316 XVOFIVXECOJBQY-DEOSSOPVSA-N 486.525 0.236 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)CCO2)C1 1840915531 MOCUOXUYJHIQTC-LRAJWGHMSA-N 490.985 0.229 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)C(=O)c1ccccc1 1841522735 PAEDYBUUZCHTEJ-UHFFFAOYSA-N 450.499 0.274 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC3(CCCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)CC1 1841924870 KLMDYNDJKRWJLA-KRWDZBQOSA-N 486.013 0.486 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCC(=O)N2C(=O)OC(C)(C)C)C1 1846485655 KPEHBASADWBWTA-HNNXBMFYSA-N 465.551 0.489 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)CN(C)NC(=O)NCc2ccccc2)nn1C 1847669143 IUUCIKPKCVPZMC-SFTDATJTSA-N 467.574 0.819 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)Cn2nnc(-c3ccc(C)cc3)n2)cc1OC 105099067 VGAZFQPYXYQRQS-UHFFFAOYSA-N 454.443 0.670 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cn(-c3ccc(C(F)(F)F)cn3)nn2)n1 728730252 JQSXLZJJLIIRQJ-UHFFFAOYSA-N 469.405 0.993 50 20 JCGD NS(=O)(=O)c1cnn(CC(=O)NNC(=O)c2nc(-c3ccccc3)n(-c3ccccc3)n2)c1 748531009 ZQAOZVRHMGIRBC-UHFFFAOYSA-N 466.483 0.239 50 20 JCGD O=C(NCCNC(=O)c1cccc(Br)c1)NNC(=O)c1ccc(-n2cnnn2)cc1 749917833 KSPGMWKLSSFIIC-UHFFFAOYSA-N 473.291 0.799 50 20 JCGD COc1cccc(/C=C(\C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)n2nnnc2C)c1 818160057 RPOMZQGPQNHMFD-LZYBPNLTSA-N 471.499 0.686 50 20 JCGD CN1C(=O)c2ccc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cc2C1=O 912638548 VONNCEDPDNRKRG-UHFFFAOYSA-N 472.479 0.008 50 20 JCGD CN(C)N(C(=O)CS(=O)(=O)Cc1ccc(Br)cc1)[C@@H]1CCS(=O)(=O)C1 915830051 UJUVAYCDYIKCKO-CQSZACIVSA-N 453.380 0.856 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCc3ccc4c(c3)OCCO4)nc2)CC1 915891733 UCSQJXQZJYAGKF-UHFFFAOYSA-N 476.559 0.658 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC1CCN(C)CC1)N(S(C)(=O)=O)CC2 915898577 DJEMTBXQCYDVND-KRWDZBQOSA-N 483.591 0.377 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=S)NCCCN2CCOCC2)c1 916115679 SNTHDIQKRWCZDL-UHFFFAOYSA-N 457.622 0.548 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3cc4ccccc4cc3O)cc2)CCN1 918781155 KQRMIHLYKDQSAH-UHFFFAOYSA-N 468.491 0.741 50 20 JCGD COc1ccc(C(=O)NNC(=O)CS(=O)(=O)N2CCN(c3cccc(C)c3)CC2)cc1OC 919806121 LOXPVOSMCINFJQ-UHFFFAOYSA-N 476.555 0.925 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2cccs2)cc1 920679002 DEOVAZDDVPKVKT-JCVNQNCUSA-N 470.507 0.856 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1 920681445 KGBYXUCQKJNDIE-YFPIXMDGSA-N 464.478 0.794 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)NCCc3cccs3)cc2S1(=O)=O 920859824 IRIBMRGTHDWIOM-UHFFFAOYSA-N 452.514 0.726 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnn3n1)C2 1778092509 DNURIAKITCWSEC-UQPPNZDLSA-N 492.540 0.991 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779032827 XEGIWFFZUVXARP-QHCPKHFHSA-N 469.498 0.460 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779375722 RWTYUWRNKQYTIV-DNVFCKCGSA-N 474.562 0.117 50 20 JCGD CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)n(C)n1 1779762937 SAVPLILHTSPBEK-NFBKMPQASA-N 454.336 0.104 50 20 JCGD CCc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)n(C)n1 1779762953 SHCUQKFJYOSVAQ-NFBKMPQASA-N 454.336 0.104 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CCN3CCOC3=O)CCO2)C1 1780097723 GMDMXNHFLZNQGC-QFIPXVFZSA-N 490.469 0.806 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1780156236 NCMPHTIOBHMGKB-DNVCBOLYSA-N 473.295 0.970 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)c(O)n1 1780969374 YVPKJROSGFQKRH-VWLOTQADSA-N 496.568 0.885 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc(O)c1)CCO2)NC(=O)NCc1ccccc1 1780969460 HFPACUKEKHYHCE-DEOSSOPVSA-N 498.540 0.283 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc[n+]([O-])c1)CCO2)NC(=O)NCc1ccccc1 1780970479 YUWGYVVYKPUGBY-DEOSSOPVSA-N 482.541 0.110 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)c12 1782375801 CQOSJPSTGCWHLM-DEOSSOPVSA-N 478.509 0.932 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1783342171 JHTOIVSDGYWDAI-SJKOYZFVSA-N 475.365 0.455 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783535608 AGMKWUWCYFPZNX-KKSFZXQISA-N 496.406 0.946 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H](F)CN1C(=O)OC(C)(C)C)CCO2 1783934492 HGPYGIKMVBMQBK-DGGJZMOXSA-N 499.584 0.537 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)cc2NC1=O 1784091015 GVTPVMHOJGJHEZ-FZZNLJMESA-N 451.907 0.599 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@H](O)CC3)C2)C1)NC(=O)NCc1ccccc1 1784130716 YDSRHBZTNHICAN-DNRQZRRGSA-N 487.601 0.714 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)c3ccccc3Cl)C2)C1 1784251422 HKNMLXSQCANAFI-GCJKJVERSA-N 473.917 0.516 50 20 JCGD CN1Cc2ccccc2C[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1785022573 CLJMNGGPTLLULJ-IITNATTFSA-N 492.580 0.335 50 20 JCGD O=C(CCc1cc(F)ccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1785236278 IZJHJPIAJGRKBN-NDXORKPFSA-N 455.295 0.127 50 20 JCGD Cc1c(F)ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1N 1786980018 ZBMVKSPMPUEYKW-QSFXBCCZSA-N 455.295 0.303 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)c4ccccc4o3)C[C@@H]21)c1cccc(B(O)O)c1 1786982813 IMWVSFDBJCUUMA-NVVBAYIOSA-N 476.294 0.380 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccc(Cl)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786982831 IQDMIZIHVADVDA-NDXORKPFSA-N 472.734 0.692 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc4c(F)cccc43)C[C@@H]21)c1cccc(B(O)O)c1 1786983460 PZGUJDFNTRJTJS-NYDSKATKSA-N 479.317 0.754 50 20 JCGD C[Si](C)(C)c1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)co1 1786984040 LGWRYMDUDMYPPU-VDGAXYAQSA-N 470.407 0.412 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccccc3F)C[C@@H]21)c1cccc(B(O)O)c1 1786985110 MWHOALMBVCIMRE-MDKPJZGXSA-N 456.279 0.178 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(C)noc3C)C[C@@H]21 1787506827 PHWSFWPRQBVSDZ-MSEPQIRJSA-N 470.530 0.948 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(C)(C)O)C[C@@H]21)NC(=O)NCc1ccccc1 1789726830 WCBNJRCCNWDLPZ-UFYCRDLUSA-N 475.590 0.473 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cccc([N+](=O)[O-])c3=O)[C@H]2C1 1790655420 OMTJFPRNHJWEOI-AYDFFVQHSA-N 485.335 0.910 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1CCc2ccccc2C1 1790993388 RJCIXPYVVYORMD-WMIMKTLMSA-N 462.355 0.765 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C[C@@H]21 1791290994 GORIEPHFGRMHCB-YDHLFZDLSA-N 459.469 1.000 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)C1 1792221129 FENQDSCMWLGTGN-UYLCUJDWSA-N 459.971 0.869 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1C(=O)C=CC1=O)NC(=O)NCc1ccccc1 1793851326 CTTJLYJWAHUDLW-ACDBMABISA-N 496.568 0.286 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(F)CCCCC1(F)F)C2)c1ccc(B(O)O)cc1 1795734139 FJPSWIDXUGGJHR-MQJTVSLUSA-N 454.254 0.487 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3nscc13)C2)c1ccc(B(O)O)cc1 1795736237 PPBWKWNHVGQQAG-YVWYUNDQSA-N 451.313 0.493 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CCCC2 1796164041 QGANQHVWGIFVDI-DHMDNZFNSA-N 467.530 0.626 50 20 JCGD CCc1nn(C)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1Br 1796189140 BNRCDDYUQGJYIO-MUJYYYPQSA-N 489.179 0.990 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796191619 FZRSZUOHNQBXBP-VJICWTENSA-N 467.306 0.576 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](C)[C@H]1SC(=N)NC1=O)C2 1796892054 DCQUZPLIYSGAAF-FQLXKURJSA-N 473.559 0.561 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2cc[nH]c2cc1F 1798568348 BZEGJWADCSFVCM-VPTLXERWSA-N 451.263 0.504 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(C)nc1O 1798653809 MDMIHWMHHAZQIM-OBAMXFLESA-N 454.487 0.433 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(-n2cccn2)cc1Cl 1799453292 VXAIFZGGMOIYGS-FAQVEIGNSA-N 494.744 0.723 50 20 JCGD CN1CCC(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1802568227 YOKDYRQHVXBUCI-RXVVDRJESA-N 465.558 0.742 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H](CNC(=O)C(O)O)[C@H]1c1cccnc1 1802913862 GSROUCVEJDVSHD-QLFBSQMISA-N 456.927 0.530 50 20 JCGD O=C(COc1ccc(O)cc1)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1 1805247109 PBGOKKVMZHPHLH-UHFFFAOYSA-N 452.316 0.996 50 20 JCGD COc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1807360917 MIPVJHNODXRGJX-GCJKJVERSA-N 460.299 0.798 50 20 JCGD COC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1 1808597994 XHDAHCXTLBQMLR-HTAPYJJXSA-N 482.541 0.956 50 20 JCGD O=C1Nc2c(C(=O)NC[C@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)cccc2C1=O 1810024726 DVXPRDQQEBFIJG-VGSWGCGISA-N 498.304 0.530 50 20 JCGD O=C(/C=N/N1CCCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1810283466 AVWAPXAFCYNYLN-XWOGAGCYSA-N 463.347 0.553 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1 1810294873 OZEOCMVKJBDWKA-WZONZLPQSA-N 493.568 0.802 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1ccnn1 1810305189 IZTSWISICZONCZ-OGWOLHLISA-N 463.502 0.252 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)NC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)c21 1811275368 ILKNDXUPDUPVJE-PGRDOPGGSA-N 499.336 0.987 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@H]1CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]1c1cccnc1)CCC2 1812225601 JUIOJLFDDADNCV-IIBYNOLFSA-N 488.552 0.936 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361767 RGOUBZUPDNUXHC-AEFFLSMTSA-N 456.377 0.922 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361769 RGXQSUIZJNTLSN-BBRMVZONSA-N 466.328 0.911 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ncn(C)n2)n[nH]1 1816319995 ZQJQNCNBHFERKK-ZWGXDWAISA-N 452.479 0.978 50 20 JCGD Cc1nccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)n1 1817740952 LLBJDAGZDCZGJZ-LLVKDONJSA-N 452.500 0.780 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@@H](N)c1cccnc1)CC2 1819795274 LONHSWLPFNPWEI-XJKSGUPXSA-N 480.554 0.853 50 20 JCGD Cn1nc2c(c1C(=O)Nc1cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n1)CCC2 1821530135 VUSWXEWKHGVMJP-LJQANCHMSA-N 462.319 0.931 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1 1823008080 QMDBCFHJSYETQU-PUQNFTFYSA-N 453.290 0.810 50 20 JCGD CCOC(=O)C1(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)CC1 1826089602 HKRSRJSCUNCUHT-GFCCVEGCSA-N 451.549 0.771 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826090200 ZWNHTGTYZIVIJA-NEPJUHHUSA-N 455.537 0.990 50 20 JCGD Cc1nn[nH]c1C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829031094 ZMZMMGOPPYTVOY-HTAPYJJXSA-N 490.948 0.779 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](NC(=O)OC)c1ccccc1)CCO2 1830416281 ZDHUAGBJNIQXKE-SVMVAKDDSA-N 483.949 0.794 50 20 JCGD O=C(c1csc(Br)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830727951 LKXJPMCNCWOASU-IAQYHMDHSA-N 468.757 0.575 50 20 JCGD O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731782 MOSODOKKOCVFFG-JXFKEZNVSA-N 469.878 0.199 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830738685 RPEOWLXVJHZOSU-LYZACZEUSA-N 487.981 0.512 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccoc3C1)CCO2 1830940734 VIWQOBRBXPZSLI-FDDCHVKYSA-N 462.547 0.214 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccoc3C1)CCO2 1830940738 VIWQOBRBXPZSLI-WZONZLPQSA-N 462.547 0.214 50 20 JCGD COC(=O)C1(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1831458950 NWRSWUSSKSJIHL-SFHVURJKSA-N 457.531 0.872 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)C2)C1 1831657618 PICCTVFWOFZQIC-DBXWQHBBSA-N 469.970 0.321 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832036671 UJUTWPRGTDVPQT-XOBRGWDASA-N 463.959 0.346 50 20 JCGD O=C(/C=C/c1ccc(F)cc1F)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832135997 KBLGWQBMALOOLW-COIATFDQSA-N 486.280 0.428 50 20 JCGD CC[C@H](C)[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1 1832549348 IPVLZRMHEVSKIY-FSTVOOFJSA-N 492.013 0.982 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc4snnc4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798268 AQYTXSXFUVBJAA-UHFFFAOYSA-N 494.386 0.265 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cc4ccccn4n3)CC2)CC1 1835303777 JVVFZJPIAZMEGH-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD O=C(COc1cccc(Cl)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926704 ZNXDUSRRFXVWQI-HSZRJFAPSA-N 488.733 0.169 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)c1 1836714893 AMNCDUDDQWCQAS-GOSISDBHSA-N 473.979 0.697 50 20 JCGD Cc1nn(C)cc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836967062 DYSYTPFKJDKUDO-UHFFFAOYSA-N 469.546 0.653 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)cc1)CCO2 1838977156 RHFDFDPLXFZPKR-QFIPXVFZSA-N 492.259 0.769 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)n1 1839153824 SUPMWIXQTWMYOU-RTWAWAEBSA-N 489.400 0.980 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@H]3COc4ccccc4O3)C2)C1 1839199330 UIDXMVQXCCFSFI-JTDSTZFVSA-N 473.295 0.973 50 20 JCGD O=C(CCc1cnc2[nH]ccc2c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840079755 UEGWESKANZNATQ-LAUBAEHRSA-N 450.923 0.552 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc([N+](=O)[O-])ccc3F)C2)C1 1840149890 ALGMNRRPDGRFSE-UZLBHIALSA-N 473.885 0.987 50 20 JCGD O=C(CC1Cc2ccccc2C1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1840931706 XSWKNBVIYLAKSF-SANMLTNESA-N 478.354 0.242 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C(=O)N3CC4(CCCN4C(=O)c4ccc(B(O)O)cc4)C3)C[C@@H]2C1 1843012416 NBSQZCIJPJCPIB-IQGLISFBSA-N 483.374 0.831 50 20 JCGD C[C@@H](C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1)n1ccnn1 1845039363 IJDMBIVBEDGOLB-KRWDZBQOSA-N 454.535 0.389 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CCCC13CN(C(=O)CCC(=O)NN(C)C)C3)C2 1845863500 CXQWHGNITYUXNH-INIZCTEOSA-N 474.562 0.199 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1846129324 KKYAYASVVANANQ-BVZFJXPGSA-N 483.374 0.831 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccc(Cl)cc1 10069657 FJDUJBUTZJRELJ-UHFFFAOYSA-N 497.913 0.784 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(Cl)cn1C)c(=O)n2Cc1ccccc1 18234372 UHGQBYPKNLTPFN-UHFFFAOYSA-N 483.916 0.881 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN1C(=O)N[C@](C)(c2ccc(F)cc2)C1=O 23750537 JQTYWERDRKRBQJ-OAQYLSRUSA-N 490.517 0.655 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1ccc([N+](=O)[O-])cc1 25166342 QVXJJTBWQVXYSW-UHFFFAOYSA-N 476.511 0.938 50 20 JCGD CC(=O)N1CCN(CCOc2ccc(CCNC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)cc2)CC1 728134064 HFLUNWNFPIJZJD-QFIPXVFZSA-N 481.619 0.153 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1cc(Br)ccc1Br 728509281 BFOFLJXYPNEFIG-LURJTMIESA-N 479.172 0.459 50 20 JCGD COC(=O)[C@@H]1CN(C(=O)/C(C#N)=C\c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CCO1 728539349 HOWDVFHDDDDKBW-QMDZLVRISA-N 467.482 0.741 50 20 JCGD CCOC(=O)[C@H]1CCCN(C(=O)CN(C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)C1 728961142 AHXZDYMDEHETJI-KRWDZBQOSA-N 475.550 0.167 50 20 JCGD C[C@@H]1CN(C[C@@H](C)C(=O)NN=Cc2c(N3CCOCC3)nc3ccccn3c2=O)C[C@@H](C)O1 874090906 IBVLEVXAVGWKNA-KZNAEPCWSA-N 456.547 0.727 50 20 JCGD CNC(=O)NNC(=O)CCCCCNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 919877955 REESUOJYNMPQDU-UHFFFAOYSA-N 475.593 0.270 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)NCCc3cccs3)CC2)cc1 920859905 URHLPOQZYIQHKB-UHFFFAOYSA-N 465.601 0.936 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCc3nc(N)n[nH]3)C2)C1 1778849348 FPZLITVMUIBNIO-OAQYLSRUSA-N 487.473 0.297 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374717 YZBRCPKFHZOKHJ-WTBBCNCBSA-N 477.518 0.374 50 20 JCGD CCOC(=O)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)ccn1 1780171662 GFCFMKQQLHJYFW-NTKDMRAZSA-N 489.573 0.759 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1)[C@H]1SC(=N)NC1=O 1780773115 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CVQDYDCOQMTFFH-UHFFFAOYSA-N 493.678 0.896 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cc3F)C2)C1 1835934077 MMAJYKGMGXGSRI-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD O=C(Cc1ccc2ccccc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935913 WWCOOZMMJZPQMI-MHZLTWQESA-N 488.349 0.832 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4ccccc34)C2)C1 1835937150 QJZRRRKOMPEQPB-VWLOTQADSA-N 475.310 0.298 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2s1 1835939611 VFNZOUKQPXDFKK-HSZRJFAPSA-N 483.355 0.601 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921120 BRKYJPHQPPODIT-GOSISDBHSA-N 480.374 0.874 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528323 RACHCBCLTMUAHA-RSDPBLMXSA-N 492.529 0.964 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(-n2nccn2)c1 1838629210 FTIGKOPESSRAGU-WIYYLYMNSA-N 463.922 0.245 50 20 JCGD C[C@H](NC=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839166162 HKAVQEJMSOMSEI-MDKPJZGXSA-N 482.375 0.584 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1 1839625554 ZYLXKKFQIVRQRL-XIKOKIGWSA-N 470.299 0.722 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC(=O)NC3)C2)C1 1839741996 JXXVRLLQDAYKIH-TUXSKGRZSA-N 488.491 0.854 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839767667 UVHJNTDPGCFNQU-UUOWRZLLSA-N 478.565 0.834 50 20 JCGD C[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1839931162 MROZSPAWLWHSPF-IQGLISFBSA-N 481.553 0.949 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1839962823 RPDIEJUGYFUTRJ-SCLBCKFNSA-N 458.309 0.329 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)COC(=O)C(F)(F)F)C2)C1 1840033468 GIPDLCDNDDNVPC-IINYFYTJSA-N 461.231 0.332 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(OCCCO)cc3)C2)C1 1840154222 PYXSHSPBKMIQEV-KNQAVFIVSA-N 470.950 0.772 50 20 JCGD O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1840187137 XQXFQJHMPAWJJE-GFCCVEGCSA-N 455.188 0.602 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)C2CCC2)C1 1842588805 IUOFLGLIIKSWGJ-FQEVSTJZSA-N 485.390 0.806 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)C1CC1 1843360322 XYFQZPDCFGZCSP-SFHVURJKSA-N 457.336 0.487 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1ccc2c(c1)OCO2 15663165 OXCUZVDDHVYZQO-UHFFFAOYSA-N 463.468 0.520 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)COc2ccc(N3CCCC3=O)cc2)c1 16594206 ARMCTBCPNBMJQT-UHFFFAOYSA-N 460.512 0.904 50 20 JCGD CCc1nc2ccccc2n1CC(=O)NNC(=O)Cn1c(=O)ccn(Cc2ccccc2)c1=O 26792887 KIFQPFYHNAKCQA-UHFFFAOYSA-N 460.494 0.818 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)C1(C)CCOCC1)N(S(C)(=O)=O)CC2 726797787 AUTLRCHFVOPGRQ-MRXNPFEDSA-N 469.560 0.917 50 20 JCGD C=CCNS(=O)(=O)c1cc(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)ccc1F 728844998 CECYTMVRXWYAPT-UHFFFAOYSA-N 462.507 0.758 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)c2)CCN1 742454134 UNWRBIBEFRFFIL-UHFFFAOYSA-N 499.471 0.970 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cnc3ccccc3n1)c(=O)n2Cc1ccccc1 751299010 DZMBHYCXQDNNRA-UHFFFAOYSA-N 498.503 0.832 50 20 JCGD Cc1cc(C)nc(-n2nc(C)c(CC(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)c2C)n1 914592346 UQILRYHRSCFBCQ-HXUWFJFHSA-N 494.508 0.969 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)o2)cc1 914748284 SEBQXJFFEDDYLJ-UHFFFAOYSA-N 484.556 0.454 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN(C)S(=O)(=O)c2ccccc2)cc1OC 915009109 XLJPBNBATMFGEB-UHFFFAOYSA-N 465.484 0.329 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NC2CCN(S(C)(=O)=O)CC2)c2ccccc2c1=O 916238116 WQAZOPQZBPHJDH-UHFFFAOYSA-N 464.548 0.565 50 20 JCGD COc1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1OC 918234043 XTZNZQRALUQDOZ-UHFFFAOYSA-N 478.527 0.869 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@H]1C(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1 919690568 PADCILWOLDBNLR-ZDUSSCGKSA-N 466.969 0.343 50 20 JCGD Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919885795 RGRHVQKTSDUJKG-MRXNPFEDSA-N 480.568 0.605 50 20 JCGD COc1ccc(C(=O)NNC(=O)CCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1OC 920340217 PUPYUOBUVUBZCW-UHFFFAOYSA-N 452.445 0.742 50 20 JCGD O=C(COC(=O)COc1ccc2c(c1)CCC(=O)N2)NNC(=O)[C@@H]1COc2ccccc2O1 928984964 WBDHFOMSEXVOPF-SFHVURJKSA-N 455.423 0.481 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3cncn3-c3ccccc3)CC2)cn1C 1322181223 ILTRVOWNHRFTHG-UHFFFAOYSA-N 471.543 0.776 50 20 JCGD CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 1339877818 VNKCMLNYDVJJII-UHFFFAOYSA-N 453.569 0.228 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])cc3c1OCC3)CCO2 1779032692 RTJBMHYUCNBVNR-HSZRJFAPSA-N 496.480 0.286 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3C1)CCO2 1779033604 AAWAUCKAQKNMHO-CLOONOSVSA-N 463.538 0.934 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])cc3F)CCO2)C1 1779036979 LATQUVUAKVEUFV-OAQYLSRUSA-N 472.433 0.490 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(O)c1OC 1779037127 PBNRUWWGMSAQSI-QHCPKHFHSA-N 485.497 0.165 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1781861247 PAIRXIRZKUTCQQ-PJSAGSTRSA-N 454.351 0.896 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1782731091 HBMGIGCQJSRDMN-LPHOPBHVSA-N 455.328 0.904 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCSC2)C1 1783202080 CDTMKEFDCVCAMZ-YBOAYWMSSA-N 461.588 0.956 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1783255110 SZLRBIDAPUTJGX-OQYZPLRDSA-N 451.951 0.919 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)CCO2 1783527755 FZXFPFNOSIGKAK-KJOVKWNASA-N 482.375 0.779 50 20 JCGD O=C(/C=C/c1cc(F)c(F)c(F)c1)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1783718271 LFJMTVJUPOOPIW-OIUIXCLQSA-N 474.244 0.941 50 20 JCGD COC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21)c1ccccc1 1783879134 GMBIDHQCHVWGMW-ZVVDCOBXSA-N 489.573 0.436 50 20 JCGD O=C(CCc1cncc(C(F)(F)F)c1)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1784299164 RTXSDOXMSNKALX-JOCHJYFZSA-N 491.275 0.857 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)n3ccnc3C)C2)C1 1784633091 YGRVSTMAAFMXLY-ZLYBIFGKSA-N 455.519 0.716 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1 1785278008 FIRLLRUSJOVNPC-HSZRJFAPSA-N 460.531 0.598 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c(C)c1 1786981965 SMXZTYQZNQXUKJ-HSQYWUDLSA-N 452.316 0.591 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984761 GIQURAPYNKLQDK-QRFRQXIXSA-N 491.313 0.027 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21 1791057616 NFEIBMZNSXBUMR-AJNGGQMLSA-N 466.398 0.175 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(c4ccccn4)CC3)C[C@@H]21 1791290665 IMKSBEMQVZEKSS-ACRUOGEOSA-N 486.617 0.651 50 20 JCGD CNc1nsnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1792485030 DOYIHNWBCIHJCO-DRXBFXEBSA-N 490.498 0.930 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccnc3c1)C2 1796442141 STSKTLFUURYHFL-WNICUGFOSA-N 475.509 0.967 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)c1ccccn1)C2 1796446241 QCMJBSHCFVBAFI-XAKVRMBRSA-N 452.515 0.909 50 20 JCGD CN1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)Cc2ccccc2)C3)CC1 1797237654 TUVCAPBDCZDOEL-XAPVIXHLSA-N 493.446 0.830 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)C2 1800977139 KBHGLCNSGLPRTK-JRBZFYFNSA-N 463.959 0.106 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1c(=O)n(C)c3ccccc31)C2 1800978491 SFWGXKKGRSFHRT-YGTYGHESSA-N 450.923 0.183 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCCOC1)NC(=O)NCc1ccccc1 1802073639 KIHIVBITUCLIIQ-KEZQHZCBSA-N 473.574 0.349 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n(C)n1 1804923552 LAIQKUDARQWCCZ-MGPUTAFESA-N 478.513 0.456 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365297 XJZNIAQNWPLMKO-VGSWGCGISA-N 470.298 0.666 50 20 JCGD COc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(F)c1 1807369646 RDICOAJPGKFTDC-HTAPYJJXSA-N 478.289 0.938 50 20 JCGD COCc1c[nH]c(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1 1807373530 BJSRWNOGKWYYQG-UGKGYDQZSA-N 462.315 0.869 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1)[C@H](F)Br 1808668122 IRVSOITYJJOUEP-IVSAIRAKSA-N 459.316 0.429 50 20 JCGD Cn1cc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1810310583 XWTFFHYPCJDQOB-LAUBAEHRSA-N 462.514 0.376 50 20 JCGD COC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1812687144 MIBUGPDNJSEBQT-MJGOQNOKSA-N 451.288 0.034 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@H]1c1cccnc1 1813069178 VSNRWHUVOJKRAX-KOSHJBKYSA-N 478.557 0.905 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)C1 1814861218 JULUXLIFLFKWCO-ZSZQSSIHSA-N 468.319 0.985 50 20 JCGD Cc1nc(N)sc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354566 JCMBMYJQEJVDTC-LBPRGKRZSA-N 457.346 0.710 50 20 JCGD CN(C)c1ncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)o1 1815355680 YKCQGCNZSGKVEK-CYBMUJFWSA-N 455.305 0.417 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ccc(F)cn3n1)CC2)c1cccc(B(O)O)c1 1815360531 SORJIDSEWJLLBO-AWEZNQCLSA-N 480.290 0.544 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1)c1ccc(B(O)O)cc1 1816942069 MTVBRMLCWMLTGG-CQSZACIVSA-N 462.300 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccnc3c1OCO3)CC2 1819797798 KKBVPFTVZBIKFS-SNVBAGLBSA-N 481.494 0.805 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cnnn1)CC2)NC(=O)NCc1ccccc1 1822518213 HCGFZQSMPANUQK-HNNXBMFYSA-N 498.573 0.088 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H]1CNC(=O)C1)CC2)NC(=O)NCc1ccccc1 1822518824 VKABJHVCTIVWRW-JKSUJKDBSA-N 499.597 0.537 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2cc3ncccn3n2)CC1 1828553061 MABAIWSSLBNDFE-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC(F)(F)C(=O)O)C2)C1 1830538412 FFIWRIAOZWZBFY-IAQYHMDHSA-N 457.268 0.584 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)nc1 1830733455 MWSORQNRPWBRLR-IERDGZPVSA-N 455.939 0.604 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1830902564 QVMSEXZPEKDDIV-XMMPIXPASA-N 484.557 0.333 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CC(N)=O)CCO2 1831610410 ZIHULXUYFPKXCQ-RCDICMHDSA-N 492.485 0.102 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCCc3ccncc3)CCO2)C1 1833056665 IQTUOEZYRHPOQL-DYMLFOFBSA-N 496.568 0.995 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)ccnc1Cl)CCO2 1833256841 JFEATKZAUBHJEN-HXUWFJFHSA-N 471.917 0.317 50 20 JCGD O=C(c1cccnc1OCC1CC1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833624992 YGTGCDWYVHOJEE-LAUBAEHRSA-N 453.923 0.540 50 20 JCGD COc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c(F)c1 1833634515 MGSRFQQLNZCQDA-RHSMWYFYSA-N 464.263 0.990 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccnnc3)CCO2)C1 1834025227 XCINBEOCUYBIGE-KKSFZXQISA-N 483.953 0.679 50 20 JCGD COc1cccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1834051923 NXYIUIDYIJSKGE-UHFFFAOYSA-N 460.579 0.648 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CC34CCCN3CCC4)CC2)CC1)c1ccc(B(O)O)cc1 1834798392 OWUFYSGADOYHDY-UHFFFAOYSA-N 482.434 0.570 50 20 JCGD CCN(CC)C[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799341 YEDWCXYGRLNWDM-IBGZPJMESA-N 472.439 0.530 50 20 JCGD CN1CCC(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1835734341 BLCLHTXQYIRMBD-UHFFFAOYSA-N 485.633 0.602 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1nc(O)n2c1CCCC2 1835852554 INLZBPVGDKHQJZ-QGZVFWFLSA-N 453.971 0.710 50 20 JCGD O=C(CCCC(F)(F)F)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927165 JQAIMIVRHSGAJS-IBGZPJMESA-N 458.242 0.169 50 20 JCGD Cn1c(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc2ccccc21 1835934297 UMEOBERHZAUFMN-AREMUKBSSA-N 491.353 0.171 50 20 JCGD O=C(c1ccc(OC(F)F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939278 KFOYJHKIRPDHNK-HSZRJFAPSA-N 490.268 0.352 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)ccc2c1OCCO2 1836460972 PJMHGOIGRBKONU-IIBYNOLFSA-N 454.907 0.436 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CN(Cc3ccccc3)CCO1)CCO2 1836687542 LOOJIXSFRJRREX-HFMPRLQTSA-N 496.004 0.598 50 20 JCGD Cc1cnc2c(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](C)Br)C4)C3)cnn2c1 1836949905 HNVRNHOLOIDXCX-LIRRHRJNSA-N 466.336 0.891 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837456407 HLZOSXDMLHVPGP-DEOSSOPVSA-N 482.541 0.091 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ccccc3)C2)C1 1837457955 YFPKPXKGBYJWGS-QHCPKHFHSA-N 485.566 0.547 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)c3ccco3)C2)C1 1837459349 DELVVMANSYKZGB-HXUWFJFHSA-N 479.440 0.140 50 20 JCGD CNC(=S)NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1837467225 ZLWMCSPATLXVOF-SJORKVTESA-N 455.408 0.163 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@@H]31)CCO2 1837472136 WYPNPBZWTMAANN-KXEAFHOWSA-N 494.378 0.324 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cnccc3F)CC2)CC1 1837920423 XEYXEOKLQBWHQV-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1ccccc1=O 1838393950 DVJFBDZVLNTZMD-QGZVFWFLSA-N 496.568 0.720 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])CCO2)C1 1838544774 RNKOXJLJHFNLTK-LAUBAEHRSA-N 484.937 0.985 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1ccc(F)cc1)CCO2 1839037427 LBSAEOMCOBQKBR-VPKVUBIPSA-N 485.940 0.654 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839150617 RLPNIKISDIDSQX-IAGOWNOFSA-N 457.376 0.585 50 20 JCGD O=C(c1[nH]nc2ccncc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199711 SJNOEVSOJBYWKM-WMLDXEAASA-N 456.272 0.718 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1nc3ccc(F)cn3n1)CCO2 1839623858 FPWRVEIBRVWUEO-GOSISDBHSA-N 470.299 0.723 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1839965542 BTHZHNHASMEFBT-MGPUTAFESA-N 496.362 0.575 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCSC)C2)C1 1839967085 ZNPBUJORGKUMRJ-GRDNDAEWSA-N 453.399 0.730 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840030736 VFOKAQBKTFOQST-WBMJQRKESA-N 453.355 0.132 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1840035668 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NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ccc(-c3ccc(O)nn3)cc2)C1 1845550144 OCUSKZRDGZQHOK-UHFFFAOYSA-N 473.493 0.979 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1847062178 SCGFZUVRCXFJED-HNNXBMFYSA-N 450.499 0.321 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2ccc3ccccc3c2)CC1 9930752 FVUVILWWHFYTLG-GOSISDBHSA-N 479.580 0.823 50 20 JCGD Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cn(-c3ccccc3)nc1-c1ccccc1)c(=O)n2C 15598490 ARJNTRBRWAKUGB-UHFFFAOYSA-N 498.503 0.748 50 20 JCGD Cc1cc(C(=O)NNC(=O)CCn2cnc3c2c(=O)n(C)c(=O)n3C)c(C)n1-c1ccccc1 16230553 JLSYZNNEBRNYQA-UHFFFAOYSA-N 463.498 0.693 50 20 JCGD COCCCNC(=S)N(C)NC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccc(C)cc2)CC1 726075817 OAZLEAVGQMEMAO-UHFFFAOYSA-N 499.659 0.482 50 20 JCGD Cn1cc(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cn1 726851348 MMWPYSVBYTVSCM-UHFFFAOYSA-N 450.521 0.018 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)COc3ccc(F)cc3)cnc21 727098778 FMHBINFHDISTOU-UHFFFAOYSA-N 453.228 0.258 50 20 JCGD O=C(COC(=O)C1CCN(C(=O)COc2ccccc2)CC1)NNC(=O)[C@@H]1COc2ccccc2O1 728324008 OIIHKKHDSNQKSJ-NRFANRHFSA-N 497.504 0.835 50 20 JCGD CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2[N+](=O)[O-])CC1 728846092 UXPAFJABVOEWRP-UHFFFAOYSA-N 496.528 0.731 50 20 JCGD COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cc3cccnc3)CC2)cc1OC 728852219 UETQQRNMPGDBMY-UHFFFAOYSA-N 462.528 0.890 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O 729274804 DNZUYSNOLSWLAA-KBPBESRZSA-N 460.578 0.257 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H]2CN3CCC[C@@H]3CO2)c1 729618289 IZMAXFBPHXEJCH-IAGOWNOFSA-N 453.565 0.524 50 20 JCGD Cc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)C2=O)cc1 789364486 AKNSOCQFCUYNMV-HXUWFJFHSA-N 493.929 0.524 50 20 JCGD CCOc1ccc(/C=C(\C#N)C(=O)OCC(=O)N2CCN([C@@H]3CCS(=O)(=O)C3)CC2)cc1 913263921 QRYAEQKSHGHSIA-HJDVLLJCSA-N 461.540 0.867 50 20 JCGD COC(=O)c1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 916248411 CZRHBNZTJWWEEC-UHFFFAOYSA-N 490.538 0.681 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)c2ccccc2c1=O 916728438 RRVXNHTUDHQVMB-UHFFFAOYSA-N 474.477 0.839 50 20 JCGD CC(C)N(C)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919886128 VBFWTSCHYFUDDU-LLVKDONJSA-N 466.969 0.500 50 20 JCGD NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)c2ccc3ccccc3n2)c1 920134050 OORFQDLZLGNKPB-UHFFFAOYSA-N 455.496 0.794 50 20 JCGD CC(C)(C)C(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 920338156 ITBGVCPNRIPRBE-KRWDZBQOSA-N 480.587 0.753 50 20 JCGD O=C(COC(=O)CCCNC(=O)c1ccc(F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 920411573 XHIKQIGRDOFKOA-SFHVURJKSA-N 459.430 0.866 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)CC1 1778754541 ICLPXNHXPADSLV-VQIMIIECSA-N 494.452 0.957 50 20 JCGD N#Cc1ccccc1OCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779035639 KLNVEKADYXYCTH-HSZRJFAPSA-N 464.482 0.079 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnccc1Cl 1779588236 AZAQYZWSLXKNRZ-DENIHFKCSA-N 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CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COc1cc(Cl)ccn1)C2 1801011549 NGFRPSKTQDQHGG-VTEUUUEMSA-N 453.927 0.076 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803244253 YSJDDWUXKVOWHN-MHORFTMASA-N 484.981 0.963 50 20 JCGD Cn1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1=O 1803831534 VSULRISBERWLGA-RXVVDRJESA-N 460.299 0.094 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1807361064 DTZNZRKOXIXPMC-YLJYHZDGSA-N 465.294 0.576 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807366992 WPYIPKKJLVRAAG-YADARESESA-N 484.325 0.526 50 20 JCGD O=C(CC(F)(F)C(=O)O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808288439 ZEBWRLGDVUTBMK-MAUKXSAKSA-N 461.230 0.191 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@H]1c1cccnc1 1808370255 AZQJIJWAAXIKGJ-RDTXWAMCSA-N 458.479 0.406 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2CCCCC2)[C@@H]1c1cccnc1 1810297758 DHOBNAMRLXBGNV-PGRDOPGGSA-N 465.558 0.886 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCN2CCOCC2)[C@@H]1c1cccnc1 1810302145 GWHPLRGBUAZQDT-PGRDOPGGSA-N 481.557 0.122 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)C2=NN(C)C(=O)CC2)[C@@H]1c1cccnc1 1813071560 URTYGJKPWIFVEQ-IIBYNOLFSA-N 457.535 0.069 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)[C@H]1c1cccnc1 1813074458 RFSCWDKVVRHMQB-KSSFIOAISA-N 472.468 0.139 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2CCOC2=O)n[nH]1 1815027419 XLVBZVUKNRWSSA-OAHLLOKOSA-N 456.463 0.166 50 20 JCGD O=C(O)c1cc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)ncn1 1816154573 MYIUOSRIPHGEBC-KRWDZBQOSA-N 464.247 0.197 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474834 ZVPIORKHDKXOKI-BEFAXECRSA-N 450.308 0.928 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cc([N+](=O)[O-])cn2)[nH]n1 1819401797 SLLZQLPDQKEBIX-MRXNPFEDSA-N 482.461 0.519 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](F)Br)CC2 1819470717 NRGAZFGEFMXQRG-AKGNYGMASA-N 453.290 0.810 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](N)CCC(N)=O)CC1 1827680687 DEGVJIACXMHAOP-ZQMUCIDFSA-N 473.578 0.333 50 20 JCGD O=C1C[C@H](C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCN3C(=O)OCc2ccccc2)CN1 1828551852 WKHLLJBILULZJG-IUKKYPGJSA-N 492.960 0.174 50 20 JCGD Cn1ncnc1C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828663845 BDOVWOXOXNZIQE-JTSKRJEESA-N 490.948 0.481 50 20 JCGD CC(C)(Cc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830551120 AKBUTGUNUXUZLV-AREMUKBSSA-N 480.370 0.705 50 20 JCGD CC(C)(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830720043 RISCRWPCEFENLF-YCRPNKLZSA-N 477.986 0.736 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830725632 LCVAJNMKNDZGPX-KSMMKXTCSA-N 484.377 0.175 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731513 KKCNYXDTIGRFSE-QRWLVFNGSA-N 465.894 0.110 50 20 JCGD O=C(C1CCN(c2ccc(F)cn2)CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830735626 JGSNZAMEFDYFHJ-PGRDOPGGSA-N 484.956 0.493 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccnc3C(N)=O)CCO2)C1 1833314882 COTNXMOTPIXSJN-XIKOKIGWSA-N 455.309 0.034 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c[nH]c(C(C)(C)C)c1)CCO2 1833382728 NULANNTWOUUWHN-QHCPKHFHSA-N 463.579 0.755 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1n[nH]c(C2CC2)c1F 1834021530 NXHRSIWLOAVKAZ-UHFFFAOYSA-N 483.353 0.605 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccc(Cl)cc1 1835926657 WWHDTGCHCWOORH-XDHUDOTRSA-N 486.761 0.894 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 1838568784 LRSSASYBMTYISR-QVKFZJNVSA-N 499.358 0.689 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C3(C#N)CCC3)C2)C1)NC(=O)NCc1ccccc1 1839054982 RARGZAAZIYUGFU-RUZDIDTESA-N 498.584 0.483 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1839144490 BQAQCVILMDUOJN-OPAMFIHVSA-N 464.950 0.814 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1839151774 CUWBFVPSDAFOIZ-QGTPRVQTSA-N 465.403 0.706 50 20 JCGD Cc1nn(C)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1F 1839197962 NWHGSAMQSVNUIG-CZUORRHYSA-N 451.268 0.628 50 20 JCGD CN1CCCn2nc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cc2C1 1839202585 KLUSZAOOTIVIQU-APWZRJJASA-N 488.358 0.479 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)Oc1ccccc1 1839746255 HMPJJFOSHPFEET-UQBPGWFLSA-N 482.342 0.294 50 20 JCGD COc1ccc(Cn2cc(CC(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)cn2)cc1 1841994925 QIFWCIIAXXHXDG-UHFFFAOYSA-N 488.353 0.680 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)N1C(=O)OC(C)(C)C 1843009766 HBTOWEZJOLCOPN-LPHOPBHVSA-N 471.363 0.971 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)CC2)CC1 1843951676 ZWBIJVURUMFNOE-IBGZPJMESA-N 454.999 0.512 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)no1 1844309545 VLBTUXUDROPGJQ-UHFFFAOYSA-N 497.556 0.262 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cc2NC1=O 1844729347 FHDFGDHLXCRAJE-ZDUSSCGKSA-N 464.482 0.535 50 20 JCGD CN(CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)S(=O)(=O)c1ccc(Cl)cc1 8630639 XPFGPJMUILPKTL-KRWDZBQOSA-N 497.913 0.491 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(NS(=O)(=O)c2ccc(F)c(F)c2)cc1 9931453 UKGZDJQFPUBRLT-GFCCVEGCSA-N 473.479 0.961 50 20 JCGD CCn1c(NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)nc2ccccc2c1=O 11163224 URHASFUOTGUYHG-UHFFFAOYSA-N 460.516 0.533 50 20 JCGD COc1cc(C(=O)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)cc(OC)c1OC 14800178 CSUQEDZDSJQZFQ-UHFFFAOYSA-N 468.466 0.545 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1)c1ccc2c(c1)OCCO2 24757359 QTRQYFGAUVFTTA-UHFFFAOYSA-N 483.524 0.102 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)c2ccccc2O)c1OC 28667792 MNRKZASQXFRDJY-UHFFFAOYSA-N 465.484 0.505 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CCN2C(=O)CCC2=O)c1 725896573 LYCDOIFWXKEGAW-UHFFFAOYSA-N 474.495 0.796 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](C)N3C(=O)CCC3=O)c2)cc1 727722343 JEEGBCVMRLSHRU-ZDUSSCGKSA-N 474.495 0.795 50 20 JCGD CN1CCN([C@@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2ccccc2)CC1 727765353 WTFUWMOQOURKQR-HXUWFJFHSA-N 459.572 0.687 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1 727942844 APLIRTNMBMHAEJ-KRWDZBQOSA-N 464.500 0.680 50 20 JCGD Cn1c(=O)c2ccc(C(=O)NNC(=O)c3cc(F)ccc3Br)nc2n(C)c1=O 728549144 DQJISPGCERDFHG-UHFFFAOYSA-N 450.224 0.609 50 20 JCGD COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)CCc2ccco2)CC1 748327593 MPTPSXSTWOJJDE-UHFFFAOYSA-N 482.515 0.956 50 20 JCGD CN(CC(=O)NNC(=O)CNC(=O)c1ccco1)S(=O)(=O)c1ccc(Br)cc1 751202801 WZTNSAWFXWKTHY-UHFFFAOYSA-N 473.305 0.240 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cccc(S(=O)(=O)NC3CC3)c2)n1 764022504 OLOXFOZTJDYVBK-UHFFFAOYSA-N 452.514 0.439 50 20 JCGD CN(C)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl 787900732 DZZGYCYXWHODAE-MRXNPFEDSA-N 497.913 0.735 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)c2ccccc2c1=O 790062083 YZGZVCHDWGOBTH-UHFFFAOYSA-N 491.551 0.574 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(C(C)=O)CC2)cc1 825636613 HJJZNXOLRKZZBP-UHFFFAOYSA-N 489.554 0.421 50 20 JCGD Cc1c(/C=C(/C#N)C(=O)OCC(=O)N2CCN(CC(=O)NC(C)(C)C)CC2)cc(C#N)n1C 912659967 RADLMBIEZHAGRU-ZDLGFXPLSA-N 454.531 0.714 50 20 JCGD CCN1CCN(CC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)C(=O)C1=O 915357399 DGSRBRZBXLOIFP-UHFFFAOYSA-N 479.540 0.001 50 20 JCGD CC(C)[C@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCOCC1 916254121 HMSIWCOYTCDUNF-IBGZPJMESA-N 467.592 0.772 50 20 JCGD C[C@@H](CN1CCOCC1)C(=O)NN=Cc1ccc(C=NNC(=O)[C@@H](C)CN2CCOCC2)cc1 916362042 HWISBMCIDKQMOV-PMACEKPBSA-N 472.590 0.523 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@]2(N3CCOCC3)CCSC2)cc1 916636631 HGIITXYCOKBHFZ-HXUWFJFHSA-N 485.632 0.154 50 20 JCGD CCc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 917719705 MPTUCGAWAAJMKE-UHFFFAOYSA-N 455.514 0.821 50 20 JCGD Cc1nn2cccnc2c1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 918542910 AUTTWOYFYOVREF-UHFFFAOYSA-N 472.527 0.452 50 20 JCGD O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)NCC(F)(F)F 918707218 HTDWSFKIQFAHGF-UHFFFAOYSA-N 454.427 0.799 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3cccc(N(C)C)c3)CC2)c1 919805818 RPYVRPOJMSJNFU-UHFFFAOYSA-N 459.572 0.974 50 20 JCGD O=C(NNC(=O)c1ccc(F)c(S(=O)(=O)N2CCCCC2)c1)N[C@@H]1CCS(=O)(=O)C1 919887025 YIWIRNKYIVEWME-CYBMUJFWSA-N 462.525 0.131 50 20 JCGD COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1cc(OC)c(OC)c(OC)c1 919954361 JJMNSCVRJYFCMA-UHFFFAOYSA-N 454.457 0.971 50 20 JCGD CCN1C(=O)C(=CNNC(=O)c2cccc(S(=O)(=O)N(CC)CC)c2)C(=O)N(CC)C1=S 920975962 MAFBFXYGRWSDSB-UHFFFAOYSA-N 481.600 0.831 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2)c1cc(=O)nc2cccnn12 1780040488 NERUYQODHMHLJM-VVFCZOMOSA-N 482.310 0.908 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968210 CGSMHUBSQHSLPQ-NSXLHWASSA-N 475.590 0.570 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)Cc3cc[nH]n3)CCO2)C1)NC(=O)NCc1ccccc1 1780968502 LVRUCNDFLFXFDW-QHCPKHFHSA-N 469.546 0.128 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969293 KSNPBNRJODUFHJ-CLOONOSVSA-N 497.600 0.929 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)C1 1781115831 WWEVXNAPLFUDGL-HYFFOGBASA-N 485.654 0.896 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4nccn34)C2)C1 1782359860 FPHVTYQEROIISJ-VUEBRRCKSA-N 463.498 0.912 50 20 JCGD Cc1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)o1 1782647943 VYVVKNCQCBEFNP-AUSIDOKSSA-N 455.515 0.957 50 20 JCGD CN(C)[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1Cl 1782830005 ADGZBOGLWIYVAZ-QPPBQGQZSA-N 485.777 0.766 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1783533857 KZZUQMOBCJHQLB-XIKOKIGWSA-N 454.325 0.244 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1783710935 ZVKCCYKHTFNFJQ-JLCFBVMHSA-N 476.534 0.042 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C3CN(C(=O)c4ccccc4OC)C3)CCO2)C1 1783867969 CWJAJRRXXPNVAE-JPYJTQIMSA-N 479.961 0.851 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1783942010 GDYKAEYSRQLRQS-SGTLLEGYSA-N 454.351 0.896 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4s3)C[C@@H]21)c1cccc(B(O)O)c1 1786982920 HPPLAXYQJYKIOR-WDSOQIARSA-N 465.340 0.883 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C[C@@H]21)c1cccc(B(O)O)c1 1786984829 OIHUZVIXFJOVPJ-IXDGSTSKSA-N 483.721 0.198 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CC(F)(F)C(=O)O)[C@H]2C1 1787435499 YLYMBCVGELAEDJ-RJSLJBRQSA-N 469.445 0.210 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)c3ccccc3)C[C@@H]21 1787508785 MRUPUESEYIWOPW-QMVFFVFNSA-N 467.526 0.834 50 20 JCGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](F)Br)C[C@@H]32)cn2[nH]cnc(=O)c12 1789176686 PKHLVOVFRKSZPW-GZCFXPHUSA-N 470.299 0.615 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1790294879 LZBOANVRMJXPIQ-QOKNQOGYSA-N 477.518 0.575 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2 1792874425 PGOTUSPVPPITDK-JBXGNFEISA-N 492.411 0.883 50 20 JCGD COc1ccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c(OC)c1OC 1792975186 MINIYWFNJNRDLT-ABOVEOFHSA-N 468.934 0.915 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1793050844 JYCWOQFWXHCGGY-VPTLXERWSA-N 492.370 0.976 50 20 JCGD COc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc(OC)c1OC 1793659546 ZXQLWYOPYTVUJV-GPVSGQMNSA-N 492.573 0.218 50 20 JCGD 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O=C([C@@H](F)Cl)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCN2C(=O)OCc1ccccc1 1829206484 TYDONCIEOLQECM-VDVULAQNSA-N 482.940 0.696 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)N1CCN(C)CC1 1830243069 XCHLMDIRMZDSRF-CTNGQTDRSA-N 464.655 0.615 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1830543592 VGTWSHPAQMVYFG-HXPMCKFVSA-N 473.320 0.904 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nc2ccc(Cl)cn12 1830735753 MMWZNZFPNHRNCT-QRWLVFNGSA-N 471.341 0.966 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737267 CSMKKLGGORWIBF-GXYOHSSGSA-N 493.960 0.390 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)COc2ccc(O)nn2)CC1 1831874221 DPPNXKCUHIQHCG-KRWDZBQOSA-N 462.551 0.554 50 20 JCGD CC(=O)N[C@H](C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)C(C)(C)C 1833404168 PZOKVUSCQPUJDV-JOCHJYFZSA-N 480.654 0.482 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798841 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Cc1cc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3ccc(B(O)O)cc3)CCO4)ccc2[nH]1 1835931779 CJDLITJLLBJTHB-RUZDIDTESA-N 477.326 0.540 50 20 JCGD O=C(c1ccc(OC(F)F)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932200 SXOSEVCZPVJLFT-HSZRJFAPSA-N 490.268 0.352 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3c[nH]c(=O)cn3)CC2)CC1 1836138837 YFDSRIWKGZGHDQ-ZDUSSCGKSA-N 454.369 0.986 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(Cl)c4nncn4c3)CCO2)C1 1837372603 FNIOXSOVCROCHT-BEFAXECRSA-N 472.329 0.707 50 20 JCGD Cc1nc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)s1 1837456064 BOODNPSMYYEDKW-JOCHJYFZSA-N 488.570 0.071 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460008 QMCCTFXNIVWDJT-MZNJEOGPSA-N 483.525 0.223 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CCC(OC3CCN(C(=O)[C@H](C)Br)CC3)CC2)CC1 1838301211 UNXBUAAEOAMYKO-INIZCTEOSA-N 487.439 0.933 50 20 JCGD CCOC(=O)C1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)CC1 1839202384 DMEVKFDLGHTPDJ-MLGOLLRUSA-N 451.289 0.477 50 20 JCGD O=C(c1cnn2c1OCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202896 SNMSMTGFIARZCI-DYVFJYSZSA-N 461.288 0.426 50 20 JCGD O=C(C1CCN(c2ccc(F)cn2)CC1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839723527 BWIQOWAIHCDESW-GCJKJVERSA-N 484.956 0.493 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCCC3(F)F)C2)C1 1840182453 JLQLJHQATDZAQP-OXJNMPFZSA-N 460.522 0.641 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccc(F)c3F)C2)C1 1840185613 UBAZBCKFVYKSNF-JOCHJYFZSA-N 468.501 0.337 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]1(F)Cl)CCO2 1840245082 XLTMTNUGZZSLMK-GMXUHYDQSA-N 469.901 0.501 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CC3CN(C(=O)OC(C)(C)C)C3)CCO2)C1 1840869005 ZFBKBHHDUSXRFH-VGOFRKELSA-N 489.997 0.954 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841088848 OZWAUDJEHZYRQA-IBGZPJMESA-N 458.563 0.451 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)Cc1ccc(O)cn1)C2)NC(=O)NCc1ccccc1 1845039544 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0.724 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc2c(c1)S(=O)(=O)N(C1CC1)C2=O 916746505 SBDLFVQBTVWEOF-UHFFFAOYSA-N 477.524 0.361 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H](C)n1cccn1)c(=O)n2Cc1ccccc1 918254858 FNUVKDRBDQXBKE-QGZVFWFLSA-N 492.540 0.669 50 20 JCGD COc1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)c1O 919756531 CDIVUAWKRSLOJM-UHFFFAOYSA-N 451.457 0.302 50 20 JCGD COc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1S(=O)(=O)N(C)Cc1ccccc1 920827900 ZKORBVPACSDSTQ-UHFFFAOYSA-N 474.539 0.899 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)NCc2ccco2)c1 920858353 PIHGEKFBTQNNEC-UHFFFAOYSA-N 451.505 0.511 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779032661 QBZVKVASOLRDMB-QHCPKHFHSA-N 497.512 0.417 50 20 JCGD N#Cc1ccccc1OCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779035647 KLNVEKADYXYCTH-QHCPKHFHSA-N 464.482 0.079 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]cc3I)C2)C1 1779544874 MEBSLSZORAGLJK-MEBBXXQBSA-N 482.706 0.712 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(CCN(C(=O)c3nccnc3C(N)=O)C2)C1 1779879723 RBUQXESFBJFHNY-ARKLPKAPSA-N 482.447 0.904 50 20 JCGD Cc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)nc2nccn12 1781310863 KAYCVDAXOQHGSE-NTKDMRAZSA-N 492.540 0.478 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(N4CCCOC4=O)cc3)C2)C1 1782081451 SMMIKCMVQUONPC-XMMPIXPASA-N 487.557 0.850 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CC(c4ccccc4)=NO3)[C@H]2C1 1784402772 FOCYPDLQHMTSRA-VHHKXPHXSA-N 492.536 0.472 50 20 JCGD CN1N=C(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]3C2)CCC1=O 1785075375 ISDNAJUHEPKKOT-OTRWWLKZSA-N 499.996 0.706 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c(O)c1 1788610295 WFFKWUJMFKUQBZ-GMVOTWDCSA-N 469.498 0.306 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4ncccc4[nH]3)[C@H]2C1 1790335371 ZSHBRVLKLYCNRO-RISOHXOYSA-N 463.498 0.469 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cccnc4nc3O)[C@H]2C1 1790365014 UHEJCRNCNQZEPI-JVPBZIDWSA-N 491.508 0.241 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1C(=O)Cc2ccccc2C1=O 1793053209 SPWDJYLBDWGSGL-BCEDRHLLSA-N 492.370 0.975 50 20 JCGD COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1795241992 FJFYZGWLOXVHNH-VPTLXERWSA-N 453.499 0.140 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1ccc(Cl)cc1)C2)c1ccc(B(O)O)cc1 1795732843 OTPRNRQPAUAMNB-HGKCTWBKSA-N 456.691 0.106 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc2c(Cl)cccn12 1796062598 JRUQUFOACXXZOR-CCWDJLKJSA-N 468.706 0.185 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1nc2ccc(C(F)(F)F)cn2n1 1796191122 AUPSQMSDFRMUGX-BJWYYQGGSA-N 487.247 0.994 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3cnccc13)C2 1796442033 NWONDXNKZQFZLK-DFZQMDCHSA-N 463.498 0.900 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CO[Si](C)(C)C)ccc21 1797955813 GEAKOYFJFXYLMR-CWPLJXCYSA-N 460.607 0.932 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C 1799350496 UFSAFFBAFDMHMG-RBGFHDKUSA-N 492.411 0.883 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1800370933 NGJDVQQMOBXYGC-RACNMONISA-N 469.517 0.906 50 20 JCGD NC(=O)[C@@H](N)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800436363 WRDLFBQBEJAVHU-OYNZLANYSA-N 481.391 0.175 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)C2)C1 1800720754 AHWZSGOKQABKLH-YVSFHVDLSA-N 471.982 0.823 50 20 JCGD CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801014443 RXSOXSITDMEUSF-NYUBLWNDSA-N 497.637 0.888 50 20 JCGD COC(OC)C(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1803347370 FXKNJCKNMJLIAU-GMQOBWHFSA-N 456.503 0.840 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC2(CCCN(C(=O)CN3CCS(=O)(=O)CC3)C2)CC1 1806702996 XREAOAUKFFMBLZ-MRXNPFEDSA-N 450.001 0.202 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CN2CCCC2=O)[C@@H]1c1cccnc1 1806923655 LPVLLHCORWEVNO-IERDGZPVSA-N 465.514 0.022 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCN2CCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807367370 ZAJMFVDDSHUXCY-OFNKIYASSA-N 450.348 0.567 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCc2cnccn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375578 SYYJUIZRAPAQLO-CVDCTZTESA-N 459.315 0.504 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nn[nH]c2C(F)(F)F)[C@@H]1c1cccnc1 1811561683 CSGFKXWNYPWSEB-DYVFJYSZSA-N 482.467 0.911 50 20 JCGD O=C(CCc1ccc(O)nn1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812324552 QQMYEWVMHPIWBH-JPYJTQIMSA-N 475.314 0.209 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)NC(=O)c2cnccn2)[C@@H]1c1cccnc1 1813030966 IDGVKPUBJQQSMD-PCODUJHASA-N 474.949 0.950 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3nccc4nc[nH]c34)sc2C1 1816899761 ULOJRHQWGANXPP-JTQLQIEISA-N 477.510 0.953 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817474842 ZVPIORKHDKXOKI-HNAYVOBHSA-N 450.308 0.928 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C2CCN(S(C)(=O)=O)CC2)n[nH]1 1818815773 MKNAISBAXGEYBR-QGZVFWFLSA-N 497.622 0.446 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401824 UNEFLJBAZCJMCD-KRWDZBQOSA-N 456.507 0.583 50 20 JCGD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)N1CCN(C)CC1 1820784145 AMWVDVFWHYEECS-OXQOHEQNSA-N 468.367 0.031 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1820954793 QTWGDLXZOCAGLA-HOTGVXAUSA-N 454.491 0.335 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1 1822416327 ANHFCQFVDHVOFL-HNNXBMFYSA-N 488.505 0.545 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C#CC(=O)O)CC2)NC(=O)NCc1ccccc1 1822518486 PFFLNUACRJIXBX-OAHLLOKOSA-N 484.538 0.489 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCS(=O)(=O)CC1)CC2 1825993720 DPCSDZUATHKBPH-VXGBXAGGSA-N 464.997 0.039 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](N)CN)C2)C1 1829221070 JVYIKMIELATVLC-FGSXEWAUSA-N 465.982 0.742 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(Cl)cncc1Cl)CCO2 1829605929 QRQCXLHBAABEOU-HXUWFJFHSA-N 488.372 0.831 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829715924 DQXYEAZYPBYEAB-MAUKXSAKSA-N 464.426 0.665 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)C1 1830358396 VGDMDVNZGRUMQR-IBGZPJMESA-N 474.967 0.173 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1830574076 XCZGGURAVCFEDU-XIKOKIGWSA-N 470.350 0.132 50 20 JCGD CC(C)N(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C(=O)OC(C)(C)C 1830719871 MXZAJEZBTIIOMA-KKSFZXQISA-N 477.986 0.688 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1[N+](=O)[O-] 1830733350 JQSGXIYLGWYJNS-FXAWDEMLSA-N 455.895 0.502 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C[C@@H]2C[C@@H]21 1830747474 FZSYNBASZHZHRU-VMDVDIMUSA-N 487.981 0.440 50 20 JCGD COC(OC)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1831039280 GOXPOQRTBOJUFP-NAVGAYGYSA-N 465.453 0.947 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1 1831113869 NSPIOMBTROEFKN-LJQANCHMSA-N 468.319 0.174 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3cc(C)on3)C2)C1 1831652106 WEPUXZQQAHDDMY-MGPUTAFESA-N 456.927 0.577 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)C(F)(F)C(=O)O)CCO2 1832252115 QVFKKGJXXAIUCP-TVQRCGJNSA-N 479.221 0.581 50 20 JCGD CC(C)c1nc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)no1 1832788276 XHIINRRRUDIZCQ-GOSISDBHSA-N 459.341 0.977 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)nc1)CCO2 1834275405 HEFXEZWOIPVNLJ-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798583 NGIFZMLGCIFJLU-NRFANRHFSA-N 457.380 0.125 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCCNC4=O)CC2)CC1 1835515740 LVXWZLMRQUVQAR-KRWDZBQOSA-N 480.997 0.456 50 20 JCGD Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)co1 1835737079 KOIWATOWHKYLKB-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4C3)C2)C1 1835932110 OCLXYUSURYUOFG-GJZUVCINSA-N 478.354 0.242 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C3CCCC3)C2)C1 1837459880 NWKXZZOBRMMYOF-NFOSPISASA-N 457.531 0.502 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1 1837530785 QRWXTLNSCAQQHH-FZTBZWDOSA-N 462.341 0.755 50 20 JCGD Cn1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1Cl 1837921212 MWBNRISVFMBCGS-UHFFFAOYSA-N 474.754 0.679 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3ccc4c(n3)OCCO4)CC2)CC1 1838060215 ODRAGXGEKMHXJF-UHFFFAOYSA-N 489.573 0.838 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc3ncnn3c1)CCO2 1839047896 COFBBJRBWKORPI-LJQANCHMSA-N 466.336 0.513 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(C)c3)C2)C1)NC(=O)NCc1ccccc1 1839054172 JVOPGSWEXUPCRX-RUZDIDTESA-N 498.584 0.441 50 20 JCGD CN1CCN(C2(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCBr)C4)C3)CC2)CC1 1839107959 UANWBXSWGILOMU-LJQANCHMSA-N 473.412 0.008 50 20 JCGD CN(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nc1 1839197856 KEZZBAZVPBPNDQ-CRAIPNDOSA-N 459.316 0.908 50 20 JCGD Cn1ncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1Cl 1839200329 ITLHOXGYCMJPOP-ABAIWWIYSA-N 453.696 0.834 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4cccnc4nc3O)CCO2)C1 1839514417 MURUYXNDYKLOJC-HRAATJIYSA-N 464.906 0.659 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)cnc2c1 1840033202 XKEMTQVXWAOFNW-YCRPNKLZSA-N 493.358 0.856 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C2)C1 1840152127 XYIJUDDOAXGLQX-BTYIYWSLSA-N 466.922 0.290 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NO3)C2)C1 1840182436 JINFLZRGKMSING-GBXCKJPGSA-N 487.557 0.009 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)c3cccs3)C2)C1 1840183866 FJSZTSSKOHTCLI-HVPBSWBLSA-N 478.571 0.316 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840184974 GQMPTOLIFOXTTC-QHCPKHFHSA-N 478.546 0.147 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840186515 ORXQNEVGTSMACU-GOSISDBHSA-N 480.370 0.500 50 20 JCGD CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012271 WWSZQNFDPKDEOC-UHFFFAOYSA-N 491.762 0.522 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2CC[C@]2(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012381 JSQLAWBUMHUVSD-BVZFJXPGSA-N 483.374 0.831 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014121 ZNZXGAPUOITXBO-LPHOPBHVSA-N 471.363 0.686 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@@](C)(O)CC(=O)O 1848098687 QTMCMUSHUCFSTH-DBHZFRFHSA-N 461.943 0.936 50 20 JCGD C[C@H](NC(N)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 26755826 MCUCYCUDKWQPIL-INIZCTEOSA-N 488.570 0.011 50 20 JCGD NC(=O)[C@@H]1CC(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)=NN1c1ccc(F)cc1 728847338 AYDSTVVYYMTSRW-KRWDZBQOSA-N 454.466 0.100 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1 728889823 QRHONZNLBGVLPF-SFHVURJKSA-N 488.570 0.612 50 20 JCGD O=C(NCCN1CCN(c2ccccc2)CC1)NNC(=O)C1CCN(c2ncccn2)CC1 728946193 CWMZUWLDXUAEEH-UHFFFAOYSA-N 452.563 0.846 50 20 JCGD N#Cc1cccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3ccc4c(c3)NC(=O)CO4)CC2)c1 731362765 MPTVXTWJYCXAPJ-UHFFFAOYSA-N 484.494 0.250 50 20 JCGD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1 746351452 WGBFZGDUMTXZTN-UHFFFAOYSA-N 470.525 0.895 50 20 JCGD CCOc1ccc(C(=O)NCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 802303333 DWYQJLLEWWICAZ-SFHVURJKSA-N 457.439 0.346 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2c(C)nc(O)nc2O)c1 813504912 GXZLJTWDLSCFKQ-UHFFFAOYSA-N 451.505 0.621 50 20 JCGD Cn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc3ccccc3c2)c2ccccc2c1=O 913573028 HYLCRYHXTQULBX-UHFFFAOYSA-N 465.491 0.826 50 20 JCGD O=C(CN1CCCS1(=O)=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 916034142 RFMIBESRTOVVCW-UHFFFAOYSA-N 455.496 0.241 50 20 JCGD CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc(C(C)C)nc21 918209132 KCUAMNWHLUWITH-LBPRGKRZSA-N 465.532 0.472 50 20 JCGD COc1cccc(C(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)c1 918779379 PZBCPQNTPVKKMP-UHFFFAOYSA-N 450.459 0.483 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn(C)nc1C)C2 1778091838 SVQPONIPEMXFFI-LVGVVDSRSA-N 469.546 0.990 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(c2)OCO3)C1 1778440088 RXZUGWHSOKPDCN-HYBUGGRVSA-N 481.509 0.855 50 20 JCGD C[C@@H]1CCc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cnccc3C(=O)NN)C4)n[nH]c21 1778605497 TTZJHKYYUITKJR-CLNHLTTHSA-N 481.557 0.899 50 20 JCGD Cc1nc2ncccn2c1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1778630480 HOZQVSFSMMFEQB-NTKDMRAZSA-N 477.330 0.159 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1scnc1C1CC1)CCO2 1779029302 VPXFYZCMSVRIQX-OAQYLSRUSA-N 456.528 0.776 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1779182112 UHYGMRCDJTWBIK-LXIYXOSZSA-N 454.325 0.208 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2ON=C(c3ccccc3)O2)C1 1779262968 YSTUJSUFAXZSPP-DQMJNTIXSA-N 487.557 0.608 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1780740927 ALLDUUNZDUPHGT-VGOFRKELSA-N 452.552 0.383 50 20 JCGD O=C(Cc1ccccc1O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781824014 JSGDPZLMWDPXAS-ZJSXRUAMSA-N 452.316 0.442 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1O 1781978240 ILMPPRKFFFFIHO-QHCPKHFHSA-N 454.288 0.228 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782418628 SMHHZNVDPSZMCN-QRJOEMBSSA-N 465.359 0.768 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1783666961 PGPXEUQITVPTLM-CRAIPNDOSA-N 451.358 0.669 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784096637 JIKKAGXCCDUPLB-FLNBYBTLSA-N 469.941 0.452 50 20 JCGD CCC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCS(=O)(=O)CC3)[C@H]2C1 1785032574 PAWXZKDLQUOVBH-QAETUUGQSA-N 450.001 0.104 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CNC(=O)c3cccnc3)[C@H]2C1 1785169053 IEXUMBVSUJVORB-IWCQGFGOSA-N 467.364 0.822 50 20 JCGD CC(C)Oc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1C#N 1785196509 VUDRKLPSIOLLNM-VWLOTQADSA-N 477.326 0.783 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c(F)cccc34)C[C@@H]21)c1cccc(B(O)O)c1 1786984219 RDKSKECYQYQANL-FNHZYXHNSA-N 466.278 0.289 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)[C@H]3SC(=N)NC3=O)[C@H]2C1 1787499784 ZALWZJZZWABPMW-PMMQCXHCSA-N 475.409 0.942 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC[C@H](O)CC3)C[C@@H]21 1787508155 KVPLTEHSXGJLCA-LHLXRYJCSA-N 459.547 0.651 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)n(C(F)F)n1 1788610021 MHHZPIBNCSFELL-NUTKFTJISA-N 477.472 0.492 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(=O)nc4sccn34)[C@H]2C1 1789139387 IQFMUBOSQBREEP-XPCVCDNBSA-N 454.936 0.603 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)[C@@H](C1CCOCC1)C(=O)N3)C2)[C@@H](O)CCl 1792981907 ZAHHEEGYLQUQHU-FNCFORQESA-N 491.972 0.952 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnnc1O)C2 1793880070 LUZFKKZIGWAYIA-NEBZKDRISA-N 469.926 0.518 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1C(=O)c2ccccc2C1=O 1794121135 JSJQXTRCZHMZLZ-MUJYYYPQSA-N 490.520 0.623 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](NC(C)C)C(C)C 1795715422 SEYQLNWBAWFIMR-JVRIXLFASA-N 460.579 0.733 50 20 JCGD CN1CCN(c2ccc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3ccc(B(O)O)cc3)cc2)CC1 1796185766 MKYCOYRXQLJJIL-VILGAWFOSA-N 476.386 0.684 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N[C@@H]1C[C@@H]3CC[C@H](C1)N3C(=O)c1ccc(B(O)O)cc1)C2 1796190394 UMEJNDQLXJZOEH-FFGOWVMKSA-N 494.357 0.254 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C#CC1(O)CCCCC1)C2 1796442083 QCEHORYGLOFGNT-DVRBRGDMSA-N 469.542 0.409 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCCO1 1797117660 WRAROUBCIRRXQQ-RZFLPCETSA-N 489.997 0.856 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1cnccn1 1797864622 MRRNACZXRKICSY-YMSVYLFOSA-N 468.352 0.216 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN)C(=O)c1ccccc1 1798439522 FCTOZELJDXJNMW-BCDXTJNWSA-N 464.526 0.709 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1799260246 ABIWVKKRLWGDDC-AYRXBEOTSA-N 482.347 0.808 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)[C@H]2OCC[C@H]21 1800768540 PQEOXWBBNHWWNY-IPJSLAPYSA-N 487.981 0.200 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)C2 1800971384 XSFJHAHRDFXTOD-GQUPQBGVSA-N 463.962 0.879 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801015596 DOZHGUULGYXIMH-YVECIDJPSA-N 453.367 0.622 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCn1cncn1 1801261119 TYTOYKPAYATOJU-YVWYUNDQSA-N 472.458 0.405 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1cncn1 1801359134 KTXAELAHBXFPML-NFWAQSGPSA-N 472.458 0.576 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1802040878 OOULRNKSLGXRHC-PTIUUAQKSA-N 455.914 0.062 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc([N+](=O)[O-])o1 1802259020 IVXBJLFWHPPZJQ-UZLBHIALSA-N 464.243 0.896 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnsn2)[C@H]1c1cccnc1 1805001003 WOJXLHUCSVMPMW-SUMWQHHRSA-N 452.500 0.565 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CN2CCNC2=N)[C@H]1c1cccnc1 1807112564 MFZHVESFNUIGOH-FRFSOERESA-N 451.369 0.958 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375173 PPYLOUUAIQJRDQ-QGCDCVKKSA-N 461.331 0.847 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812715950 AXXZCEQQBMFFTB-QILLFSRXSA-N 457.369 0.157 50 20 JCGD CC(=O)Nc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)ccn1 1815356538 JDYYJSVYJJTHMP-INIZCTEOSA-N 479.327 0.716 50 20 JCGD O=C1Cc2cc(C(=O)N[C@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)ccc2N1 1815356715 NABVXSZBSOHNOT-INIZCTEOSA-N 476.323 0.857 50 20 JCGD O=C(CCCn1ccnc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361579 KMXSRXZEHABZPQ-MRXNPFEDSA-N 453.333 0.726 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)Cc3ccc(O)cn3)sc2C1 1827050405 AKDCPXOHIZOXLS-LBPRGKRZSA-N 467.511 0.711 50 20 JCGD COCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1828861510 STPLWTZJOMLXPL-RUZDIDTESA-N 495.341 0.079 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)N1CCN(C)CC1 1828924589 SRINBKCPKGBVQH-XMSQKQJNSA-N 485.633 0.554 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)C1 1830708762 KXNPVPFTTJBZSP-SPYBWZPUSA-N 461.353 0.817 50 20 JCGD CC(C)(C)OC(=O)N(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C1CC1 1830719542 FTAWNVLKVNVVCK-KKSFZXQISA-N 475.970 0.442 50 20 JCGD Cc1cccc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1832242707 JYOGHPZJPWIQDE-VWLOTQADSA-N 481.553 0.696 50 20 JCGD COC(OC)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549123 CIAQMDPHYTWWNZ-VBKZILBWSA-N 479.958 0.194 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc(C(F)F)c1)CCO2 1833319057 KLNYJVFKMABIDL-JOCHJYFZSA-N 475.257 0.083 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833400808 BMCPJMRHHQBBIK-SCLBCKFNSA-N 490.376 0.339 50 20 JCGD C=CCOCCCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833469688 VXCAPNGJSHFGER-UHFFFAOYSA-N 457.380 0.534 50 20 JCGD CCc1[nH]nc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1Cl 1834797838 CDPUNPVBEABJJW-UHFFFAOYSA-N 487.797 0.804 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798262 AEMNFWOLKNTNLB-KRWDZBQOSA-N 458.368 0.353 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)N1C[C@H]2C[C@H]2C1 1835671514 PMVNMQSWDLDCJL-KURKYZTESA-N 483.617 0.211 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3csnn3)CC2)CC1 1835737158 PZJHBABSAPZQME-UHFFFAOYSA-N 458.548 0.036 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](NC(C)C)C(C)C)CCO2 1835898407 SQRWXTYYLQUNQJ-UMVRBXGHSA-N 490.605 0.599 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)C3(c4ccccc4)CCC3)C2)C1 1835939686 DVFCADTVJINWPG-RUZDIDTESA-N 478.354 0.558 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1 1835986446 SQFIZNIAMFKQIH-KXBFYZLASA-N 457.369 0.840 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CS(=O)(=O)N3CCCC3)CC2)CC1)[C@H](F)Br 1836412316 DHJLQXNAOZLXLL-KRWDZBQOSA-N 497.431 0.674 50 20 JCGD Cc1cnc2c(C(=O)N3CCO[C@@]4(COCCN(C(=O)CO[Si](C)(C)C)C4)C3)cnn2c1 1836949345 JAWHZPQMVZPHTI-OAQYLSRUSA-N 461.595 0.959 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(Cl)ccc3F)C2)C1 1837457118 WGNHUGHBDVQRRN-NRFANRHFSA-N 492.895 0.256 50 20 JCGD N#Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(Cl)c1 1837460141 WETDEVMKUHFASG-QHCPKHFHSA-N 498.927 0.594 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1837669424 URQPYCKNQSCNHO-QMTMVMCOSA-N 462.385 0.779 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1837920053 HXASPGHJAIINSM-KRWDZBQOSA-N 471.132 0.669 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cccn4nccc34)CC2)CC1 1837921375 FSBRTSKVFPBLEU-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C(=C/c3ccco3)NC(C)=O)CCO2)C1 1839390941 PKZLFKKHWMIHKR-HMUKAAKESA-N 469.922 0.467 50 20 JCGD O=C(c1ccc(N2CCCOC2=O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839459638 CQGADAXFIBDPDO-AVRDEDQJSA-N 481.933 0.703 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccc(C)c34)CCO2)C1 1839612830 VLMGNYBTHQXHJY-UWJYYQICSA-N 450.923 0.967 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C2)C1 1840032041 MFCWLFRSLDVCQR-RBZFPXEDSA-N 481.347 0.820 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1840076857 KUHVLZPHZPCKNY-IBGZPJMESA-N 481.384 0.298 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccccc1 1841238398 FDNGVRGMPNKNQI-GOSISDBHSA-N 466.498 0.599 50 20 JCGD CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC[C@@H]2C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1846118819 FSZCADLTJUVFOW-CVEARBPZSA-N 499.008 0.553 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccco1)c(=O)n2Cc1ccccc1 14046688 UJDDQQSMSMKZBT-UHFFFAOYSA-N 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486.573 0.202 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334489 OHHMAGUAGJDSTJ-WMZOPIPTSA-N 485.347 0.203 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@@]13CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C3)CCC2 1781368854 YNCXQDFXJOCKCS-HYBUGGRVSA-N 466.347 0.030 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)Br)CCO2 1781382815 BTFNFYJAEILMEY-FXAWDEMLSA-N 495.411 0.686 50 20 JCGD COc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)ccc(F)c1F 1786982002 WQMBFSOIQGRQKR-FNHZYXHNSA-N 474.269 0.560 50 20 JCGD CC[S@@](=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508675 NQMKFJOZQGWXCX-MWLKSIGHSA-N 465.576 0.259 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4cccc(F)c34)C[C@@H]21 1788610060 ZXUWJSJDLOSCPT-QITLCBANSA-N 481.488 0.608 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(O)[nH]3)[C@H]2C1 1788955346 ISAWUGYBCGHQJR-ABHRYQDASA-N 471.942 0.841 50 20 JCGD 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COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793879108 ILOMXERONUSTML-AICCOOGYSA-N 468.378 0.962 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OC(F)F)cn1 1794459196 KHZCEUHLBQVLOP-IVWMJMPLSA-N 455.462 0.259 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 1795895062 NWOPCXYLMMVBKO-IATJYDTKSA-N 490.395 0.730 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)CC(=O)N3)C2 1796441853 ALNXTNHHXDIPNK-NEANFDDLSA-N 478.509 0.518 50 20 JCGD COc1cccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797750511 IQIGKUAWYBWLEF-VPTLXERWSA-N 453.499 0.140 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)ccn1C)C2)NC(=O)NCc1ccccc1 1799869177 APYCMEJMXYNQBO-ACDBMABISA-N 480.569 0.983 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C\C(=O)NC1CC1)C2)NC(=O)NCc1ccccc1 1799871454 HAQHVNQLWPCFAW-FJSXSUQBSA-N 482.585 0.806 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)C2 1801012430 GBVVVFJYYWFZJB-USGNIVHTSA-N 464.513 0.959 50 20 JCGD C[C@H]1[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)CCN1C(=O)OC(C)(C)C 1801014469 VDMUSDLOKHCXIF-CURYNPBISA-N 495.621 0.595 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(C(=O)N(C)C)c1 1801913869 MQPKYLOWGNHYLT-ZLPXHQDTSA-N 494.552 0.726 50 20 JCGD COc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c(F)c1 1805082336 HFIVWMPZFRQLHZ-VGOFRKELSA-N 478.289 0.938 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807370434 FANONGPJOMMKHW-NYDSKATKSA-N 473.342 0.977 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)N1CCN(C)CC1 1807897797 FZWNBLJDDXTAPA-JLMWRMLUSA-N 494.600 0.036 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995499 ZLDFMSMIWNRKMM-IERDGZPVSA-N 462.271 0.201 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)[C@@H](N)Cc2cscn2)[C@@H]1c1cccnc1 1808210613 LHKOIHMAWQVPMC-MDKPJZGXSA-N 473.603 0.487 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccnc4c3OCO4)CC2)C1 1809978081 VRJVEOTYNOAEJT-UHFFFAOYSA-N 451.288 0.649 50 20 JCGD Cc1nnsc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303633 UFKIYDPAFCFQCT-WMLDXEAASA-N 466.527 0.873 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)no1 1813070982 OXFQTSHKLUOCCH-SBUREZEXSA-N 485.545 0.786 50 20 JCGD CCOC(CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)OCC 1813204642 AGJPOHLHHWDMEZ-XXBNENTESA-N 469.347 0.870 50 20 JCGD COC(=O)NCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1813267041 MPJGPLBGSRSWDQ-RUVVGEKZSA-N 469.502 0.577 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1814170437 SOMCTCBIAHCKDW-ICSRJNTNSA-N 467.331 0.670 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCN2CCCC2)[C@H]1c1cccnc1 1814266160 LBWMABUPTPSXDK-XMSQKQJNSA-N 465.558 0.886 50 20 JCGD CN(C)c1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nc1 1815355144 OUYACQRHKYHDCY-HNNXBMFYSA-N 465.344 0.824 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](F)Br)CC2)c1cccc(B(O)O)c1 1815360129 NQSYPWCOKFOLCC-GXFFZTMASA-N 456.102 0.739 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cnn4ncccc34)sc2C1)c1cccc(B(O)O)c1 1816942330 RHQRSSCOVZXMSY-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnncc2C(=O)O)[nH]n1 1819403455 MUBMHZYHBHNPHG-MRXNPFEDSA-N 479.457 0.516 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](N)c1ccccn1)CC2 1819795212 KCPDCQFGFXTREA-DIFFPNOSSA-N 466.527 0.462 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H](O)Cc1ccccc1 1822078603 AOPOPJGKDGCKMV-LEWJYISDSA-N 462.315 0.999 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C)[nH]n1 1822412112 ISIQXQPOBHQZLU-HZPDHXFCSA-N 495.581 0.660 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2)N1CCN(C)CC1 1822696741 FYKGLLPDCFWYCL-HUUCEWRRSA-N 465.624 0.064 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)c1 1827050806 ZHDMQHPJEMZXFG-QFIPXVFZSA-N 499.398 0.712 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(C(=O)O)ncn2)CC1 1828925073 DEJAUWGICUMRQH-LJQANCHMSA-N 481.513 0.720 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CNC(=N)N)C2)C1 1829341007 VEAUGECEYYFANY-VGOFRKELSA-N 494.980 0.175 50 20 JCGD CC(=O)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCN2C(=O)OCc2ccccc2)C1 1829356410 UEMUKHPYGWFBQD-DEOSSOPVSA-N 487.557 0.401 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829715602 CUYQJLNGEUNKQI-RHSMWYFYSA-N 450.399 0.275 50 20 JCGD Cc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1F 1830100808 SBRGARRWFFVPOD-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C[C@@H]2C[C@@H]21 1830719595 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1834864204 CBZIDTBANZTYHH-HRAATJIYSA-N 475.970 0.944 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(=O)nc4cccnn34)CC2)CC1)[C@H](F)Cl 1835084120 MPPVOGTZIPBHQV-SFHVURJKSA-N 450.902 0.809 50 20 JCGD Cc1nc2ncccn2c1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835373798 MVRNJECOJKKFOU-UHFFFAOYSA-N 490.373 0.217 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4cccc(Cl)c34)C2)C1 1835938131 MZYOZYFPFDBETM-DEOSSOPVSA-N 497.744 0.885 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)ccc12 1836254443 YYEOFGHXTQPDSA-HTAPYJJXSA-N 494.932 0.181 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)n1cccc1C=O 1837920884 LICOTOOTPNWYKX-GOSISDBHSA-N 481.358 0.854 50 20 JCGD O=C(/C=C/c1cnccn1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922104 LRWHGBMZJMYBTM-SNAWJCMRSA-N 464.331 0.482 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1838029971 WUWXENCKHWZXPY-UHFFFAOYSA-N 484.513 0.417 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(O)[nH]3)CCO2)C1 1838067838 JSKCMGOMYHBGHQ-OAQYLSRUSA-N 489.441 0.333 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cn2[nH]cnc(=O)c12 1838471087 HGGROFNOOZWEOL-KSSFIOAISA-N 486.298 0.092 50 20 JCGD O=C(c1ccnc2c1OCO2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1838478692 XDKBXXHLMPRFQX-GUYCJALGSA-N 460.256 0.571 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C#N)CC3)C2)C1 1838528412 VZHKYCPZHVHSQY-JOCHJYFZSA-N 472.454 0.894 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccc(F)cc1 1839037251 DQBZUYHJWYVVKE-LQWHRVPQSA-N 471.913 0.059 50 20 JCGD C#CCCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054251 OSSUHYCNPOYUOU-SANMLTNESA-N 499.612 0.983 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1)N1CCN(C)CC1 1839105481 MMEUAAIUNVUZEI-ZWOKBUDYSA-N 475.428 0.110 50 20 JCGD CNc1nsnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839197226 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COc1ccc(C(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1OC 28928412 IOVAHTNAYGVEJC-UHFFFAOYSA-N 476.555 0.780 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cccc(OC(F)F)c2)cc1[C@]1(C)NC(=O)NC1=O 728510314 GTIAPQBDHDGNKE-IBGZPJMESA-N 484.437 0.975 50 20 JCGD COc1ccc(CCN2C[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cc1OC 728846013 UHAMSOYERQWROS-IBGZPJMESA-N 496.568 0.949 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)N[C@@H]1CCC[C@@H]1C)c(=O)n2Cc1ccccc1 729622953 BKIPQRXBKPLQLE-FUHWJXTLSA-N 497.556 0.573 50 20 JCGD COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCN([C@H]3CCS(=O)(=O)C3)CC2)c1C 897557297 JOPVUQAAAQCIRL-MSTPFNHUSA-N 492.598 0.533 50 20 JCGD Cn1nc(C(=O)NNC(=O)CCC/N=C2/NS(=O)(=O)c3ccccc32)c2ccccc2c1=O 913573004 FJYIUURMBCYAHY-UHFFFAOYSA-N 468.495 0.213 50 20 JCGD CCn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(Cl)cc2)c2ccccc2c1=O 913573050 KTPAAYMVEZCXBC-UHFFFAOYSA-N 463.903 0.809 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCC3CC3)c2)c1 914595787 ZSDDDBJXNHKWIA-UHFFFAOYSA-N 480.568 0.700 50 20 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50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)c(OC)c3O)CCO2)C1 1839377576 JNXLEWBIJAKTEB-QVKFZJNVSA-N 472.922 0.733 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839694337 KIULOMQMEQRSJR-HXUWFJFHSA-N 457.358 0.644 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)c3ccccn3)C2)C1 1839963472 LFMNUWYTPYQPEG-QOKNQOGYSA-N 455.353 0.711 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2)C1 1840030654 RPZZRRJJPGTWBO-IQUTYRLHSA-N 494.383 0.112 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1840031206 ISLLMEQFYYXILX-LRDDRELGSA-N 460.285 0.031 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840037393 ZDPJKXONMOGWTG-UIVXKWKOSA-N 473.364 0.982 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1840103559 HBTMSIVIGVSVAS-HNAYVOBHSA-N 460.369 0.486 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnc4ccccn34)C2)C1 1840149743 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C[C@@H](Nc1cnccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052022 MTJGHZMJKMVRKP-UTKZUKDTSA-N 465.363 0.890 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827055483 YVMOPJLLXNBTPS-PKTZIBPZSA-N 495.389 0.070 50 20 JCGD CNC(=S)NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924529 WUGSTVKTLRCJMY-GOSISDBHSA-N 475.619 0.402 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCn2cncn2)CC1 1828925002 CKQJGGNAYYGAIO-LJQANCHMSA-N 454.535 0.600 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1c(Cl)cncc1Cl)CCO2 1829599151 OJQXRFKKHLURGN-NRFANRHFSA-N 494.140 0.452 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1830362022 IVYXEBAGMYHWAC-FQEVSTJZSA-N 480.027 0.379 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c([N+](=O)[O-])c1 1830736237 SAPUYZBVQAOEDF-OXQOHEQNSA-N 485.877 0.051 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1830836576 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C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)N1CCN(C)CC1 1839103318 LUDGOGOVHBDGKQ-LSTHTHJFSA-N 465.422 0.315 50 20 JCGD O=C(c1cccn2c(O)nnc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199282 LRZSOOBPMFWUNL-SJKOYZFVSA-N 472.271 0.195 50 20 JCGD Cc1cc(C#N)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839454054 QVVGXBJKBRTKME-HSZRJFAPSA-N 457.531 0.310 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)CCO2)C1 1839718838 QNBFUOQYXAISPX-MOPGFXCFSA-N 491.328 0.449 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2 1839921271 ICSGOGZZCSTLGT-UXHMZNKVSA-N 494.763 0.947 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840116017 RHSBLHAEOXMXSF-PNLZDCPESA-N 492.013 0.839 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(-c4cccnc4)c3)C2)C1 1840150064 GBZDZKYJTIGAGH-GHTZIAJQSA-N 463.922 0.591 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c2cc(O)ccc2n1 1840184556 VCAWFXSLOSHCTC-VWLOTQADSA-N 499.568 0.692 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1C 1840185973 UYAKTGXRVPSVEF-DEOSSOPVSA-N 476.574 0.376 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc31)CCO2 1840256777 BVGZEZVBUHDIMY-DHLKQENFSA-N 464.327 0.166 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(Cl)c1 1840736227 MRIXNZDBZKWEJP-JOCHJYFZSA-N 482.965 0.792 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC1CC1)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015176 QCPARCGNQTXIDM-LJQANCHMSA-N 471.363 0.877 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cccnc1CS(C)(=O)=O)C2 1843415573 OTBNIUDCXAIBAN-MFKUBSTISA-N 486.554 0.577 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)C[C@](C)(O)CC(=O)O)C2 1844693352 VVHARUKXYAFIOH-FQEVSTJZSA-N 463.443 0.953 50 20 JCGD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)c3csc(N4CCOCC4)n3)C2=O)cc1 12801820 BQBDWWZLWYNIIZ-OAQYLSRUSA-N 488.526 0.217 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCc2ccc(S(N)(=O)=O)cc2)c1 25376747 IQSYTOOUBQAWRM-UHFFFAOYSA-N 482.584 0.758 50 20 JCGD COCCCNC(=S)N(C)NC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 726076409 RZPWTFINEHDCQW-UHFFFAOYSA-N 458.606 0.514 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)NCC1CCN(S(=O)(=O)c2ccccc2)CC1 726249475 GUTULLJQXJOKCJ-UHFFFAOYSA-N 463.516 0.441 50 20 JCGD CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 726277289 LLSKGUJBHWXMBZ-IBGZPJMESA-N 494.618 0.358 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC(NS(=O)(=O)c2cccs2)CC1 728305364 CNQKOKIZKXYWFZ-UHFFFAOYSA-N 455.518 0.255 50 20 JCGD CCN1CCCC[C@@H]1C(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 729515798 OABSZBFSJDUJAS-MSOLQXFVSA-N 482.603 0.975 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)N[C@H]1CCC[C@@H]1C)c(=O)n2Cc1ccccc1 729622958 BKIPQRXBKPLQLE-WMZOPIPTSA-N 497.556 0.573 50 20 JCGD Cc1cc(CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)on1 747305071 GLFUBGLCFNTSFT-UHFFFAOYSA-N 451.505 0.467 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C 748245983 BQHZSWHWAPNCNH-GDBMZVCRSA-N 466.560 0.936 50 20 JCGD C=CCN1C(=O)C(=O)N(CC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)C1=O 748546017 BTHDBVAQFXJKSZ-UHFFFAOYSA-N 491.507 0.287 50 20 JCGD C[C@@H]1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNC(=O)c3cccs3)cc2)C[C@@H](C)O1 751210160 ATTZEJNJWLQJHM-ZIAGYGMSSA-N 480.568 0.737 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H](NS(=O)(=O)c2ccc(C)c(C)c2)[C@H](C)O)n1 760139309 QKWTYTINESMRAT-LIRRHRJNSA-N 498.583 0.029 50 20 JCGD O=C(COC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12)NNC(=O)c1ccccc1 761595253 NCKQTOLMSIDFOO-UHFFFAOYSA-N 460.493 0.916 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccc(C)n1)c(=O)n2Cc1ccccc1 897463137 BOZLRWDQAHNYHG-UHFFFAOYSA-N 461.482 0.593 50 20 JCGD CN(C)c1cccc(C(=O)NNC(=O)Cc2ccc(S(=O)(=O)N3CCOCC3)s2)c1 904224502 APFMHOFFCBPWIR-UHFFFAOYSA-N 452.558 0.839 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NCC(=O)NNC(=O)COc2cc(C)cc(C)c2)cc1 913445891 BSNUNSMHEDKJEJ-UHFFFAOYSA-N 463.512 0.985 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)cc1 916562209 NCPTZCCTBZNLJM-UHFFFAOYSA-N 475.527 0.668 50 20 JCGD N#Cc1cccnc1NCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 916641236 KUQAGCPFEPBFJE-UHFFFAOYSA-N 457.516 0.794 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)NC2CC2)c(Cl)cc1Cl)N[C@@H]1CCS(=O)(=O)C1 919883285 BYHDXPMHBFZYCZ-SECBINFHSA-N 485.371 0.565 50 20 JCGD COC(=O)c1ccc(F)c(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c1 920310627 SROAMYYWVYXNRR-UHFFFAOYSA-N 465.868 0.536 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2ccc3c(c2)OCO3)c1 920397115 WTHGPHQFMCBFTH-UHFFFAOYSA-N 476.511 0.637 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(C#N)cc3)C2)c1 1318155696 FXQREROIJGIKEL-MRXNPFEDSA-N 455.496 0.623 50 20 JCGD CS(=O)(=O)c1cc(Br)cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1F 1318223953 PKXWENLIOUFXEU-ZETCQYMHSA-N 457.299 0.187 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCC3)C2 1779372594 MDSNCSMNYXOAHO-HYBUGGRVSA-N 481.557 0.659 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccnnc1)CCO2)NC(=O)NCc1ccccc1 1780969888 LFGOSKGHIGMNIT-QHCPKHFHSA-N 467.530 0.266 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1783535643 BBXLYDFQWOELFV-KZULUSFZSA-N 450.293 0.316 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935356 NIYXYXGTSZOXHD-WAIKUNEKSA-N 477.537 0.147 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784093888 ITWWSROZSMWKFD-VIQHNZTISA-N 471.982 0.823 50 20 JCGD COc1ccc([C@H]2C[C@H]2C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1784428586 BUXAMNXOYLIRET-IZFXNUPESA-N 478.354 0.772 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3noc(C(C)C)n3)[C@H]2C1 1785210116 POSDBOHASSUCPN-HRZAHRDASA-N 485.545 0.849 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785592385 RNMJMBWJJVRGNA-RXPSNABZSA-N 499.373 0.208 50 20 JCGD N#Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786982175 PZEGLMWZWSSBEP-PMVMPFDFSA-N 461.327 0.464 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccn(C)n3)[C@H]2C1 1787048305 WZZWQCZRMCDBLW-SKFHZHBLSA-N 455.519 0.076 50 20 JCGD C[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21)[C@H]1SC(=N)NC1=O 1787495969 WERXPRHLXOARNG-XSEXMBABSA-N 456.641 0.620 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)cc3F)C[C@@H]21 1788610201 OUOKSMABQQRBEP-KHDYIWLOSA-N 457.462 0.437 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Nc3cnccn3)[C@H]2C1 1788628324 TXMQBNPYPNBYGN-CCFHPVLRSA-N 482.545 0.391 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCNC(=O)C3)[C@H]2C1 1791347038 FTQSZQNCQZOSJQ-OFVDUGFESA-N 488.497 0.640 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1792872533 MTTQTRXDWVQWAY-OEYIWLLWSA-N 485.404 0.512 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1n[nH]c3cc(Cl)ccc13)C2)c1ccc(B(O)O)cc1 1795735179 NRVITOFSKHYWJV-YEZVWNJWSA-N 482.733 0.342 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c1CS(=O)(=O)C2 1795930166 WCTLHDCSWAGUBX-IQOUGMIPSA-N 475.365 0.215 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nnc(Br)n2c1)c1cccc(B(O)O)c1 1796380086 GBCLZBMYFQDKKE-BJWYYQGGSA-N 498.146 0.737 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CNc3ccccc31)C2 1797750861 VTWYNTUSZGLLKC-ZZXMYQEDSA-N 450.499 0.098 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cn2[nH]cnc(=O)c12 1798467682 PUVNKYBOJNTFNU-QPPBUOOMSA-N 456.272 0.225 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 1800769549 IEZFBTRPZGXXPF-DCXXXQMHSA-N 495.621 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1Cl)C2 1801011264 FGMRYKWHNVVDEL-DPIQGUFMSA-N 458.346 0.965 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1CCC(CO)CC1 1804216860 PXHLHOGRBSHDMD-ZDNGABSWSA-N 465.359 0.880 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365894 MNBJXPDKOOERRL-JXKFMYIUSA-N 490.369 0.482 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375836 VOCNVSVSLYLJSJ-ZJSXRUAMSA-N 499.373 0.151 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1cc(=O)n2[nH]nnc2n1 1807949564 PNKIBOODKNLBLB-ZLKJLUDKSA-N 479.270 0.218 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2ncnn2C)[C@@H]1c1cccnc1 1808414021 DMRFNZABSVWLHD-YCIBLXSWSA-N 463.502 0.664 50 20 JCGD O=C(C/N=C/c1ccco1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810389656 DOLJAMYPPSBUNC-JZUGSGHOSA-N 460.299 0.793 50 20 JCGD COc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1810809506 PMKJWPFIZVBWDY-GCJKJVERSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc2cccnn2n1 1811268206 VXASPFBAHMUUFJ-GCJKJVERSA-N 470.298 0.438 50 20 JCGD CCC1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)COC1 1812490358 MMVQIHXOEWDTGD-QFBILLFUSA-N 452.515 0.826 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCN2CCOCC2)[C@H]1c1cccnc1 1813069923 BPGUCRFQRRLREA-XXBNENTESA-N 460.579 0.183 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=C/C(=O)NCc2ccco2)[C@H]1c1cccnc1 1813072552 FISDBLZILRXNNX-QOUQAXHDSA-N 496.568 0.926 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)/C=N/O[C@@H]2CCCCO2)[nH]n1)c1ccc(B(O)O)cc1 1817472216 NYEJWAPVTAJOFJ-PAIJHWHYSA-N 469.307 0.924 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476948 IQCFBWJKLYAKAT-GOSISDBHSA-N 454.292 0.905 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)/C=C\C(=O)NC2CC2)n[nH]1 1819272021 QATIEBHUVZXBEI-JTGQJZMRSA-N 466.502 0.549 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819452330 KBGXDJPDBNVANF-PAIJHWHYSA-N 469.307 0.924 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCCCC1=O)CC2 1819801002 WSGIOFSYDJXIFH-GFCCVEGCSA-N 471.543 0.380 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1820107156 LJNKTNIQFUBOQY-SWLSCSKDSA-N 458.349 0.354 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1 1823530565 OPNAFGWAZLAXNT-IHRRRGAJSA-N 486.957 0.770 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)CC1 1824977142 ZPVFPSHIITZKOK-MSOLQXFVSA-N 464.028 0.590 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CS(=O)(=O)N1CCCC1)CC2 1825998315 HWGGIYCQDQSPDT-VXGBXAGGSA-N 464.997 0.735 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)NC(=O)OC(C)(C)C)CC2 1826088889 RCJARVUMXCVLPY-GTNSWQLSSA-N 484.579 0.271 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1828763213 MUQGJQZURKXINV-QFBILLFUSA-N 455.556 0.044 50 20 JCGD O=C1CC(C(=O)N2CCN(C(=O)OCc3ccccc3)[C@@]3(CCN(C(=O)[C@@H](F)Cl)C3)C2)=NN1 1829124288 NVRPLXIXGJTIJE-DYESRHJHSA-N 479.896 0.849 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)no1 1830540542 QOVKYFBIZWLKRT-ORAYPTAESA-N 487.351 0.200 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830724772 BXVQFVIBHRTVNK-URZJWIJPSA-N 489.997 0.832 50 20 JCGD O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733314 IIQJQZYMBNEWSB-FXAWDEMLSA-N 471.341 0.815 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](F)Br)CC1)C(=O)C(=O)O 1831166338 CFOKMBWFXDQQBM-GXTWGEPZSA-N 450.305 0.840 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CC1 1831871154 MGDGBXHVGIESLR-OALUTQOASA-N 497.637 0.865 50 20 JCGD Cn1nncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1833224945 ANPMKUUBYXORJB-XOBRGWDASA-N 486.957 0.017 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ncc(F)cc1F 1833602108 KVILUVPHRVCWJY-UHFFFAOYSA-N 472.301 0.539 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1coc(C)n1)CCO2 1834207960 VLUVSFGQROJSFV-GQBLCDNYSA-N 458.475 0.187 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnoc1C)CCO2 1834316082 VEHNBGKURCTGFF-JHXRPTDYSA-N 458.475 0.187 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3snnc3C3CC3)CC2)CC1 1835244892 NHTFYAQOJZJKON-UHFFFAOYSA-N 498.613 0.913 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@H]1Cc2ccccc2O1 1835476543 HWHLMCVJJQFRFR-XMMPIXPASA-N 477.370 0.555 50 20 JCGD O=C(c1ccnc(C(F)(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929204 HNOFXVHIBZXXIX-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccc4)no3)C2)C1 1835931664 WTAPMKDZBZAQBY-RUZDIDTESA-N 491.309 0.405 50 20 JCGD Cn1ncc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1Cl 1836042448 UBPXJPFPBYWVNE-UHFFFAOYSA-N 473.770 0.252 50 20 JCGD COc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1836981822 ONCQWTWNWNMNIQ-UHFFFAOYSA-N 467.331 0.696 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1cccn1 1838395331 DSJRATXLGWBDFI-INIZCTEOSA-N 469.546 0.755 50 20 JCGD CCc1[nH]nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1F 1839198001 PEZBFXAKSPDNTM-CJNGLKHVSA-N 451.268 0.872 50 20 JCGD COc1ccnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1OC 1839202026 RJFZDHAATZWAPI-CRAIPNDOSA-N 476.299 0.859 50 20 JCGD O=C(c1cccc(N2CCOCC2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839343400 COPRYBKZTLCSMY-KNQAVFIVSA-N 467.950 0.193 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)CC)CCO2 1839962579 KVZYFJVMESIBIK-HNAYVOBHSA-N 462.385 0.923 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(-c4cccnc4)c3)C2)C1 1840150070 GBZDZKYJTIGAGH-RXVVDRJESA-N 463.922 0.591 50 20 JCGD CCC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)n1cccc1 1840183871 FQBQUWDGIFPBPA-XXBNENTESA-N 463.579 0.659 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1840184395 JSBFLRAUJYVYBL-JOCHJYFZSA-N 492.964 0.431 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840187793 XLLWGEJINLMNSH-BFUOFWGJSA-N 484.377 0.786 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)C[C@H]2CNc3ccccc3O2)C1 1844220119 BYUQVSUDEHFWQJ-HNNXBMFYSA-N 450.499 0.765 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CCN1C(=O)C=CC1=O)C2 1844691910 NANHBVSYXDXYGZ-UHFFFAOYSA-N 470.438 0.652 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2c(O)cc(O)cc2O)C1)NC(=O)NCc1ccccc1 1845421699 ZYSOGYYMUAGTGU-UHFFFAOYSA-N 483.525 0.967 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNS(=O)(=O)c2cccc(-n3cnnn3)c2)cc1 116055488 ZJCJWQGNEXSPQU-UHFFFAOYSA-N 471.528 0.706 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)cc1OC 726649446 FZGQAMMDQZADTO-GFCCVEGCSA-N 462.459 0.261 50 20 JCGD C[C@H](Oc1ccc(F)cc1)C(=O)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727098436 NQNGXVZEZFGORP-VIFPVBQESA-N 467.255 0.647 50 20 JCGD Cc1nn(CCC#N)c(C)c1CCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728326519 AANVLKCGOOWFGG-IBGZPJMESA-N 455.471 0.877 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCC(CO)CC1)c1ccc2c(c1)OCCO2 745491316 INWNLQUJYIQIFE-UHFFFAOYSA-N 481.552 0.987 50 20 JCGD O=C(COC(=O)C/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1cccc(Cl)c1 821698195 WUSGDSSBHWZCRT-UHFFFAOYSA-N 450.860 0.383 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)C2=NN(c3ccc(F)cc3)[C@@H](C(N)=O)C2)c2ccccc2c1=O 913081711 XEDXLONEERBQPS-GOSISDBHSA-N 479.472 0.998 50 20 JCGD O=C(COC(=O)c1cc(Cl)ccc1-n1cnnn1)NNC(=O)[C@H]1COc2ccccc2O1 915244121 CHTXXAHJKWIMGB-MRXNPFEDSA-N 458.818 0.460 50 20 JCGD CC(C)[C@@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCN(C)CC1 916258382 VSESHIKUEHGDDA-JOCHJYFZSA-N 459.639 0.801 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1778350216 LFOJEVWKXUSQCH-XFAGBWLFSA-N 495.621 0.692 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3CCN(C(C)=O)CC3)C2)C1 1778359730 XDRILMXRNNDHHG-QFBILLFUSA-N 459.385 0.154 50 20 JCGD Cc1ccn2c(=O)c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)cnc2c1 1778689443 LXOIZTDGSKMLET-DRSNIGMVSA-N 462.934 0.730 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032265 MJWPFKCUCAMZBV-NRFANRHFSA-N 469.527 0.460 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1n[nH]cc1I 1779706016 DAZUZKXIYGUQHM-XHBSWPGZSA-N 496.733 0.742 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)CCOC1 1780760847 ACOCXCRVOMOMNS-AHWCRGGASA-N 489.997 0.784 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Br)C2)CC1 1780774970 RHNSIAJTLVMPDO-RVKKMQEKSA-N 498.415 0.862 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)C1(O)CCC1 1780968868 KEWBCQCCBNCAHF-DVECYGJZSA-N 487.601 0.714 50 20 JCGD Cn1cc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)ccc2n1 1781236915 VMGALNZGABMQPJ-RCZVLFRGSA-N 476.342 0.694 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(C(N)=O)cc2)C1 1782866185 TVFOHFRIUNWMAI-WZONZLPQSA-N 459.547 0.286 50 20 JCGD O=C(CN1C(=O)C=CC1=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783023101 TYTHZHFTPKQWID-VGSWGCGISA-N 490.354 0.748 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1783780870 CQUIVYZTVPCXFS-JOCHJYFZSA-N 485.327 0.510 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C[C@H]1COc3ccccc3O1)CCO2 1783933135 CNXLNBBMKZXNCY-GAJHUEQPSA-N 460.531 0.419 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCCN3C(=O)c4ccccc4C3=O)CCO2)C1 1783933364 IWSLZMVDYQXBRA-RUZDIDTESA-N 499.568 0.266 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@]1(C)CCCN1C(=O)OC(C)(C)C)CCO2 1783933493 MEGOBLGBMCMTJL-BJKOFHAPSA-N 495.621 0.979 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(C(F)(F)F)ccn1)CCO2 1783935373 OEJXYNZFVPRKPE-IBGZPJMESA-N 457.453 0.917 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)CCO2 1783939913 NGPCUVSKCDLRMQ-NRFANRHFSA-N 485.557 0.148 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccccc3[N+](=O)[O-])CCO2)C1 1783939997 QBNRMUCTEZUIDP-FGBWHXJSSA-N 459.503 0.811 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1785593309 YSPXMSBBIIMKTG-UGCQDJOBSA-N 457.955 0.885 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@@H]4Sc5ccccc5[C@H]43)C[C@@H]21)c1ccc(B(O)O)cc1 1786979590 BATABQNJQZMFFV-PSSAOXBQSA-N 478.379 0.848 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(=C/c3ccco3)NC(C)=O)[C@H]2C1 1790180871 PEYAXUDGWLTXDA-HOFANOCXSA-N 453.923 0.990 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc2c(c1)C(=O)CC2 1790385238 RVGGOESNPMKEPY-HARLFGEKSA-N 462.311 0.402 50 20 JCGD Cc1onc(-c2ccccc2)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737270 NEZGTLVNRLJZIJ-HATOLVCRSA-N 475.310 0.847 50 20 JCGD Cc1cc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)c2[nH]1 1796984155 KAMYCQDKUBZEIX-CWPLJXCYSA-N 462.510 0.992 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797754355 SDTLHQFQZABAEI-WMIGDMCZSA-N 462.510 0.829 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)Nc1cnccn1 1797775923 CZDLJIVMBJTQDY-OBBNUZJISA-N 468.518 0.001 50 20 JCGD CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1csc2c1c(=O)n(C)c(=O)n2C 1799064600 RRTQTUVWIAMGNK-UMPJEAMMSA-N 482.990 0.448 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c(Cl)cccc12 1799900748 HHQBECRPULNPGL-DPIQGUFMSA-N 483.916 0.732 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2)C(C)C 1800208911 FHJNLCBXOGNWIR-MULDDASSSA-N 486.997 0.596 50 20 JCGD COc1cccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1800683835 OJGOVFPHCHIHPD-INUXOSNVSA-N 465.510 0.610 50 20 JCGD COC(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c([N+](=O)[O-])c1 1800791669 XAFIDECSHSKDBV-BCDXTJNWSA-N 481.270 0.627 50 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CCNC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1810239332 LCZTXHKQZFCYHU-MDYRTPRTSA-N 461.567 0.168 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CC2(O)CCC2)[C@@H]1c1cccnc1 1810309386 QMZIDXAVSSSYDO-OXQOHEQNSA-N 452.515 0.705 50 20 JCGD O=C(CCc1ccc(O)nn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1812323947 CZHXPXFVGXXIEB-MBSDFSHPSA-N 475.314 0.209 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1812365515 NRNWBBMAETXAHW-ZTNFWEORSA-N 469.303 0.643 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)c(C)n2n1 1813069723 BSOLORLIBPEVCT-MBSDFSHPSA-N 493.572 0.829 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n1 1813069872 DJSASMRNAPHMID-PGRDOPGGSA-N 471.562 0.617 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](C)NC(=O)c3cnccn3)sc2C1 1820027329 ZDRZYUGZSALOJL-SDDRHHMPSA-N 466.951 0.917 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[nH]n1 1822414511 VQAFVTUAMFWHMJ-HNNXBMFYSA-N 492.562 0.240 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)COc3ccc(O)nn3)sc2C1 1824557832 OZSZDNOLVJUEDK-ZVYABZQBSA-N 498.525 0.764 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(-n2nccn2)c1 1830732102 RLNGLIPCABFRKO-RXVVDRJESA-N 463.922 0.245 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c(OC)c1F 1830733965 XHUXWRDTVFIVNI-ZUOKHONESA-N 478.876 0.652 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1831110074 BXAVBXJFVREFSZ-MBSDFSHPSA-N 492.385 0.813 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(-c4ccccn4)nc3)CCO2)C1 1833292813 KSFWVEJQYWRCAB-VGSWGCGISA-N 475.933 0.862 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc([N+](=O)[O-])[nH]3)CC2)CC1)c1cccc(B(O)O)c1 1834801307 XIKGIQNFOCXYSG-UHFFFAOYSA-N 469.307 0.102 50 20 JCGD NC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)c1ccccc1 1834822229 DUJGWKZSCOMISI-PXNSSMCTSA-N 454.365 0.970 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1834859634 PBCIFPACBHRHCB-KNQAVFIVSA-N 468.934 0.714 50 20 JCGD COCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1834973658 ILKUJJHSRXRLLI-FQEVSTJZSA-N 451.432 0.237 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C/N=C/c3ccco3)CC2)CC1 1835781486 BPRLAOZJFAAFDN-LFVJCYFKSA-N 460.579 0.643 50 20 JCGD O=C(Cc1ccc(F)cc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933744 BYZVIFSQBKQQTE-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)s1 1835935232 JRQPFCAXXKTYDD-QHCPKHFHSA-N 472.372 0.439 50 20 JCGD O=C(CCc1ccccc1F)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939801 IXGJLBMLTSDDNZ-DEOSSOPVSA-N 470.306 0.208 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1836592212 KWKMJGPZEWXWFU-DEOSSOPVSA-N 496.369 0.721 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnc3[nH]ncc3c1)CCO2 1836811851 VIPRPOSUAATENU-HGQHNSGJSA-N 494.512 0.162 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccccc3Cl)C2)C1 1837457741 OTMHPZCGQAPDNE-QHCPKHFHSA-N 487.944 0.651 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3Cc4ccccc4CN3)CC2)CC1 1837919316 GJCUFQLXKAVSJU-VWLOTQADSA-N 491.397 0.693 50 20 JCGD O=C(Cc1cc2cccnc2cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839133292 JBLYMJGTDNZWBW-UGKGYDQZSA-N 465.909 0.973 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1839200931 SJYAGEFEBJKMTK-KYNGSXCRSA-N 486.294 0.868 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1839387455 KGQRQRVQCSCJAQ-UZLBHIALSA-N 475.615 0.137 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc2c[nH]nc12 1839511848 WFMNKAHKUATYEI-DEOSSOPVSA-N 493.524 0.254 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C[C@@H]1C[C@@H]3CC[C@H]1C3)CCO2 1839916680 RMSCRCCODWMRAH-GKAYAJSDSA-N 450.580 0.642 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](Br)CC)CCO2)C1 1839964933 JKCMLSYQRWCWES-CLCXKQKWSA-N 462.385 0.921 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCS(=O)(=O)c3ccccc3)C2)C1 1840151649 JPQRKWGOYPNFDY-GHTZIAJQSA-N 488.990 0.561 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840184274 GGRXONBJIRFVON-XMMPIXPASA-N 489.573 0.017 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840185509 SOKUZCBLXXFALD-DEOSSOPVSA-N 490.557 0.306 50 20 JCGD COc1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1C 1840643593 SEQIFTSNSRBEED-XMMPIXPASA-N 468.315 0.067 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012422 NTDKROUEZNMWTI-BXKMTCNYSA-N 469.347 0.583 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cc1ccccc1F)c(=O)n2Cc1ccccc1 10161402 USAIGMVPFDOZGF-UHFFFAOYSA-N 478.484 0.957 50 20 JCGD CCOc1ccc(C(=O)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)cc1OC 14936184 HVYDCUVEACQBFI-UHFFFAOYSA-N 452.467 0.927 50 20 JCGD COc1cc(C(=O)NNC(=O)CCOc2ccc(S(N)(=O)=O)cc2)cc(OC)c1OC 726373312 YSJXWVPNMIYBJH-UHFFFAOYSA-N 453.473 0.590 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)[C@H]1Cc2ccccc2CN1Cc1ccccc1 728519564 LLINOJRKCKUIAQ-XZOQPEGZSA-N 477.565 0.888 50 20 JCGD COc1ccc(C(=O)NNC(=O)COc2ccccc2O)cc1S(=O)(=O)N1CCOCC1 730780919 YMWISOQSMHIZDS-UHFFFAOYSA-N 465.484 0.262 50 20 JCGD CCn1c(CCC(=O)N([C@H]2CCS(=O)(=O)C2)N(C)C)nc2cc(S(=O)(=O)N(C)C)ccc21 746949177 GOZUSKDEENYLAX-HNNXBMFYSA-N 485.632 0.731 50 20 JCGD O=C(CS[C@@H]1CCS(=O)(=O)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 747405288 AXRNYXILGSLXIL-OAHLLOKOSA-N 475.614 0.543 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)CNC(=O)c2cccs2)C1 751208669 HRYPUKYDTQHXLZ-ZDUSSCGKSA-N 469.545 0.331 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1 786121909 LVZPUVQZRFTZHM-MRXNPFEDSA-N 495.945 0.025 50 20 JCGD CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 812452886 DEGOYZUNLUHFCP-LJQANCHMSA-N 470.438 0.748 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)COc2ccc(C#N)cc2)c1 864017224 ZVRYBJLVICDVJN-UHFFFAOYSA-N 487.538 0.485 50 20 JCGD Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 916124847 XCZBSOSLGOYBBF-KRWDZBQOSA-N 450.434 0.613 50 20 JCGD CN1CCN(c2ccc(CNC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)cn2)CC1 916247277 NDPHOPVYFNWPFF-UHFFFAOYSA-N 450.503 0.869 50 20 JCGD CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)CC1 916383965 XXOZHTAABUOEGF-UHFFFAOYSA-N 458.537 0.861 50 20 JCGD C[C@@]1(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)CCS(=O)(=O)C1 916649877 VMNCCORPHRLVCO-MAUKXSAKSA-N 460.578 0.025 50 20 JCGD O=C(NCCC(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1cncn1-c1ccccc1 1318092799 FZNOPXVLJJGBGT-UHFFFAOYSA-N 462.514 0.950 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1778784906 AFIDGBYZHRHVLY-UTKZUKDTSA-N 494.457 0.028 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-c4ccco4)no3)CCO2)C1 1779030767 WVKGUEJFESXBCO-QFIPXVFZSA-N 466.454 0.690 50 20 JCGD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c(O)c1 1780320831 AKBOLGMDXFYXKP-ZJSXRUAMSA-N 468.315 0.522 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cn[nH]c1)C2)NC(=O)NCc1ccccc1 1780559548 QXFFXWSQVUTXAZ-HYBUGGRVSA-N 483.573 0.883 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCN3C(=O)Cc4ccccc4C3=O)CCO2)C1 1783870476 CIXRNCKWQOZROC-FDDCHVKYSA-N 477.945 0.685 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCNC(=O)c3ccccc3)CCO2)C1 1783939519 GWCOLKZKRUYHBK-HSZRJFAPSA-N 459.547 0.009 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)CC2=O)c1 1784083678 FMORVCWCYNXVCW-GYWCDFCBSA-N 479.961 0.628 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)cnc2s1 1784093142 QRIOLSRRMFHVPA-MHEUCROKSA-N 454.936 0.257 50 20 JCGD CC(C)(C)OC(=O)N1CCC(O)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)CC1 1784853985 MWGMALFCGYMVNW-QAETUUGQSA-N 489.997 0.328 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCC(=O)NC3)C[C@@H]21 1785074675 XYIGUHUDNUTXLH-WOYTXXSLSA-N 486.997 0.624 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)ccc2c1OCCO2 1786979709 AZAAXFPZRLJWAN-XJABCFGWSA-N 480.326 0.353 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(O)n3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724723 MPCZYTRWZOSIKU-ZJOUEHCJSA-N 496.568 0.727 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)C(=O)CC4)[C@H]2C1 1790385624 CUNIQKYXXLDKES-CUWPLCDZSA-N 456.543 0.782 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)NS(=O)(=O)CC)C[C@@H]21 1790958230 MTPPSVGHIHKMAF-QTVXIADOSA-N 468.414 0.467 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc(OC)c1C 1791292232 JPZGTFOYGYPUPH-MDKPJZGXSA-N 476.574 0.979 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792984190 VLMKZIGYYPEJOY-CKBPBPHLSA-N 477.961 0.915 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nnc(Br)n2c1)c1ccc(B(O)O)cc1 1796380866 RAPNWHNCMGAGKK-BJWYYQGGSA-N 498.146 0.737 50 20 JCGD COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cc1O 1796439802 AYXFSJAZSDSCJD-JKWNGSSESA-N 483.525 0.667 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796445676 HPIRTTJHKGLGAZ-FKWFMORESA-N 480.525 0.982 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2cc(F)c(F)cc2[nH]1 1797336628 MJDXDZKQJJKADM-USGNIVHTSA-N 469.253 0.643 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@H]3Sc4ccccc4[C@H]31)C2 1797751508 BRNVLMYZDVALBL-LDDAGVOWSA-N 479.562 0.776 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(F)c1)C2)NC(=O)NCc1ccccc1 1799094996 PAYDTOSZRQDKJT-HATOLVCRSA-N 484.532 0.770 50 20 JCGD C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1799273645 FLGWWEQNHSLMSO-PKXQRHIVSA-N 473.357 0.819 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(-c2cc[nH]n2)cc1 1799696573 WYFFQLVRWDTTHT-HATOLVCRSA-N 460.299 0.274 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc[nH]n1 1800285096 CESUGRCZQOKHTF-YXPYIKCWSA-N 455.943 0.674 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)C1(O)CCC1 1802465459 JPJLVQFYAXETGB-MDYRTPRTSA-N 466.542 0.951 50 20 JCGD N=C(N)SCCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807371137 QTSSDDKNHYTCPF-LPHOPBHVSA-N 455.349 0.098 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@@H]1Cc2ccccc2CN1 1808239151 NMPOFVIYTZDJDG-VJTSUQJLSA-N 484.365 0.796 50 20 JCGD CN(C)c1ccc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)nc1 1809968361 VZNGZHKWRLAYIX-UHFFFAOYSA-N 450.348 0.986 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2CCCC2=O)[C@H]1c1cccnc1 1810301686 BYOYWSGJWNQTCD-KKSFZXQISA-N 465.514 0.022 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)NC[C@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)c21 1811275370 ILKNDXUPDUPVJE-XMSQKQJNSA-N 499.336 0.987 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nn1C 1813073647 SBBAIQNKUALLKE-IIBYNOLFSA-N 457.535 0.516 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)C[C@H](N)c3cccnc3)sc2C1 1815184586 NAWROQBIGVWRON-GJZGRUSLSA-N 459.576 0.913 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354612 MARBDDGIJKBHGO-SJORKVTESA-N 465.344 0.014 50 20 JCGD Cc1nn(C)c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1F 1816244197 WIFWQWFJUXANTH-MRXNPFEDSA-N 454.271 0.890 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)sc2C1 1816980420 CZDRWKHQOXALGV-JSGCOSHPSA-N 498.606 0.314 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3cc4cn[nH]c4cn3)sc2C1)c1ccc(B(O)O)cc1 1819445838 LEDAIOLSNZMFOX-CQSZACIVSA-N 462.300 0.634 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819452351 LBXVEVMVZZRQAT-WEEQGOHXSA-N 469.307 0.924 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3ON=C(c4ccccc4)O3)sc2C1)c1cccc(B(O)O)c1 1819586979 YWNXRJFGZHLYTQ-ZHRRBRCNSA-N 492.322 0.783 50 20 JCGD CNC(=O)CC(=O)N[C@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822518770 SXOOIIKHIAJZKY-HNNXBMFYSA-N 487.586 0.537 50 20 JCGD C[C@@H](O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2 1825626334 NPEXBAMQMHQZTD-UKRRQHHQSA-N 460.560 0.782 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](Cc1cnc[nH]1)NC(C)=O)CC2 1826008607 DJGGOGGSZUMSLD-OSAQELSMSA-N 468.967 0.779 50 20 JCGD O=C(c1cnn2ccncc12)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052007 LKHFESPXDCDEGW-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053743 ZRFBVQJIBGHTPE-PMACEKPBSA-N 489.378 0.443 50 20 JCGD Cc1cc(CC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)nn1C 1827055647 GUWRLHYPOYCPBR-JOCHJYFZSA-N 452.364 0.884 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)C1(O)CCC1)CCO2 1829737515 SEYXYXYHQGQYDQ-ZOJONMHKSA-N 475.546 0.128 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)CCO2 1830418619 KXAOBQATBQFBEI-SLSDLSHTSA-N 482.317 0.379 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830738684 RPEOWLXVJHZOSU-FHTPNYMGSA-N 487.981 0.512 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(OC)c1OC 1830886903 MCVNEFBFRBFEMK-RNNSKVFSSA-N 498.960 0.782 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cc(=O)nc3cccnn23)CC1 1831873329 HYKXJEODAXETLI-GOSISDBHSA-N 483.573 0.696 50 20 JCGD Cc1cc(C)nc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834936074 LQDQTQVGTMHSHA-UHFFFAOYSA-N 464.375 0.877 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)nn3-c3cccc(=O)n3C)CCO2)C1 1836259833 LYSBXLXTVSIBJK-SBUREZEXSA-N 491.976 0.967 50 20 JCGD COC(=O)C12CCC(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)(CC1)CC2 1836705990 FTKHTQRIYOLDEN-QXFGJNNOSA-N 472.966 0.556 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837630205 JIIJIWWNKCBLFL-MOPGFXCFSA-N 459.330 0.713 50 20 JCGD CCOc1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1838884308 STZOLWREYLCXRX-XMMPIXPASA-N 468.315 0.149 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)N1CCN(C)CC1)CCO2 1839101278 MMEUAAIUNVUZEI-FUHIMQAGSA-N 475.428 0.110 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202726 NUORXRZFSMAFCW-FUHWJXTLSA-N 485.347 0.203 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839661164 OJUAETXWEWKSQC-JPYJTQIMSA-N 461.563 0.090 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccnn3)C2)C1 1839743422 PVXASHIJDBMKTK-CQTHNFAISA-N 472.452 0.620 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1)C(C)(C)C 1840030586 PPQGTRONFVYMMS-OHNRDTAOSA-N 462.385 0.777 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCOCCOCCOC)CCO2)C1 1840077785 LLRJQEWYMPSGEV-XLIONFOSSA-N 450.960 0.530 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS(=O)(=O)c3ccc(C)cc3)C2)C1 1840151424 AZXMSKSCXLITSO-WIYYLYMNSA-N 488.990 0.479 50 20 JCGD O=C(NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2)c1cccs1 1840186731 UANJUSCCONPJDR-QGZVFWFLSA-N 450.344 0.738 50 20 JCGD CCOc1c(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cnc2c1cnn2C 1844264072 ARLXVEFGRMXMBB-UHFFFAOYSA-N 478.513 0.496 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)n(C)n1 1845038425 ATSSBPLAHUKBMK-UHFFFAOYSA-N 469.546 0.592 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)COc2cccc(N3CCCC3=O)c2)cc1 15709739 OLYKEGWGFSDKLI-UHFFFAOYSA-N 474.539 0.969 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2C[C@@H](O)CN2C(=O)c2ccc3c(c2)CCC3)n1 728730838 XVIZRGNCUVDPJL-MSOLQXFVSA-N 486.550 0.449 50 20 JCGD C[C@H]1COCCN1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 729615017 VWORTZQUNAYWOF-KRWDZBQOSA-N 475.571 0.830 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)CCOc1ccccc1 747180532 AWNUXPBFGHQXNO-UHFFFAOYSA-N 463.512 0.946 50 20 JCGD Cc1ccc(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)cc1 760103141 MJQCCKWJFDBEIS-UHFFFAOYSA-N 454.530 0.362 50 20 JCGD CN(CC(=O)NNC(=O)c1ccc(CSc2nncn2C)cc1)S(=O)(=O)c1cccnc1 916102498 ZBNRKWOLVRCHAE-UHFFFAOYSA-N 475.556 0.584 50 20 JCGD O=C(Cn1cnc2ccc(Br)cc2c1=O)NNC(=O)c1ccc(-n2cnnn2)cc1 916144761 KTZNBTXEYVMFEF-UHFFFAOYSA-N 469.259 0.596 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cccc(O)c1O)c(=O)n2Cc1ccccc1 916331850 MAFULZQGWSWULY-UHFFFAOYSA-N 462.466 0.989 50 20 JCGD CN(C)CCCNC(=S)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916546092 GUGFDMQVFFRVIH-UHFFFAOYSA-N 457.622 0.087 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C/c1cnccn1)c(=O)n2Cc1ccccc1 918257466 YJEBLVJGMBVAPE-CMDGGOBGSA-N 474.481 0.079 50 20 JCGD Cn1c(=O)n(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c2ccccc21 1778165206 RHGWZEAVTZTVPV-QFBILLFUSA-N 469.311 0.860 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1778344684 AVGDZYLXWINAAX-VCAMNPENSA-N 459.971 0.919 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ccsc4n3)C2)C1 1778629155 WPXBMTRJZCADRG-FQEVSTJZSA-N 455.500 0.152 50 20 JCGD Cc1ccc(C)c(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779034889 WGLUNUKMCRMCAI-XMMPIXPASA-N 451.527 0.988 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3c(c1)OCO3)C2 1779373507 XANPECTWEXUMJA-HYBUGGRVSA-N 481.509 0.855 50 20 JCGD Cc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(-n2nccn2)c1 1780240277 IGUMWTJRLMBUPG-DEOSSOPVSA-N 475.314 0.013 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780939372 YUTGXKUYNZDXAO-KUHUBIRLSA-N 485.404 0.895 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc2ccc(F)cn12 1781381315 JIIFCSFPWWIDQO-HYBUGGRVSA-N 480.305 0.595 50 20 JCGD O=C(Cn1cnc2ccccc21)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782100065 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COc1cncc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788611743 XYRZPDONFRLWMV-NDXORKPFSA-N 482.541 0.315 50 20 JCGD O=C(NC1(c2ccc(NC(=O)c3cc(=O)nc4cccnn34)cc2)CCC1)c1ccc(B(O)O)cc1 1790032909 YFWRIIHWOZIPQC-UHFFFAOYSA-N 483.293 0.831 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878310 QZFVAENQSNBZHY-QMHWVQJVSA-N 496.026 0.389 50 20 JCGD CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)CC1 1793906218 JDCUNEICFIGGAZ-QKPAOTATSA-N 459.971 0.986 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(S(C)(=O)=O)cn1 1794749538 OKRRXEVFISZXLB-QDMKHBRRSA-N 451.549 0.110 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(F)cc1F)C2)c1ccc(B(O)O)cc1 1795732909 QKXNFECLRQKBDZ-JMJLSGOLSA-N 456.254 0.561 50 20 JCGD O=C(/C=C/C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)NCc1ccco1 1796188633 ASRQQMKNXDBKFB-MMLHABCJSA-N 451.288 0.084 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nn1)C2 1796441741 XEAYBDWDRCSESH-CNKKGNCFSA-N 459.894 0.467 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Br)C2 1796446306 RQEBQLJAMMLXSE-ATDFFDOOSA-N 454.325 0.493 50 20 JCGD Cc1ccn(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)n1 1799094851 CXMDWMOZISVHLN-JHDGKUDLSA-N 483.573 0.127 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)C#N)C2)NC(=O)NCc1ccccc1 1799095325 NTKHZWZWXJAANC-OPVJXMOQSA-N 456.547 0.472 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097967 XURIBRWDJUHJFT-IRJINJETSA-N 497.600 0.505 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)cc1 1800278615 ZBEFOCQYAOWWRK-HPNQWNLUSA-N 467.950 0.281 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O)C2 1800638962 FHCGYMIBCSFANZ-QPHKQPEJSA-N 461.382 0.552 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Br 1800756734 DGVQSCVFALTNMI-ATDFFDOOSA-N 454.325 0.493 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1802879952 OLJQKGBMTLZTIB-DBVUQKKJSA-N 467.530 0.314 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1F 1803883223 UQDDVTGUXLNUBF-BCDXTJNWSA-N 474.319 0.475 50 20 JCGD COCc1oncc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808821394 NUDPPJUKRRUDEY-DYESRHJHSA-N 464.287 0.529 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1813072191 BBPSZZAEFMFRLQ-SLWLNILOSA-N 456.591 0.801 50 20 JCGD Cc1nn2cc(CC(=O)N[C@@H]3CCc4nc(NC(=O)c5cccc(B(O)O)c5)sc4C3)nc2s1 1815350576 YHMSGTLNIMXMAQ-CQSZACIVSA-N 496.383 0.704 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815356982 XPLPYOKNYTVSRK-SWLSCSKDSA-N 466.332 0.339 50 20 JCGD C[C@H](CBr)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816669164 YFZZSMGGBFCPTI-SFYZADRCSA-N 481.336 0.526 50 20 JCGD O=C(Cn1cc(Cl)cn1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1817502477 RHJHLBBCRFGLJD-QGZVFWFLSA-N 456.699 0.946 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1824524842 QWACXAHUULKZGP-OXJNMPFZSA-N 464.393 0.280 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1824556109 PPIZJUNAHWVHPP-KBPBESRZSA-N 487.586 0.642 50 20 JCGD Cc1nnc(CC(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)s1 1826085406 RHCQPPCXBGHEQE-NSHDSACASA-N 451.578 0.831 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnc3ncccn23)CC1 1828247925 JOJZTHCQAGUZCD-FQEVSTJZSA-N 461.331 0.956 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830743748 SYCMYISCBXKQJF-QEEYODRMSA-N 463.959 0.203 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCCC1(F)F)CCO2 1831726801 UMSPLXOTGRMKOL-JXFKEZNVSA-N 460.522 0.641 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1831999103 PRZXMBMLMQJWHP-QYWGDWMGSA-N 475.970 0.512 50 20 JCGD Cc1cc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)n[nH]1 1832549443 PGBSHSZCODAGLI-JTSKRJEESA-N 499.996 0.849 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnc3)CCO2)C1 1832667883 JOVCJFWXDZWYMX-KXBFYZLASA-N 456.337 0.948 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(F)nc3F)CC2)CC1 1833017622 WCFNKCHJHJLVMT-UHFFFAOYSA-N 466.533 0.918 50 20 JCGD O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833028144 KZYUZALJBXKFFB-WYRIXSBYSA-N 475.329 0.253 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cocn1)CCO2)NC(=O)NCc1ccccc1 1834511029 ZQZIIFPCBKMAHD-HSZRJFAPSA-N 486.529 0.091 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834800690 YYAJAMCUOXUVLL-QGZVFWFLSA-N 467.379 0.318 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737276 DIOLVVSCYYSRPY-QGZVFWFLSA-N 482.589 0.403 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCc3cnccn3)CC2)CC1 1835737383 NGBKVEHQHYDXEO-UHFFFAOYSA-N 480.573 0.293 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738230 NPJGYGNHTQHULT-HNNXBMFYSA-N 490.561 0.432 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc4sccc4c3O)C2)C1 1835932262 XADIFISBTXBATI-DEOSSOPVSA-N 496.350 0.671 50 20 JCGD COC(=O)C12CCC(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)(CC1)CC2 1836705993 FTKHTQRIYOLDEN-RQTSHOTFSA-N 472.966 0.556 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1836841965 SAJWBQRMXKNBTA-DEOSSOPVSA-N 484.557 0.381 50 20 JCGD C[C@H](Sc1cccs1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1837230711 BBFWIGCAFJNQNH-KSFYIVLOSA-N 490.412 0.679 50 20 JCGD CO/C=C(\C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1837264070 JIEYZHGLNCXWOH-SIAYCOCNSA-N 489.573 0.339 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3F)C2)C1 1837460112 VOYUPINOFKQJRO-QFIPXVFZSA-N 457.462 0.208 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3nn(C)c4c3CCC4)CC2)CC1 1838247128 GUUVZJCSGHAADL-UHFFFAOYSA-N 474.606 0.894 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n[nH]1 1838662680 AXNMXOWBTVZUPZ-XMMPIXPASA-N 499.572 0.134 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1839044318 YWVNXCSSYJWEQL-HRAATJIYSA-N 485.006 0.755 50 20 JCGD CC(C)CC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839053992 AFNXPSNOZVCEPB-DEOSSOPVSA-N 475.590 0.835 50 20 JCGD COc1nccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1F 1839199831 VQIXLICYYCMEJB-DYVFJYSZSA-N 464.263 0.990 50 20 JCGD O=C(Cn1nccn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839238121 VLDOBZTZHNNXNP-RXVVDRJESA-N 492.374 0.741 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839518610 UTXHZYFEXQLMRE-RBUKOAKNSA-N 461.346 0.972 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cnc4ccccc43)CCO2)C1 1840102971 FGSWKPHGQQKXQW-IERDGZPVSA-N 450.923 0.747 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC[C@H](C(=O)OC)C1)CCO2 1840148827 XSROFAZDANJCKL-NWZZKEMCSA-N 460.955 0.676 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1 1840153311 KBAKIOMARGTDHW-IIBYNOLFSA-N 451.907 0.505 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCC(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1841434220 MNCCVQQLBGRLFQ-HNNXBMFYSA-N 463.959 0.347 50 20 JCGD CN1CCN(CCC(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)CC1 1842828675 LZIRJBGVLVJUDH-UHFFFAOYSA-N 485.633 0.174 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014818 FGWFRFBDQMNPQL-DEOSSOPVSA-N 489.353 0.923 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)CN1CCS(=O)(=O)CC1)C2 1844692068 CASRTHRODUYCJQ-UHFFFAOYSA-N 494.526 0.068 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@]23C[C@H]2CCN3C(=O)OC(C)(C)C)C1 1846192226 BWNRIHICINAEKK-MWTRTKDXSA-N 463.579 0.962 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H](C[C@H]1CCOC1)NC(=O)OC(C)(C)C)C2 1846384899 WXKKNURXCOAWRO-MSOLQXFVSA-N 495.621 0.883 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCCCCC2)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 9930788 WKPXRVVTPRIECL-QGZVFWFLSA-N 471.601 0.766 50 20 JCGD COc1cc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc(Cl)c1OCC(N)=O 10471216 GAYOHGQXGCECKG-UHFFFAOYSA-N 498.945 0.603 50 20 JCGD CN(c1ccccc1)S(=O)(=O)c1ccccc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 15639657 IQJMIHLFJIDPFO-AWEZNQCLSA-N 451.526 0.707 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=S)NCCc2cccs2)c1 21125497 AFWBUPXCTIFARZ-UHFFFAOYSA-N 469.614 0.466 50 20 JCGD COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)c1ccccc1F 21190670 NDRAYZWUGDZHET-MRXNPFEDSA-N 451.476 0.829 50 20 JCGD Cc1cc(C)n2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)c2n1 23109089 JRUKLXHOTCJZDD-UHFFFAOYSA-N 458.500 0.442 50 20 JCGD CC(C)C[C@@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CNC(=O)c1cccs1 725740087 AVICWOJYEMQXHT-CQSZACIVSA-N 477.568 0.779 50 20 JCGD Cc1nc2c(c(C)nn2C)c(C)c1CC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 728329522 QOFKFNMYFXAIBC-SFHVURJKSA-N 467.482 0.967 50 20 JCGD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 729051969 CMGOEOLWBBSAEQ-CQSZACIVSA-N 461.548 0.693 50 20 JCGD CC(=NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCCC[C@H]2C(=O)O)cc1 730576423 FNNUJTLNUVKWIR-WBVHZDCISA-N 471.557 0.589 50 20 JCGD O=C(NNC(=O)c1ccc(Cl)c(S(=O)(=O)NC[C@@H]2CCCO2)c1)C(=O)N1CCCC1 748246526 BZDMEFCKYABKKD-ZDUSSCGKSA-N 458.924 0.181 50 20 JCGD O=C(Cc1cccc(F)c1)NCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 749019083 UWTXRVYOJGGXJF-UHFFFAOYSA-N 491.545 0.913 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H]1CCCN1S(=O)(=O)c1cccs1 749161203 JWFMMUKUAKKHSR-CYBMUJFWSA-N 485.613 0.964 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1OC 756831668 JOESJJUGNVSUPN-UHFFFAOYSA-N 477.495 0.862 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@@H]1CC(=O)N(C3CC3)C1)N(S(C)(=O)=O)CC2 886212480 XFCRJCADZXLWQW-PBHICJAKSA-N 494.570 0.111 50 20 JCGD COc1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1OC 915886799 FRBVIZLQWXDVRA-UHFFFAOYSA-N 492.554 0.911 50 20 JCGD CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@H](C)C1)c1ccc(S(=O)(=O)NCC(=O)O)cc1 916366333 TYMOZPZRSCGETG-KFWWJZLASA-N 454.549 0.635 50 20 JCGD COc1ccc(C(=O)NNS(=O)(=O)c2ccc(OC)c([C@@]3(C)NC(=O)NC3=O)c2)cc1OC 917717580 JYTMPQXNJBUWCZ-HXUWFJFHSA-N 478.483 0.390 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)Cc1c(C)[nH]c(-c2ccncc2)nc1=O 917917488 BAFBUIWFKMRTQH-UHFFFAOYSA-N 469.527 0.746 50 20 JCGD COc1ccc(C(=O)NCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 918221730 MKGGNSWLSVIEMS-UHFFFAOYSA-N 468.558 0.968 50 20 JCGD COc1cccc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)c1O 919755672 RAMLVCDEFCLGHI-UHFFFAOYSA-N 452.489 0.868 50 20 JCGD NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 920033132 VRCZGZQPGFJBRQ-ZCTDBXRUSA-N 474.481 0.227 50 20 JCGD O=C(COc1ccccc1F)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 920048355 ABCIPDFYUXEGPA-UHFFFAOYSA-N 455.424 0.422 50 20 JCGD COc1ccc(N(C)S(=O)(=O)c2cccc(C(=O)NNC(=O)CN3CCCC3=O)c2)cc1 920827157 RRUYSQULSFCYGJ-UHFFFAOYSA-N 460.512 0.904 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1)N1C[C@H]2C[C@H]2C1 1778863291 ZBLQCZJODNKZPR-QSAXNBNMSA-N 498.628 0.503 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)Cc3cnc[nH]3)CCO2)C1)NC(=O)NCc1ccccc1 1780970083 RKISFEDNBVDFDK-QHCPKHFHSA-N 469.546 0.128 50 20 JCGD COc1ccc(F)c(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1OC 1781823866 WBXZLWDKSLKWMH-QHCPKHFHSA-N 487.488 0.599 50 20 JCGD CN1CCCn2nc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)CCC(=O)NN(C)C)C3)cc2C1 1782213503 WPXGFLRBSPLNBX-HYBUGGRVSA-N 489.621 0.219 50 20 JCGD C[C@@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1783252407 DIGLUKUFKXUCHT-RQBNJVACSA-N 487.601 0.692 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(=O)c2ccccc2o1 1783824244 QXFMGNWHNPNTAM-NVVBAYIOSA-N 476.294 0.380 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)OC)CCO2)C1 1783870379 BFTXZECJVOWLIO-YUWJWYLASA-N 477.986 0.998 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)C[C@@](C)(O)CC(=O)O)C2)C1 1783929615 IGAYSFHLNXSZLS-YADHBBJMSA-N 493.469 0.579 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3CCN(C(=O)OC(C)(C)C)CC3=O)C2)C1 1785669854 QHOHJZDUMPZGOV-KSFYIVLOSA-N 486.997 0.913 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1786381194 JAXMLRGKBCBTGD-OAHLLOKOSA-N 458.345 0.795 50 20 JCGD Cc1ccncc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984687 YNXXTBUZMDWTKO-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4cc(C)ccn4c3=O)[C@H]2C1 1788045091 CRKUZODQYSXPGD-OWLYRPNTSA-N 462.934 0.850 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc2cnccc12 1788381227 UCZJEAJUVFTOHM-TZYHBYERSA-N 459.311 0.822 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS[C@H]3CCCCO3)[C@H]2C1 1788644513 MGYGKLJDMMLZCI-RNVRALISSA-N 477.587 0.538 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3C(=O)Cc4ccccc4C3=O)C[C@@H]21 1791249829 QPBGDKFWKWZRKQ-LEAZDLGRSA-N 491.972 0.835 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c([N+](=O)[O-])cc1O 1791291013 WEYRSRRPBMWPGT-RFUYNDQBSA-N 493.517 0.275 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 1795894853 KPRRLFXJQADURN-FQMQPWHVSA-N 459.971 0.964 50 20 JCGD COCc1oncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1796687118 VBKWUBUOHHOAKJ-POKDIBPUSA-N 458.475 0.158 50 20 JCGD CN1Cc2ccccc2C[C@@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798440828 XLHHILUWQZMSEZ-VQQMMKBISA-N 462.554 0.994 50 20 JCGD 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COc1ccnc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1807360916 MIPVJHNODXRGJX-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]cnc4n3)C2)CC1 1809963834 XKPZMWMELBTKEP-RWPZCVJISA-N 493.528 0.396 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810307527 DNAWUKQFZVCHRZ-BLIXFSHQSA-N 476.541 0.933 50 20 JCGD O=C(C#CC1(O)CCCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810326666 GUUIBDSJKRZZGB-URXFXBBRSA-N 475.354 0.780 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(=O)Nc1cccnc1 1810462701 LOOGMWXMTVRKST-RXVVDRJESA-N 473.298 0.115 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1CC(c2ccccc2)=NN1 1812305912 DYGKRKKFRNXCSX-FTBPSBKWSA-N 497.364 0.847 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)C#CC(=O)O)[C@H]1c1cccnc1 1812878826 MHKBCSDQWNFYIL-ZGFVEPFRSA-N 450.455 0.309 50 20 JCGD 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CNc1nsnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1829756139 SXNJXUVKTKKOPB-HZPDHXFCSA-N 452.364 0.886 50 20 JCGD O=C(c1nc(-c2ccccc2)ns1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830722468 CCOXTQGQHUMSLW-FOIQADDNSA-N 466.947 0.875 50 20 JCGD CCOc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cnc2c1cnn2C 1830723801 QHFZOBVSTPXAFY-IIBYNOLFSA-N 481.937 0.037 50 20 JCGD O=C(c1csc(C(F)(F)F)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830731543 LGBHWXIGLIBHNJ-ABAIWWIYSA-N 457.858 0.832 50 20 JCGD N#Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccc1Br 1830733331 IPXUQQYRPXOIKJ-LPHOPBHVSA-N 486.750 0.990 50 20 JCGD CC(C)(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1830778803 JVJGCIITZVKVFX-VFNWGFHPSA-N 477.986 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(Cl)s1)CCO2 1832607637 OVYZYDQUFAJASF-FQEVSTJZSA-N 472.995 0.773 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833313684 NAABFZBFXAWZNZ-ZWKOTPCHSA-N 491.029 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1837868555 HAHDIQYRFSDXOJ-HRAATJIYSA-N 483.953 0.679 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)n3cncn3)CC2)CC1 1838102844 DRTSAOVPADWGSJ-DCMOEJRUSA-N 484.561 0.972 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)S)C2)C1 1838528141 HJNFGMDEEKFZMU-RNODOKPDSA-N 467.500 0.908 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1839154845 ZXIQZIQLUXHPBD-RTBURBONSA-N 461.346 0.972 50 20 JCGD O=C(c1cnnc(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198131 UZZUUQFZWFVEJX-WFASDCNBSA-N 451.680 0.891 50 20 JCGD Cn1ncc(Br)c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201416 XEQVDKRMEZVCEQ-SWLSCSKDSA-N 498.147 0.943 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc2c[nH]nc12 1839512215 QFZWDFPWPWPSIX-QHCPKHFHSA-N 472.546 0.314 50 20 JCGD CN1CCCn2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)CO[Si](C)(C)C)C4)C3)cc2C1 1839622164 OMWHOGXSFVMAJN-QFIPXVFZSA-N 479.654 0.640 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(CC(C)C)nn3C)C2)C1 1840151961 SIYXSTPLSWFGPL-UTKZUKDTSA-N 456.971 0.942 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1C 1840182535 NAVTVGBHQYWNDC-XMMPIXPASA-N 460.575 0.675 50 20 JCGD CC(C)(C)OC(=O)NCc1ccnc(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1842256478 JADPADXNTFBFOG-UHFFFAOYSA-N 494.357 0.917 50 20 JCGD C/C=C(\C)C(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C1 1843428596 CHLUNVPJXCEALC-WHYRTXPLSA-N 485.390 0.972 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CCc2nc(N)n[nH]2)C1 1844182493 NVNNHJKJQLOIKA-LBPRGKRZSA-N 455.947 0.655 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@@H](C(=O)N1CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C1)C2 1844265075 RZEYJGDXEBKOAB-OAHLLOKOSA-N 495.540 0.138 50 20 JCGD COc1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c(O)c1OC 1845425577 BMROECWRYOGTPJ-UHFFFAOYSA-N 455.471 0.539 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)O)C1 1847092849 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COc1ccnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1779699867 OFIBVWBEJUHBBY-NFBKMPQASA-N 453.304 0.211 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781333580 IKLGKIJZKLFOTK-DOTOQJQBSA-N 455.321 0.577 50 20 JCGD COC(=O)[C@H]1CCC[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1782170132 XZDROLIZZPHEJC-XDSPWSPCSA-N 486.374 0.473 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC[C@H]2CCOC2)C1 1782771744 UHDHVJODCUWZFE-XKDCRVNJSA-N 459.547 0.629 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccnc3S)[C@H]2C1 1783548443 ZXDAFQVCJWIITR-ZLIFDBKOSA-N 456.528 0.276 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1783663886 PPWOWFVKMACCKR-APWZRJJASA-N 465.385 0.917 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784091310 ZUZMIEGZXKESEA-RBZJEDDUSA-N 463.959 0.106 50 20 JCGD CC(=O)NCC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1784643401 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CC[C@@H](N)C(N)=O)C2 1794142865 ZZEYCFUVFVFWOU-KHMAMNHCSA-N 459.975 0.350 50 20 JCGD CC(C)(C)OC(=O)N[C@H](Cc1cccnc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1794155700 RSOWLIJKGHKPAH-MTHXSQLBSA-N 496.992 0.707 50 20 JCGD CC(C)n1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1C(=O)O 1794758143 YLKSSDOOWIPMFK-BTTYYORXSA-N 469.502 0.726 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(C(F)(F)F)o1 1795732480 LLFRAYGPOHSDKK-XOIINTDNSA-N 466.221 0.804 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCCCC3)cc1)C2)c1ccc(B(O)O)cc1 1795736241 QMUBFKCCDCQHJE-RUMRUAAYSA-N 477.370 0.874 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1c(=O)n(C)c2ccccc21 1797172917 MDXUNQITXXHQRY-YGTYGHESSA-N 450.923 0.183 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2 1800839355 DKLDMMQFBGMNPU-XRGAULLZSA-N 455.321 0.336 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]2c2cccnc2)nc1 1803141161 LSLLSKAJYZLZTJ-ZTFGCOKTSA-N 466.947 0.799 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1 1804596607 BSZWYZIWYHYSFO-ACDBMABISA-N 466.299 0.484 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(O)cn2)[C@H]1c1cccnc1 1806106805 LOKZDAURSJBZEN-FOIQADDNSA-N 461.482 0.814 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)CCBr)[C@H]1c1cccnc1 1806342370 HDWYPAYECLRVIB-FVQBIDKESA-N 457.325 0.937 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374760 MMWHVEZNTWFPPG-WIYYLYMNSA-N 460.299 0.302 50 20 JCGD COc1ccnc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1OC 1807375822 QJVISJIINUXCOC-GCJKJVERSA-N 490.325 0.807 50 20 JCGD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc(O)n1 1807375876 QTPPNOVSXHKKNP-GCJKJVERSA-N 460.299 0.804 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1807645142 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Cc1nn(C)c(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c1F 1817471100 RRSGYXIWYZYRDN-INIZCTEOSA-N 454.271 0.890 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccnc4c3OCO4)sc2C1 1821235279 FOVJZHMKTCFGHR-LLVKDONJSA-N 460.516 0.866 50 20 JCGD C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(CCO)CCO)CC2 1822870202 URVLJXTYBNQBQK-PIGZYNQJSA-N 453.392 0.578 50 20 JCGD CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1824472457 PKKVQBAJBHUXDV-PMDBQALLSA-N 457.516 0.407 50 20 JCGD C[C@@H](CBr)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(O)O)C2)C1 1828539800 QJOJVBYKJBPMOX-BTYIYWSLSA-N 498.374 0.780 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830365770 HKGJHKPJPZXKJH-KSFYIVLOSA-N 466.966 0.921 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1830539831 IXJHAOAXVHINLD-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C1CC1 1830727759 DEIUKHSNFRLXOS-QYWGDWMGSA-N 475.970 0.346 50 20 JCGD Cc1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)cn1 1832549146 GMFCMZFCVUDZHP-HTAPYJJXSA-N 497.980 0.987 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833028482 PUEVUYIQUVDSAQ-KQHSUYLTSA-N 499.362 0.233 50 20 JCGD CN1N=C(C(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)CCC1=O 1834422488 PCSJXAPOOMSPNO-UHFFFAOYSA-N 456.385 0.951 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccccc3O)CC2)CC1)c1ccc(B(O)O)cc1 1834799206 QJCDMKMWLPIFRV-UHFFFAOYSA-N 465.359 0.500 50 20 JCGD O=C(Cc1cccnc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834878542 GPTAXLNEQABHRW-UHFFFAOYSA-N 450.348 0.189 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)Cc3ccccn3)CC2)CC1 1834889498 DJMNASKQWGTPKV-UHFFFAOYSA-N 465.558 0.508 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccnc(Cl)n1 1835909680 SEWBLRBXCOSVHP-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccnc4c3OCO4)CC2)CC1 1836092571 ATQDIPHHDDHMKO-UHFFFAOYSA-N 495.540 0.308 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C)CN(C(=O)OC(C)(C)C)C1)CCO2 1836726986 WCBWOSZAQWRYHK-AOMKIAJQSA-N 489.997 0.954 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4O3)C2)C1 1837461304 UDBRZEMMWDKDEZ-OFVILXPXSA-N 495.536 0.149 50 20 JCGD O=C(C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccc1 1837621578 CDOGRZIQSUEZOQ-UHFFFAOYSA-N 464.327 0.862 50 20 JCGD Cc1cc(C)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1838946866 JSUFOOIHJCZLHP-XMMPIXPASA-N 452.316 0.367 50 20 JCGD CCNC(=S)NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1839655182 JPNNIGCVXBAUES-DLBZAZTESA-N 455.408 0.163 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cc[nH]n3)CCO2)C1 1839719704 JUAXUCNNROZVNS-KKSFZXQISA-N 485.969 0.541 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1839964723 ARXYQMYYZKZSKL-KUHUBIRLSA-N 466.336 0.973 50 20 JCGD COC(=O)C12CC(C(=O)N3CCOC[C@@]4(CN(C(=O)[C@H](C)Br)CCO4)C3)(C1)C2 1840036565 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O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc3nnc(Br)n3c2)C1 1843126543 WADJYWYWCUQPQV-UHFFFAOYSA-N 484.119 0.302 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)CCOC1 1844264926 YTJDDOTURKTANF-QHCPKHFHSA-N 488.545 0.186 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(CC(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)=NO2)C1 1846102188 OWESKZSFRCKKPI-QVKFZJNVSA-N 470.954 0.945 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CCCC34CN(C(=O)c3cccc(B(O)O)c3)C4)C[C@@H]2C1 1846104978 AKEQXVDZTREWSM-CJAUYULYSA-N 483.374 0.831 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c1 14850708 LVKDUSDLTVPAPJ-GOSISDBHSA-N 499.567 0.247 50 20 JCGD Cc1cc(/C=C(/C#N)C(=O)N2CCN(C(=O)Cn3cnnn3)CC2)c(C)n1C[C@H]1CCCO1 725882881 GPGAZQKYBYRFBZ-DEWISIQVSA-N 452.519 0.548 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCCCCN1CCN(c2ncccn2)CC1 729229209 VOKIDDQZPSMFFZ-UHFFFAOYSA-N 460.564 0.201 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc1S(=O)(=O)N1C[C@@H](C)C[C@@H](C)C1 729274973 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nn(C)c2c1CCC2 1797048058 YVBGFMAXMXZGIF-DHMDNZFNSA-N 467.530 0.246 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2cccnc2n1 1797358186 FHDKAVVUFKWRPU-CCWDJLKJSA-N 461.482 0.145 50 20 JCGD CC(=O)NCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798523188 VJHRQDCTGUQMKV-YVWYUNDQSA-N 462.459 0.250 50 20 JCGD C[C@@H]1C[C@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097539 OGXQRMZWWUTIJB-DUZMOWEYSA-N 457.575 0.968 50 20 JCGD COC(=O)C12CC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C4)(C1)C2 1800703972 MANMSDKZQWOZBW-MIWJPFKNSA-N 471.514 0.053 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)C2 1800981771 RIOOZWUGYUNUFK-SCAKLKGDSA-N 471.982 0.943 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1 1801012408 FABHGEATOFNCLC-CWPLJXCYSA-N 461.519 0.441 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1COCCN1C(=O)OC(C)(C)C)C2 1802332641 GEBVSOCRHKZOHV-XMTFNYHQSA-N 481.594 0.634 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@H](O)c1ccccc1 1806805108 VKFCIDRZLMWECZ-ACIOBRDBSA-N 459.311 0.815 50 20 JCGD N[C@H](CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccnc1 1807370564 GWNJMWMKTGPEAG-BKULYWANSA-N 473.342 0.566 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1 1807373622 CSDGNKOQEAMOQJ-GCJKJVERSA-N 476.298 0.946 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)n1 1807398191 VXZRAOFPOXAQKW-UHFFFAOYSA-N 464.331 0.878 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cn2cccnc2n1 1809776557 FVKHWWGBGPXGBV-RXVVDRJESA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@@H]1c1cccnc1 1810305605 MZBQXHAFHKXWOE-UNWOCNEZSA-N 464.526 0.967 50 20 JCGD O=C(C#CC1(O)CCCCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810326668 GUUIBDSJKRZZGB-ZJSXRUAMSA-N 475.354 0.780 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccn(C(F)F)n1 1810907314 JYIPZPJUGCOQQQ-APWZRJJASA-N 469.257 0.986 50 20 JCGD Cn1ccc(=O)cc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1811367405 DAYUTIYTFODMLM-HRAATJIYSA-N 475.509 0.412 50 20 JCGD C[C@H](O)C(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1812857939 BAGXDCCHFPTRHI-WEYGHZABSA-N 468.558 0.814 50 20 JCGD COc1nccnc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813071282 RPUKKPAPGJIPPW-UZLBHIALSA-N 455.519 0.573 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1cncn1 1813400813 WBHLRAZJUVWFEC-IDHHARJASA-N 463.502 0.252 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(CO)c(F)c1)CC2)c1ccc(B(O)O)cc1 1815347855 SZNXGRIMUKLLRB-MRXNPFEDSA-N 469.303 0.994 50 20 JCGD Cc1noc(C)c1CC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350327 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COC[C@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cc(C)c(O)nc2=O)n[nH]1 1823370042 FYPPZRSOXHPYNN-JSGCOSHPSA-N 452.899 0.927 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@H](O)CCl)CC3)cc21 1824186481 NCDKCNNKLPPEET-FUHWJXTLSA-N 451.955 0.850 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C=C\C(=O)NC2CC2)CC1 1828791349 KVCXWLKQIYHQMI-HCZHMGAMSA-N 468.558 0.753 50 20 JCGD Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1F 1830094613 PXVSHTOIYVHURZ-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1 1830535573 QMEJLFVYUJEOLI-FOIQADDNSA-N 480.363 0.919 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C1 1830736944 CAIKERLLFGUVNC-HOIFWPIMSA-N 489.997 0.690 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832036663 UJUTWPRGTDVPQT-JLTOFOAXSA-N 463.959 0.346 50 20 JCGD O=C(CCCC(F)(F)F)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832258015 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cc(O)nc(O)n3)CC2)CC1 1835117830 OKHKZEQQMHRWSU-CCVNUDIWSA-N 498.544 0.207 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC2)CC1 1835738089 CWXGZAJOIVUGTH-RUCARUNLSA-N 472.590 0.421 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835846729 DOVSYUKQJKTEDU-SFHVURJKSA-N 479.390 0.447 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4nccc-4c3Cl)C2)C1 1835928351 LXGHSMQCGMKLQI-HSZRJFAPSA-N 498.732 0.232 50 20 JCGD CC(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835931381 PQCGPMRHXCNGKY-RUZDIDTESA-N 466.343 0.874 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933872 FPFKJWVXAWMKBV-XMMPIXPASA-N 469.347 0.014 50 20 JCGD Cc1cccc(Cl)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939712 YIAFLHDDKMDIIB-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnc4snnc4c3)CC2)CC1 1836102699 IJQURSCZWODXRV-UHFFFAOYSA-N 488.618 0.645 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1 1837457439 BJYBHBNONCFIOI-LJQANCHMSA-N 485.463 0.488 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cncc(C(F)(F)F)c1)CCO2 1838183796 HKSXZOUZKNXQBA-FQEVSTJZSA-N 487.479 0.543 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CCCn3ccnc3)CC2)CC1 1838395512 XXVKHBXTXIMXLV-UHFFFAOYSA-N 483.573 0.974 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049411 WIZJSNYVCCGSHV-UXHICEINSA-N 470.357 0.965 50 20 JCGD O=C(c1cc2cn[nH]c2cn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200196 HMEUCMMQXBPLLM-YOEHRIQHSA-N 456.272 0.718 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1839964631 XNKCEPHDNDMBSY-UWVAXJGDSA-N 469.380 0.581 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)n1 1840031679 ZIOLCUHEUOTZGJ-KUHUBIRLSA-N 456.337 0.873 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1840034696 UMDLXZCXDGFDSI-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)C2)C1 1840151522 FMSIBBKIOZLAPQ-NQIIRXRSSA-N 488.990 0.343 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCOC[C@@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840189778 LKCGJNLJVJGPQV-HXUWFJFHSA-N 457.358 0.644 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(C)CC1(F)F)CCO2 1840825382 DTFVSAKUCGBXAM-IKFBJYTDSA-N 467.473 0.622 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1 1840855201 ABUHDQJSTWVOJQ-GJYPPUQNSA-N 462.385 0.921 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840903235 XKCVUVHTYWASKD-YYFZDKIDSA-N 486.338 0.952 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C13CC(c4ccccc4)(C1)C3)CCO2 1840953516 OFQUMFNTWBLLBT-WZDPVOGJSA-N 490.365 0.558 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1841921262 DRMWFHKZLVINHM-MJGOQNOKSA-N 469.347 0.653 50 20 JCGD CC(C)[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)N1Cc2ccccc2C1=O 1843013050 CBJOCZVQIAPWJE-QFIPXVFZSA-N 475.354 0.864 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccoc2I)C1 1843136317 IPLASECDJZKXRD-UHFFFAOYSA-N 480.067 0.695 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3CCCC34CN(C(=O)[C@H](O)CCl)C4)c2C1 1843991985 BTUGWRXHLGJNEB-CQSZACIVSA-N 468.942 0.446 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCCN(c3cc(NC4CC4)ncn3)C2)C1 1845008393 IRRKRBXIFNKPIV-GOSISDBHSA-N 498.632 0.844 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H](C)Oc3ccc(F)cc3)CC2)cn1C 109593871 VDWUWNKVFBJXBV-ZDUSSCGKSA-N 467.523 0.883 50 20 JCGD C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)NNC(=O)CNC(=O)c1ccco1 725872890 SVJILISFXZDWKZ-CYBMUJFWSA-N 456.459 0.446 50 20 JCGD CN(C)N(C(=O)CNS(=O)(=O)c1cccc(Br)c1)[C@H]1CCS(=O)(=O)C1 728180309 RLMLHFJOQWFSLY-LBPRGKRZSA-N 454.368 0.220 50 20 JCGD CCC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1cc(Br)ccc1O 730568823 DBAUAANDABWHBL-UHFFFAOYSA-N 456.322 0.970 50 20 JCGD O=C(COC(=O)C1=NN(c2ccccc2)C(=O)CC1)NNC(=O)[C@H]1COc2ccccc2O1 772840582 OPOGUMAXFZQKKS-GOSISDBHSA-N 452.423 0.700 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1 822647525 QNGFZMOFMBWUHO-JTQLQIEISA-N 481.394 0.583 50 20 JCGD O=C(CCSc1ccc(F)cc1)NNC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 913035042 ARXWGRIGDMPHHP-CYBMUJFWSA-N 456.521 0.621 50 20 JCGD COc1ccc(CCN2C[C@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2=O)cc1OC 915077417 OQRAQQOHCIAZRT-QGZVFWFLSA-N 489.550 0.960 50 20 JCGD CCOc1cc(C#N)cc(Br)c1OCC(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 915141545 JZJJCMDOHFETDU-NSHDSACASA-N 460.306 0.680 50 20 JCGD CCCCS(=O)(=O)N1CCC[C@@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 915874417 FVWIHSRGXRZWJL-HXUWFJFHSA-N 465.620 0.940 50 20 JCGD CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 916227732 KQMJUNGMBGTABW-UHFFFAOYSA-N 486.554 0.906 50 20 JCGD CN1CCN(c2cc(CNC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)ccn2)CC1 916389614 ANUNQDTXNMTHDF-UHFFFAOYSA-N 450.503 0.869 50 20 JCGD CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)c1ncnc2[nH]cnc12 917906737 JPIQDANIKKQSHF-UHFFFAOYSA-N 494.537 0.729 50 20 JCGD COc1cccnc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028057 ASQHJZLMVAKKCH-QHCPKHFHSA-N 468.514 0.165 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ccccn3n1)C2 1779373563 ZEFOEBXQJJYTBO-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1 1779610981 PKILAYQNPSVQCL-QFIPXVFZSA-N 455.519 0.288 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2)NC(=O)NCc1ccccc1 1780969851 KIDMRXQAMBRADA-XLIONFOSSA-N 455.918 0.697 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(NC(=O)C4CC4)cc3)C2)C1 1781468020 YGZMBNXYQTZAHX-VWLOTQADSA-N 492.536 0.791 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781661326 UYTLMHNNYRESAL-ZJSXRUAMSA-N 499.304 0.784 50 20 JCGD COc1cc(C)c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C)c1 1781922453 PGZDIEFOXDYNBC-XMMPIXPASA-N 452.316 0.749 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)Cc1ccccc1)C2 1782214463 RBRRBQKAYYMPSM-YOSAUDMPSA-N 460.575 0.477 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1782618206 WDEFLRSKBJGJGD-CYFREDJKSA-N 474.606 0.503 50 20 JCGD CS(=O)(=O)CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783021904 DULARQCMXCIRBB-APWZRJJASA-N 473.389 0.867 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1783342163 JHTOIVSDGYWDAI-PXAZEXFGSA-N 475.365 0.455 50 20 JCGD O=C(CCc1ccc(F)c(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1783800196 PXGXBVVACDYONP-JLMWRMLUSA-N 472.297 0.871 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C[C@H](NC(=O)OC(C)(C)C)C1CC1)CCO2 1783933215 RWFCLFJHYQDVAW-UUOWRZLLSA-N 495.621 0.883 50 20 JCGD Cc1noc(C)c1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1785084508 ARTNOOVEWVSWNW-JVPBZIDWSA-N 456.503 0.126 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3nnc(C)s3)[C@H]2C1 1785323196 UUSLDIMBADPOSW-NBSPSWBDSA-N 487.586 0.893 50 20 JCGD CC(C)(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c[nH]1 1785567911 XFCBEGNPWLPXEG-VDGAXYAQSA-N 453.348 0.899 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3(NC(=O)OC(C)(C)C)CC3)C2)C1 1785716783 WNEMXXBVXZBIMZ-NRFANRHFSA-N 467.567 0.247 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc4c(c3)OCO4)C[C@@H]21)c1ccc(B(O)O)cc1 1786979470 LTLJTYBRXRDMCR-LEDOBFOHSA-N 480.326 0.321 50 20 JCGD Cc1ccn2ncc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)c2c1 1786983362 PCGWJARTBDNECU-XJABCFGWSA-N 462.315 0.230 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786985199 QBEZMCOTEDEWER-PWZKMPOXSA-N 451.332 0.234 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(Cl)nc2n[nH]cc12 1787236663 SPNKTJRDJSSKGZ-KKXDTOCCSA-N 483.721 0.198 50 20 JCGD Cc1cc(NC(=O)CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Br)C[C@@H]32)no1 1787492615 HGRDZVGLTYVJTQ-YWDSYVAPSA-N 461.288 0.982 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C#CC3(O)CCCCC3)[C@H]2C1 1788631741 ZIUUZLGWBXKHKY-INOWORCRSA-N 483.569 0.799 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1791103200 POIIANLAPUKXRC-QXKUPLGCSA-N 491.969 0.022 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795113017 JDLGDWQFSFXOQO-XYYYAOKXSA-N 482.375 0.540 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCOCC1)NC(=O)NCc1ccccc1 1795327169 PPPVVKZNDJPGJF-VTYHHJSWSA-N 473.574 0.349 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795740598 CIXQUEXIWWAGTC-DFYYWFRZSA-N 455.345 0.145 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn(C)nc1C(F)F)C2 1796440252 JQHFAVFGHSZKPV-WPLOUJSJSA-N 477.472 0.695 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]cc1[N+](=O)[O-])C2 1798524664 JAPLTNMJJVANBZ-DPIQGUFMSA-N 488.413 0.668 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(O)[nH]1)C2 1798524972 TXMLXMPLPLTDSI-DPIQGUFMSA-N 459.415 0.466 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799347503 ONASQKOOXAHZOB-SIMNAORKSA-N 458.288 0.401 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)[C@H]2C1 1800723783 LONHXUAWLIUZPQ-MCZKYTFGSA-N 487.981 0.058 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C2 1800754096 FLVVSKQLRPPHAN-NIFZNCRKSA-N 478.384 0.635 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2)C(Cl)Cl 1801015486 NJDKYWQLULJTAE-ZSBFGKGUSA-N 468.337 0.995 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1801944293 NGCBAVNUBHYOHL-ZINXYGQCSA-N 479.342 0.933 50 20 JCGD COC[C@@H](Cl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2 1802282564 JMPGFNROZFXXCI-KHMAMNHCSA-N 460.959 0.647 50 20 JCGD CN(C)c1ncc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)o1 1805343732 LVYYNUKPWLHGTG-YLJYHZDGSA-N 463.303 0.449 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1C 1805590958 IUDSHPBDUSMKQN-JXFKEZNVSA-N 462.514 0.755 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1)C(=O)C(=O)O 1806346173 APMASHBERZRMLW-XJKSGUPXSA-N 455.309 0.415 50 20 JCGD Cc1nc(N)sc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807244470 TUJNZIXRLXJMOP-FUHWJXTLSA-N 465.344 0.742 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375974 RCSQWFNUCIZJPS-XWFZLUIHSA-N 474.330 0.372 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1808410301 UTVVVJJSBMKSCF-KOIHPHJTSA-N 460.922 0.821 50 20 JCGD CCn1nccc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810298367 IALKMJMFUINOTB-OXJNMPFZSA-N 462.514 0.930 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnc(O)[nH]2)[C@H]1c1cccnc1 1810950005 FQFRORLUVHWROQ-SUMWQHHRSA-N 450.459 0.142 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(C(=O)C(O)O)[C@H]1c1cccnc1 1811357770 AQVSZAQBLIDVRS-KSSFIOAISA-N 458.427 0.545 50 20 JCGD O=C(CN1C(=O)CSC1=S)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 1814184669 CKOVSHPGSQEBNS-WOSRLPQWSA-N 456.977 0.547 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2)[C@H]1SC(=N)NC1=O 1817257329 PBPCDISHFMUOMI-AMJWSMQMSA-N 481.604 0.231 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnn3ncccc23)[nH]n1)c1ccc(B(O)O)cc1 1817471563 IJABVZYOAYOAOZ-LJQANCHMSA-N 459.275 0.752 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817474897 ILYFPICXSHQMNX-QGZVFWFLSA-N 471.323 0.920 50 20 JCGD Cc1nc2ncccn2c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1818391829 NJGYQCLKJMMRGW-OAHLLOKOSA-N 476.327 0.714 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc2cn[nH]c2cn1 1819232964 PZSJJWMGMGDAFK-IBGZPJMESA-N 459.275 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](N)c1ccccn1)CC2 1819795211 KCPDCQFGFXTREA-APPDUMDISA-N 466.527 0.462 50 20 JCGD C[C@@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825640559 AXNYLLRPHVMIHG-SKDRFNHKSA-N 452.139 0.832 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055717 IZOQDCVIRDEIJP-OXQOHEQNSA-N 464.393 0.280 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)COCCO)CC1)NC(=O)NCc1ccccc1 1830165452 HGKVCTSTGUZAMV-JOCHJYFZSA-N 489.617 0.961 50 20 JCGD CCOc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)nn1 1830543663 XRCAJDSWHWUQTE-KUHUBIRLSA-N 471.352 0.976 50 20 JCGD CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830733086 DWJZHWCPPDXBGY-QNFHRHJVSA-N 492.013 0.982 50 20 JCGD CN(CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)C(=O)OC(C)(C)C 1830738331 NDVBOSIBGRUWAB-KKSFZXQISA-N 477.986 0.690 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831157809 RUMCNCCLNDQMHU-MHECFPHRSA-N 484.383 0.617 50 20 JCGD O=C(C/N=C/c1ccco1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835777865 AGDXBLWVEJEUFE-WGOQTCKBSA-N 466.347 0.264 50 20 JCGD Cc1ccc(C)c(OCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835927164 JPXCJKZWXJBKGA-VWLOTQADSA-N 482.342 0.132 50 20 JCGD O=C(CCc1ccccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929613 YMEKWNPFWCUPAR-XMMPIXPASA-N 486.761 0.723 50 20 JCGD COc1cccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1C 1835933543 BCIXBFMQTSZVAW-XMMPIXPASA-N 468.315 0.067 50 20 JCGD Cc1nnc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)s1 1836081766 XOHVFYJXCYUTEG-HIFRSBDPSA-N 451.318 0.536 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1 1836894592 YFYLPHHUUVILCS-AUUYWEPGSA-N 466.336 0.973 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1n[nH]c3cc(Cl)ccc13)CCO2 1837086288 CCUVFMYMTWRLDJ-QFIPXVFZSA-N 492.964 0.659 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c[nH]c3cnccc13)CCO2 1837175590 MAWHAPUDXBVLFE-BATDETSNSA-N 493.524 0.767 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2 1837292701 JVAAKJHHOCVFDV-WOJBJXKFSA-N 482.331 0.963 50 20 JCGD COc1c(C)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1C 1837459953 PHHXSSDKEKXGDQ-RUZDIDTESA-N 497.552 0.694 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460085 TZSXECFWNBKFAW-BXKMTCNYSA-N 482.541 0.029 50 20 JCGD COc1ccnc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1837921240 PCYBPJKZRXEYBP-UHFFFAOYSA-N 467.331 0.696 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1[nH]cc3c1CCC3)CCO2 1838453202 YTDHZTFOYITDQJ-UJBXUPAJSA-N 482.541 0.707 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1838553134 NEMWPSKGAVSUBB-HSZRJFAPSA-N 496.536 0.286 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(F)c(F)c1)CCO2 1839009064 URSGTHJLQDETRL-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn2[nH]cnc(=O)c12 1839200641 NQJMUMNOHDKGEO-RDTXWAMCSA-N 486.298 0.092 50 20 JCGD COCCn1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)n1 1839201022 PXINYFQUUNAIRZ-RHSMWYFYSA-N 463.304 0.290 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CCO2 1839388392 PPFCEIBPXXJEOW-CKFHNAJUSA-N 494.383 0.459 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc2s1 1839523751 BMRBVDSXQUZHQO-QHCPKHFHSA-N 483.355 0.601 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839651427 DHUMJTRQRWSMKT-UGSOOPFHSA-N 457.325 0.355 50 20 JCGD Cc1nn2cc(CC(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)nc2s1 1840030872 ZEKZHQGSPUWFEZ-XIKOKIGWSA-N 486.392 0.882 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)ccn1 1840154087 LFWKPIBLVHQDGH-IIBYNOLFSA-N 469.922 0.582 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@](C)(O)CC(=O)O)CCO2)C1 1840182150 XUPUYFSWGLXCBN-MORSLUCNSA-N 465.341 0.232 50 20 JCGD Cc1cccnc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840182783 UGSUVQGIQFYBON-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COc3ccc(C(=O)OC)cc3)CCO2)C1 1840958719 WOASFGJYXNZSQY-PGRDOPGGSA-N 484.933 0.562 50 20 JCGD COc1cc(CC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc(OC)c1OC 1843013114 KIQJSVJRDAXRJJ-UHFFFAOYSA-N 468.315 0.452 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cnc3cc(C)ccn3c2=O)C1 1843787140 PYCMGZYOLUDRQU-JVWAILMASA-N 475.509 0.954 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cc3n(n1)CCNC3=O)C2 1844692206 UVANWGCIGAYQIV-UHFFFAOYSA-N 482.453 0.591 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c1ccc(C(C)=O)cc1 12267727 RWZGQBDSAMENLY-UHFFFAOYSA-N 497.913 0.834 50 20 JCGD O=C(O)c1cccc(S(=O)(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 13359474 QGKBWQAWQFJUDE-UHFFFAOYSA-N 453.498 0.793 50 20 JCGD COc1cc(C(=O)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)cc(OC)c1OC 21189849 XEJMJZSBKUXJAO-UHFFFAOYSA-N 462.484 0.554 50 20 JCGD CCCCCn1nc(C(=O)NNS(=O)(=O)c2cccc(S(N)(=O)=O)c2)c2ccccc2c1=O 22410449 RNJNGANNWRIDOW-UHFFFAOYSA-N 493.567 0.857 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)C2=NN(C)C(=O)CC2)c1 24584143 CMMKAMCHENITFM-UHFFFAOYSA-N 459.484 0.865 50 20 JCGD COc1ccc([C@@H](CNC(=O)NNC(=O)CNC(=O)c2cccs2)N2CCOCC2)cc1OC 725872814 HEMHZXNQUOQQEA-MRXNPFEDSA-N 491.570 0.899 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccc(C(=O)NC[C@H]2CCCO2)c1 726243589 NDLQUJXENBIPHY-MRXNPFEDSA-N 459.528 0.917 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CNC(=O)CCC(C)C)N(S(C)(=O)=O)CC2 727484582 NXBGHZWMHXVZIH-KRWDZBQOSA-N 498.602 0.653 50 20 JCGD CCOc1ccc(OCC)c(NC(=S)NNC(=O)Cn2c(=O)c3c(ncn3C)n(C)c2=O)c1 727492205 LOEXTGXMHHZJCX-UHFFFAOYSA-N 475.531 0.249 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@H]2Nc3ccccc3S(=O)(=O)N2)c2ccccc2c1=O 727752723 IJROTIAVTDYCTC-KRWDZBQOSA-N 456.484 0.298 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)c(Br)cc1Cl 728510741 RWSHDKSLBCSONU-ZCFIWIBFSA-N 492.757 0.136 50 20 JCGD C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cccc(OC(F)F)c3)CC2)C[C@H](C)O1 728598675 LCKWSVCGAHPKHL-KBPBESRZSA-N 491.517 0.614 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl 729274881 GKRZIEDJICNXAP-NSHDSACASA-N 466.969 0.213 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1c(C)nc2[nH]n(C)c(=O)c2c1C 729282471 YOJUHRGVIWIYJI-UHFFFAOYSA-N 473.559 0.874 50 20 JCGD CCCS(=O)(=O)c1ccccc1S[C@H](C)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 730532884 BTYIKXHAXPEAIH-OLZOCXBDSA-N 463.603 0.868 50 20 JCGD Cc1cc(NC(=O)[C@H](C)SCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)no1 785298879 NOUYCHOXOZAJNJ-WFASDCNBSA-N 478.483 0.574 50 20 JCGD C[C@H]1CN(C(C)(C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C[C@H](C)O1 916234725 PGKCIWOLVFBHAG-GJZGRUSLSA-N 455.581 0.769 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)CNS(=O)(=O)c2cccc(Br)c2)cc1 916830536 FMVFMUGMZOFOFJ-UHFFFAOYSA-N 469.317 0.822 50 20 JCGD COc1cccc(C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)c1O 919755563 CFZLYJYHNMEOLV-ZDUSSCGKSA-N 452.489 0.868 50 20 JCGD Cc1cc(N2C[C@@H](C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)CC2=O)ccc1Br 919884061 DPTPEHAKGNHVSH-NWDGAFQWSA-N 473.349 0.628 50 20 JCGD Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919885794 RGRHVQKTSDUJKG-INIZCTEOSA-N 480.568 0.605 50 20 JCGD N#Cc1cccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779028702 IODKEKDRVYOIAJ-XMMPIXPASA-N 462.510 0.633 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1779351245 OEVPSXYMDDXUGK-IBGZPJMESA-N 451.210 0.471 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)nc1)C2 1779372657 UAXRWQXWYJAFII-VGOFRKELSA-N 456.478 0.661 50 20 JCGD C[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559244 FUTOHSPSVPLRLX-GEQKSPFYSA-N 461.563 0.227 50 20 JCGD CC(C)=NO[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1780803849 MGSBITPAYAQBAO-YBOAYWMSSA-N 460.535 0.614 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(=O)cco1)CCO2)NC(=O)NCc1ccccc1 1780968704 DIQFUGNCNVMQCE-XMMPIXPASA-N 483.525 0.430 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](O)CCNC(=O)OC(C)(C)C)C2)C1 1781342986 QMKJQWVPFIKMHM-MDOVXXIYSA-N 463.959 0.346 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCN(C(C)=O)CC1)C2 1781901480 ORBMHWKNEQUIGJ-DBXWQHBBSA-N 487.439 0.838 50 20 JCGD COC(=O)c1ccc(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1782338257 WYNFTZCAUGGHNO-ATIYNZHBSA-N 494.353 0.523 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782626591 HDXCVLNJXMEXDC-FCORRRHLSA-N 469.546 0.579 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Cl)cc1)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1783723032 MNAPATOHIBQHLU-LPHOPBHVSA-N 494.397 0.438 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)OC)CCO2)C1 1783879745 XODNSBRZLUMCDQ-PDSXEYIOSA-N 491.969 0.527 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)CC(C)(C)C(=O)OC(C)(C)C)CCO2 1783935929 YGQIKZYOXGJYAJ-HSZRJFAPSA-N 468.595 0.947 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc(OC)c1C 1783937391 IRCCWAHHRQBXGY-HSZRJFAPSA-N 462.547 0.829 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCn3c(=O)oc4ccccc43)C[C@@H]21)[C@@H](O)CCl 1784086185 WNRCZSBNPFVIQY-DNUAJFIVSA-N 451.907 0.564 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cc(F)ccn3)[C@H]2C1 1785239864 NRXJXXOVRBKZRK-GKCIPKSASA-N 470.505 0.445 50 20 JCGD Cn1ncc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)ccc21 1786979641 GTQBMAUFCHJMSL-XJABCFGWSA-N 462.315 0.160 50 20 JCGD CCC[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)n1cccc1 1786979803 IHNFPKHGOPWUFC-UVUJQTEASA-N 453.348 0.803 50 20 JCGD Cn1ncc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)cccc21 1788065385 MQSBYWMNDGLSMK-BUKVSMQUSA-N 462.315 0.160 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1[C@H]2Sc3ccccc3[C@@H]21 1788622913 VVHIWKHVARVTIW-FOOHHUQRSA-N 478.379 0.848 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CO[Si](C)(C)C)[C@H]2C1 1788764031 KEJLYQMNAKNTOI-FHWLQOOXSA-N 460.644 0.887 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(Br)cn1 1788833583 KTPHVSYKGHGHSN-FNHZYXHNSA-N 488.147 0.431 50 20 JCGD Cn1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(C(F)(F)F)n1 1788897033 VCRKDXRTOQQMBF-PJODQICGSA-N 495.462 0.345 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]3C2)cn2[nH]cnc(=O)c12 1789924748 USLIGEOJZRHWMO-NHULGOKLSA-N 470.299 0.615 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791286386 FMOWBUIFYKMOHM-UMGGQSCQSA-N 460.579 0.344 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C#Cc1ccc(Cl)cc1 1792836676 SRKKXOWZYLPGQP-VPTLXERWSA-N 467.913 0.593 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2 1792868194 QVCFCGWXMZKGQB-RMEBNNNOSA-N 478.384 0.493 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1792920269 ZNXDIHOGBORDID-WKCHPHFGSA-N 491.353 0.399 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1793093285 FPOWYQFQTHIAEO-NXIXHYNASA-N 456.348 0.988 50 20 JCGD CSc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795740666 HHVFLPLGGZWBSP-OPMZPASUSA-N 454.357 0.534 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)C1 1796187733 AILPXADHHAFNHX-ACDBMABISA-N 469.347 0.795 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nc(O)c1)C2 1796440693 YHLRJJZKTXBMHT-WVNFENISSA-N 454.487 0.433 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCc1ccccc1)C2 1797750707 PSMXPYAQMMLFQX-UPHUGPLXSA-N 453.499 0.105 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCN1Cc2ccccc2C1=O)c1cccc(B(O)O)c1 1797761803 ISUZFEOFYVARPM-WKCHPHFGSA-N 461.327 0.664 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cncn1-c1ccncc1)C2 1798440614 FLKFSMOKWIGUKN-ACHSLPGTSA-N 460.498 0.831 50 20 JCGD COC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1799426925 ACYBRSJMLCXJGE-XEMDLRDOSA-N 467.287 0.062 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Br)cc1O 1799475986 UWUZAQYKSWVKLJ-HBCWATKFSA-N 489.131 0.352 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1ccccn1 1800201060 DYMAJPLQPQGASL-LBKYZSNHSA-N 467.364 0.821 50 20 JCGD CCN(CC)C[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1800220822 IFYZCTJLMDOODX-PWIWSCCXSA-N 460.579 0.688 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2 1800640344 SNMXUIYZROUKOE-OCVGTWLNSA-N 474.377 0.862 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1800759777 HRZGYIDBHSJDFN-RMRDIRSESA-N 496.406 0.706 50 20 JCGD CC(=O)NC(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803594273 UACVSKYDJIKXFQ-APWZRJJASA-N 467.530 0.314 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)[C@@H](N)CCC(N)=O)[C@H]1c1cccnc1 1807041805 FQCDTMBTMYLZKM-JJAZEVLHSA-N 454.369 0.711 50 20 JCGD Cc1[nH]nc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1F 1807369593 PJUJAZRJWNQONG-UZLBHIALSA-N 451.267 0.565 50 20 JCGD N=C(N)SCCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807371135 QTSSDDKNHYTCPF-APWZRJJASA-N 455.349 0.098 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374307 YRULRNWSXLCFCJ-WIYYLYMNSA-N 475.314 0.374 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc3ncnn3c2)[C@H]1c1cccnc1 1810060399 PBTOBEKSLCNMHI-HTAPYJJXSA-N 464.530 0.817 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810305912 PXVZZQKORXXILF-SIXWZSSISA-N 484.513 0.961 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(C(=O)CNC(N)=O)[C@H]1c1cccnc1 1811359335 LYSKTBLSZVAXBE-YWZLYKJASA-N 484.469 0.903 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCC(=O)N3)sc2C1 1814048033 QOTRMYYJNITMFD-POKWRQTLSA-N 457.516 0.468 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)C1CCC(CO)CC1)CC2)c1ccc(B(O)O)cc1 1815337124 NINVCUXXSLJHHE-MQBCKMQZSA-N 457.361 0.847 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815340893 QLHORPUKAWNJQV-HIFRSBDPSA-N 471.373 0.075 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403621 WZJOCDYKWJZLDV-SUMWQHHRSA-N 466.506 0.642 50 20 JCGD CNC(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN(C)NC(=O)NCc2ccccc2)n[nH]1 1820709659 JSFKEXJAMGVCJS-SFHVURJKSA-N 484.561 0.884 50 20 JCGD Cc1nccnc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1820872804 JLZFYPVSWRTGBI-NSHDSACASA-N 452.500 0.780 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](C)n2cnnn2)n[nH]1 1822852404 AWETTZHUPAUWQI-HREMKEFQSA-N 467.494 0.784 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1823124832 HWDRPGCKCHRCAD-OAHLLOKOSA-N 453.333 0.631 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CC[C@H]3CCC(=O)N3C1)CC2 1826088879 QYJUQFCWZUTRFH-ZNMIVQPWSA-N 476.603 0.829 50 20 JCGD O=C(c1cc2cccnn2n1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057446 FPCPQULBVAERBW-JOCHJYFZSA-N 461.331 0.956 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CC(F)(F)C(=O)O)CC1 1827595269 UDFYRETWBDFYBH-QGZVFWFLSA-N 452.263 0.710 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CSCC(=O)O)CC1 1828925903 UKUMEXMSIZUQGC-QGZVFWFLSA-N 463.560 0.736 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1830364217 CESMRZOXENXAQS-FQEVSTJZSA-N 453.927 0.020 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1830568749 JYDNGLASFDFKNZ-QYWGDWMGSA-N 477.986 0.736 50 20 JCGD O=C(c1occc1Br)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830727957 LLQXTQYEJSOKQS-WBMJQRKESA-N 451.701 0.712 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733800 TZARJDMKHULYSQ-PGRDOPGGSA-N 480.949 0.578 50 20 JCGD CC(F)(F)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1831683215 TVEOAUOWHOLXAH-NRFANRHFSA-N 469.489 0.437 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833310978 ZWDICQZIOIQXKH-QZTJIDSGSA-N 491.029 0.697 50 20 JCGD Cc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cn1 1833866406 DTNLOUPRGMJELP-UHFFFAOYSA-N 458.607 0.877 50 20 JCGD CCn1nccc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834276044 MMWDJIKYARWQPG-UHFFFAOYSA-N 453.352 0.082 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1F 1835490667 LLQMRQPVQWDKBH-ODXCJYRJSA-N 478.876 0.652 50 20 JCGD Cc1nc[nH]c1CSCC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835690697 MLXXFNDXTAEREB-UHFFFAOYSA-N 499.446 0.517 50 20 JCGD Cc1cc(Cl)ccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835925922 AUPXGZHLVXTCKD-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)n(-c2cccc(=O)n2C)n1 1836259538 FKDWPRZSXZNAKQ-WIYYLYMNSA-N 481.912 0.484 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ncccn3n1)CCO2 1836868663 OIDJATPNALILHA-GOSISDBHSA-N 452.309 0.584 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837715346 LRMDNYQXCMJJIY-OXJNMPFZSA-N 451.600 0.585 50 20 JCGD O=C(c1n[nH]cc1I)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1837963403 MXQNZCLDHOGIGB-BXUZGUMPSA-N 486.669 0.619 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C(C)(C)C)n[nH]1)CCO2 1837993968 PHPAMOKGYFGWLZ-QFIPXVFZSA-N 464.567 0.150 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnn4c3OCCC4)CC2)CC1 1838394764 UXBLIGPQZPKSCR-UHFFFAOYSA-N 497.556 0.590 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cnc[nH]3)C2)C1 1838528330 RGROQHDYZAYMHY-JOCHJYFZSA-N 487.469 0.556 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1839151511 UUGAPRIZEWBIAS-RTBURBONSA-N 494.397 0.791 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839173728 INTUPVLHMJNAAI-QADUPLGGSA-N 489.529 0.086 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1839967027 WZOKYNDACGBHJD-MRUHUIDDSA-N 497.390 0.830 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nc(CO)[nH]c4c3)C2)C1 1840032576 CMNFWSOURFUETI-RNODOKPDSA-N 481.347 0.909 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4ccccn34)C2)C1 1840152538 LMFCSWSMPSWBCU-KKSFZXQISA-N 450.923 0.967 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(F)c(C#N)c3)C2)C1 1840154847 HTTLSWJTJURURI-DYESRHJHSA-N 453.898 0.950 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)c1ccccn1)CCO2 1840328269 CMQPSXVNLYNBTC-QMFOPCRCSA-N 496.568 0.950 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cnc(OCF)cn2)C1)NC(=O)NCc1ccccc1 1842244510 FGKFMDKIXRHLDF-UHFFFAOYSA-N 485.520 0.946 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C1 1842911976 SKLQJDCYMDQGQR-VSWHYLHOSA-N 489.577 0.566 50 20 JCGD O=C(Cc1cc(Br)ccc1O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014464 MGAKHLMBETWAKN-UHFFFAOYSA-N 473.132 0.894 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1cnc3c(c1)CCNCC3)C2 1843417047 QRVNRRYISOBBIW-LQKURTRISA-N 463.542 0.721 50 20 JCGD CC[S@](=O)CCC(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844174402 NXDROYAGPHGMCA-YTTGMZPUSA-N 463.604 0.695 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccnnc1O)C2)NC(=O)NCc1ccccc1 1845039219 SDSLJNSAFLDRCB-UHFFFAOYSA-N 453.503 0.345 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCOCC3)c2)C1 1845391416 VSEZTDIJYOSPBG-UHFFFAOYSA-N 464.526 0.653 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1847068791 IKNMGASSHLVNBR-SFHVURJKSA-N 455.320 0.100 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)C=CC1=O 1847949206 LGCNSCQYNPDNHX-KKUMJFAQSA-N 468.938 0.635 50 20 JCGD CON(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 21783680 RSNVNDDMFIBUSB-UHFFFAOYSA-N 496.567 0.728 50 20 JCGD O=C1NC(=O)C2(CCC(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)CC2)N1 727765972 YVFCNAYXQBYLFE-UHFFFAOYSA-N 463.516 0.001 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@@H]2CCCO2)C3=O)c1 728206300 HAVWXOIRZLAWJM-KRWDZBQOSA-N 488.522 0.892 50 20 JCGD CCOc1ccc(N2C(=O)c3ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc3C2=O)cc1 729276601 IFCQFTAZNPMNAZ-LBPRGKRZSA-N 474.495 0.585 50 20 JCGD O=C(Cn1ccc2ccccc21)NNC(=O)NCCC(=O)N1CCN(c2ncccn2)CC1 729612146 WBEFOTSRZYYZRH-UHFFFAOYSA-N 450.503 0.501 50 20 JCGD O=C(Cn1ccc2ccccc21)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCOCC2)cc1 729667693 WAXDVVMUQOYQHT-UHFFFAOYSA-N 478.552 0.672 50 20 JCGD CC(C)N(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 776104006 ZTCHGIKVRZSJKH-LJQANCHMSA-N 491.522 0.860 50 20 JCGD O=C(CNC(=O)c1ccc(Br)cc1)NNC(=O)c1csc(N2CCOCC2)n1 912852034 AHKWIBDNXIHYQH-UHFFFAOYSA-N 468.333 0.933 50 20 JCGD C[C@H]1CCCN([C@@H](C)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1 916450428 NURBOJVUYIDMKS-IRXDYDNUSA-N 453.613 0.764 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccc1O 917717856 MCOZSZMEZJLFML-UHFFFAOYSA-N 497.551 0.977 50 20 JCGD COc1cc(CNC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)ccc1OCCO 918002207 VCFKDGRBDDDBGV-UHFFFAOYSA-N 465.532 0.812 50 20 JCGD O=C(Cn1cnc2scc(-c3cccs3)c2c1=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919885324 ONKNRWJJQRSXHK-JTQLQIEISA-N 467.554 0.704 50 20 JCGD CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(NS(C)(=O)=O)cc1F 919954008 ACPOUXHLVHTFRF-UHFFFAOYSA-N 461.493 0.984 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2 919955632 JWBOPSSRIBGAQK-UHFFFAOYSA-N 484.512 0.381 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@]3(F)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1778324312 DPBCTFAXAIGMRS-PKTZIBPZSA-N 499.584 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(C(F)(F)F)c3)CCO2)C1 1779029340 VYWFTQGRPSPOGO-FQEVSTJZSA-N 478.431 0.856 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C#N)c1 1779037080 MUTQFOWTEKIUET-DEOSSOPVSA-N 478.509 0.252 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccn2cncc2c1 1779112250 AQMDOQZINZDCGZ-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(S(C)(=O)=O)cn1)CCO2 1779296672 YECWFHPTXRSZIJ-LJQANCHMSA-N 455.609 0.780 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1780158254 WQKQHTPRRQGBKY-UWJYYQICSA-N 454.907 0.533 50 20 JCGD CN1CCN(C2(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](F)Br)C4)CC2)CC1 1780652118 IPFHNSCBOZZYQZ-JTDSTZFVSA-N 475.403 0.971 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967960 GCQFSWVMFXJOQM-CYFREDJKSA-N 474.606 0.503 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781331297 HYJABYYLVZPZFT-WOSRLPQWSA-N 453.261 0.002 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3c(C)n[nH]c3C)C2)C1 1781431756 OIUOIJOQMWVZQZ-SYOQMXFQSA-N 455.519 0.533 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781884182 YSQWFYZZBZLLLU-QRJOEMBSSA-N 466.343 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc3ccccn13)C2 1782215174 WTXJWOXFZOVLTD-WZONZLPQSA-N 456.547 0.835 50 20 JCGD CC#C[C@@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccc(O)cc1 1784015001 SCCCLSWYJIKDKH-FNZWTVRRSA-N 476.338 0.713 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](C)Br)CCO2)C1 1784374008 MHVVSSTWLQLHEN-DWQUBVKVSA-N 456.341 0.070 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)[C@H]1CC(=O)N(Cc2cccs2)C1 1785189454 SRPGGQPRPQBVBD-IAVJCBSLSA-N 469.991 0.676 50 20 JCGD CC(C)c1csc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)n1 1785502007 PBUJABPNWADMMU-IEZWGBDMSA-N 457.361 0.853 50 20 JCGD CC(C)(C)OC(=O)N1Cc2[nH]nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@@H](O)CCl)C[C@@H]43)c2C1 1785798526 HUKRIWIBEPEQIJ-PYTWLRIVSA-N 497.980 0.853 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(C)noc3N)[C@H]2C1 1786836357 MTXBHBTZBPNOJQ-HVEJOWRVSA-N 457.491 0.293 50 20 JCGD C[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)Oc1ccccc1 1786983137 KMFBROAIJANIAO-UJFGGOPNSA-N 466.343 0.817 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)ccc1C 1786984718 AOZSCGTVGDEKSQ-VCOUNFBDSA-N 452.316 0.591 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)CC1 1788145733 UOGDRGIMTRJEAH-UHFFFAOYSA-N 499.398 0.786 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCNC4=O)[C@H]2C1 1788258070 DUFSARUNMFFXMA-QCQGSNGOSA-N 468.352 0.393 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C#Cc3ccc(Cl)cc3)C[C@@H]21 1788607707 ADXCHHGESVFHSK-NDXORKPFSA-N 481.940 0.984 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)C[C@@H]21 1790962029 SZVCMLKYOAKKSG-LHEWDLALSA-N 475.409 0.942 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3CNc4ccccc4O3)C[C@@H]21 1791291126 MVVSPCYMVQCMSR-NYUBLWNDSA-N 473.574 0.602 50 20 JCGD COC(=O)CCCCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791350935 JDVILGGSUZJVMW-IHPCNDPISA-N 460.336 0.083 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NNc1ccccc1 1792506806 SIBJETRLYZVDNK-OODBJQIASA-N 481.557 0.715 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCC(=O)NC1 1792580623 NZZWZUMBRHTIJU-GXNBUGAJSA-N 474.470 0.250 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(S(C)(=O)=O)cn1 1794427089 VSFNFGMEBUFUKS-ZSBFGKGUSA-N 455.609 0.540 50 20 JCGD CC#CC[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)c1ccccc1 1795740380 ZVSPJQAIWTUYFX-CBJLPSGESA-N 460.339 0.767 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc[nH]c1[N+](=O)[O-] 1796401605 BHHXWVSGQLZHCQ-RNJOBUHISA-N 486.913 0.653 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2cc(F)c(F)cc2[nH]1 1797338156 ARTOYFPFWLWLTG-NXCRSVRDSA-N 484.463 0.962 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C1=NN(c3ccccc3)C(=O)C1)C2 1798440147 DUQVAXXKCSYNTI-ACHSLPGTSA-N 475.509 0.730 50 20 JCGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccc(O)cc1 1799298943 CJRBKDUXYPRDPJ-BCEDRHLLSA-N 453.499 0.398 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])c(O)cc1C 1799829517 OGKQXLMTBHNOHD-JXZJUKCJSA-N 498.496 0.946 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc([N+](=O)[O-])c1OC 1799841847 XAXVMASFQMSEGP-FAXLKDOZSA-N 457.867 0.415 50 20 JCGD O=C(Cc1cccc(OC(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800427492 FYPVEAFGXYIRDH-UPHUGPLXSA-N 492.259 0.711 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1800643091 LJNMGAOILFZJMN-OQMKEHIESA-N 471.308 0.520 50 20 JCGD Cn1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1=O 1803831527 VSULRISBERWLGA-GHTZIAJQSA-N 460.299 0.094 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(=O)OC(C)(C)C 1806722479 VTQFAYXVLZBJPD-KNQAVFIVSA-N 496.373 0.948 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cncn2-c2ccncc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361131 FESAJFKCNJLVPD-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD Cn1nc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c2c1CCC2 1807374832 JORCSCYCMCCGPC-WZONZLPQSA-N 473.342 0.617 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NC=O)[C@@H]1c1cccnc1 1808362300 WVDRWLMLHUQOCG-PBZRQJIMSA-N 453.503 0.356 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)CN3CCNC3=N)C2)CC1 1809743384 HHJDVICEXVRMHI-WGOQTCKBSA-N 456.551 0.192 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1 1809906198 HDQRFFITQYJXLA-KKSFZXQISA-N 485.508 0.756 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(=O)Nc1cccnc1 1810463458 SFBBYFJQLHRRBA-WIYYLYMNSA-N 473.298 0.115 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1nn[nH]c1C(F)(F)F 1811557757 PETPCWKEMKXDFO-PBHICJAKSA-N 488.235 0.532 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1 1813072942 HAPPMKHDEHOSNW-KXBFYZLASA-N 460.564 0.371 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C[C@](C)(O)CC(=O)O)[C@H]1c1cccnc1 1813073598 KTBRZBWAORFCBI-SSKFGXFMSA-N 463.535 0.076 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnn3c2OCCC3)[C@H]1c1cccnc1 1813074257 WOBZXVJMVDYRCV-UTKZUKDTSA-N 469.546 0.753 50 20 JCGD NC[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccccc1 1815160520 YAZUMEVMBDQUIB-MSOLQXFVSA-N 464.356 0.791 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793645 QWPUFKXCGJOJGS-QWRGUYRKSA-N 480.572 0.048 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1ccccc1=O 1819797369 BELMCDSKWMGJSQ-CHWSQXEVSA-N 481.538 0.790 50 20 JCGD O=C(CN(CCO)CCO)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](F)Br)[nH]n1 1822026462 HRBZAMBZRYDRSV-WFASDCNBSA-N 450.309 0.379 50 20 JCGD O=C(CN1C(=O)CSC1=S)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1823497946 JDQZXTRDXMQKIJ-HNNXBMFYSA-N 487.372 0.256 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1824514674 BAMYQCWLWNLZNK-IBGZPJMESA-N 462.377 0.506 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827058235 UJHWGVKKBLRZPD-OXJNMPFZSA-N 458.368 0.307 50 20 JCGD NC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1 1827500546 DQBJVUDQXCIBQU-MRXNPFEDSA-N 464.312 0.461 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)Cn2ccccc2=O)CC1 1828927066 YVVTZJJKAKECFQ-HXUWFJFHSA-N 466.542 0.780 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnn4n3)C2)C1 1830543008 HBMFTVYEEVKECU-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1 1830544493 ZNVAPLWMZLPYMF-AUUYWEPGSA-N 478.384 0.999 50 20 JCGD CC(=O)Nc1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1830730450 ALQMMRIBAVJLPH-NQIIRXRSSA-N 453.923 0.244 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccc(F)cc1 1830733480 NFSJKGTXIYEDKH-LQWHRVPQSA-N 471.913 0.059 50 20 JCGD O=C(c1n[nH]c2c(Cl)cccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830735288 FTRUXVCWBHVXSH-IFXJQAMLSA-N 457.314 0.886 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1831309487 ZMKOVABYKCAWAP-STWLZBDKSA-N 488.585 0.628 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832800321 OCMKTKRYOOHZLV-MLGOLLRUSA-N 460.285 0.031 50 20 JCGD O=C(CCc1nc(-c2ccc(F)cc2)no1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832899191 QBOMZMRBMGLSML-HTAPYJJXSA-N 496.923 0.864 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)CC2)CC1)[C@H](O)CCl 1833310095 HVJLLVATSRGDPU-XMSQKQJNSA-N 464.950 0.892 50 20 JCGD CC(C)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)no1 1834496694 CLSXQLWUAABUCI-JOCHJYFZSA-N 472.502 0.180 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cocn1)CCO2)NC(=O)NCc1ccccc1 1834511030 ZQZIIFPCBKMAHD-QHCPKHFHSA-N 486.529 0.091 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801478 NSMPLBCEIDQXGT-UHFFFAOYSA-N 481.406 0.145 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CCOc1ccccc1)CCO2 1834833163 LCDSGMIMJBWWAY-HSZRJFAPSA-N 462.547 0.285 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cnnn3C)CC2)CC1 1835118269 LWBYEFHUWSNTPB-CVKSISIWSA-N 469.550 0.134 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)F)CCO2)NC(=O)NCc1ccccc1 1835482326 HBSPHRAWHCOVKH-HSZRJFAPSA-N 479.553 0.537 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3c3ccc(Cl)cc3)C2)C1 1835930190 AROFUXABSJGTBY-WRALFONMSA-N 498.772 0.894 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934063 LQYTYRXLQIHMCW-OZXSUGGESA-N 494.353 0.141 50 20 JCGD Cn1ccc2cccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c21 1835937487 ZLIDVUUDWKLBHS-RUZDIDTESA-N 477.326 0.242 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc([N+](=O)[O-])[nH]1 1836196051 GWPMNOAXLQUOMH-UHFFFAOYSA-N 469.307 0.102 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836719093 MSJHTCOXJUQISY-KRWDZBQOSA-N 470.910 0.355 50 20 JCGD O=C(C[C@H]1CCCCO1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837048855 CMXQTYWQMVHMED-JOCHJYFZSA-N 458.364 0.938 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 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C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1 1840035505 UKVHHLFNQJVWRH-UQASEVPWSA-N 479.375 0.992 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)C2)C1 1840154657 BWCGJMKSLOCRGU-LQBOVUBWSA-N 464.950 0.463 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)C1 1840155073 PDFDJSVRQPRRQB-VLIAUNLRSA-N 481.893 0.795 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc31)CCO2 1840256780 BVGZEZVBUHDIMY-WIOPSUGQSA-N 464.327 0.166 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc[nH]c3C1)CCO2 1840363195 ONZZQXILBASRIJ-KKSFZXQISA-N 450.612 0.823 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1F 1840702197 JLOCGSWOCZDGMW-QFIPXVFZSA-N 468.501 0.716 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3cc(C)c(O)nc3=O)CCO2)C1 1840805970 LJTULZLPENJGHZ-FOIQADDNSA-N 456.927 0.121 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841618765 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COc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1[C@]1(C)NC(=O)NC1=O 917732389 URWCCRNBCRCLIC-FQEVSTJZSA-N 476.467 0.144 50 20 JCGD CC(C)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CN3CCCC3=O)CC2)cc1 920826489 METZKAZORKXMDF-UHFFFAOYSA-N 450.561 0.981 50 20 JCGD O=C(NCCCS(=O)(=O)c1ccccc1)NNC(=O)c1csc(N2CCOCC2)n1 921200593 DZPYHKSTKHUOFR-UHFFFAOYSA-N 453.546 0.788 50 20 JCGD COc1ccc2oc(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2c1 1778421730 YOKPZOKDBYIKDY-XMMPIXPASA-N 464.283 0.879 50 20 JCGD C[Si](C)(C)c1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)co1 1778997262 MKEACLPGZDPWOD-JOCHJYFZSA-N 471.590 0.581 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1779028336 JJNFJJTWWFLAQO-JOCHJYFZSA-N 455.519 0.394 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc2c1OCCO2 1779030782 XDMPPNOMRUAKCM-XMMPIXPASA-N 481.509 0.522 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnc3ccc(F)cn13)CCO2 1779037183 SWQDUAZTQGOHHE-QFIPXVFZSA-N 467.461 0.229 50 20 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O=C(NC1CCN(C2CCN(C(=O)COc3ccccc3F)CC2)CC1)c1ccc(B(O)O)cc1 1834798843 DXILWEJGHCISMO-UHFFFAOYSA-N 483.349 0.770 50 20 JCGD CC(C)CC(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1834799115 FFPKVVPTEDIUKL-XMMPIXPASA-N 475.590 0.835 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)F)CCO2)NC(=O)NCc1ccccc1 1834917198 AGMKFDUVIJZTGP-NRFANRHFSA-N 469.489 0.054 50 20 JCGD N#Cc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cc1 1835734365 CSMDQGDGTKHICV-UHFFFAOYSA-N 489.580 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)COc3ccccc3)CC2)CC1 1835736840 JPTAWKWTUVVEIZ-UHFFFAOYSA-N 480.569 0.949 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)n1cccn1 1835737436 USAVKGGKXIWKQY-INIZCTEOSA-N 468.562 0.328 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc(F)ccc4[nH]3)C2)C1 1835930536 LPPNPQZYQTZDCG-DEOSSOPVSA-N 481.289 0.371 50 20 JCGD Cc1cccc(C)c1SCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930782 ZJZWUXVKRREEHA-RUZDIDTESA-N 498.410 0.846 50 20 JCGD O=C(Cc1ccc2c(c1)CCC2)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934222 QFLVHOFFLYGNHX-SANMLTNESA-N 478.354 0.168 50 20 JCGD O=C(c1cnn(Cc2ccccc2)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838016245 WAHKEIDNTPOGBY-KNQAVFIVSA-N 462.934 0.601 50 20 JCGD O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838480496 ASBLFBLJDSCELN-JTSKRJEESA-N 475.933 0.240 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN(CCO)CCO)CC2)CC1 1838760998 PNCWYXZYGRREOX-GOSISDBHSA-N 478.428 0.445 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)OC(=O)NC(C)C)CCO2 1839074708 ZNPAZRLFEXHPBP-QRWLVFNGSA-N 463.959 0.610 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(C#N)c1 1839131458 ZMMFUCGPPYROBU-WIYYLYMNSA-N 451.907 0.165 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198275 BUVSPUSWHBOIOZ-ZFWWWQNUSA-N 457.318 0.040 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(C)n(C)n3)C2)C1 1839961614 CQRDFYWAXVYYTD-VQIMIIECSA-N 457.369 0.901 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)S)CCO2 1840162112 MLYCZFDBEDEFTO-RBZFPXEDSA-N 467.500 0.908 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)ccc(F)c1F 1840703494 FPFXKNMYBDYFLM-HSZRJFAPSA-N 474.269 0.337 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)CCO2 1840882621 LPPHBSOAOLHIPA-ACTFIFLWSA-N 489.997 1.000 50 20 JCGD CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840914223 OQQJDQDRKHEJAJ-JKSBSHDWSA-N 492.013 0.982 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)C(C)(C)O 1840916501 MJBMPAXTDUUHEK-CKNLXJGOSA-N 481.949 0.641 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)[C@H]1C[C@H]1F)C2 1843428585 CETDGQBCYWNHTG-OTWHNJEPSA-N 489.353 0.364 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=O)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1847099554 WQOQCMDLRHOLIB-KBPBESRZSA-N 475.974 0.131 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)cc1 16786011 RDXXDZYTHZXXGD-INIZCTEOSA-N 479.536 0.886 50 20 JCGD COc1ccc(CC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1[N+](=O)[O-] 727671868 SXCBNKWIROEOOW-UHFFFAOYSA-N 450.473 0.922 50 20 JCGD C[C@@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 728213944 HRJXXTPVVBUNPA-OAHLLOKOSA-N 485.570 0.761 50 20 JCGD CCOc1ccc(CN2C(=O)c3ccccc3C2=O)cc1C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O 729276465 FULNGAUCQQNNHO-CYBMUJFWSA-N 488.522 0.580 50 20 JCGD Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)CC2)c1C 729276765 LMKCUAVSFZEDJQ-MRXNPFEDSA-N 488.632 0.406 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(OCC(=O)NNC(=O)Cc2ccccn2)c([N+](=O)[O-])c1 729393413 SELJVPWQXODHCK-UHFFFAOYSA-N 465.488 0.789 50 20 JCGD O=C(NNS(=O)(=O)c1cc2c(cc1Br)OCCO2)c1ccc(-n2cnnn2)cc1 747072805 OQTWJYCCBXXRID-UHFFFAOYSA-N 481.288 0.819 50 20 JCGD O=C(NNC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1)C(=O)N1CCCC1 748246082 FJAIKRYSNRQJCD-UHFFFAOYSA-N 474.495 0.642 50 20 JCGD Cn1c(=O)oc2cc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCCC4)c3)ccc21 903881779 IIRDZNLSQYBFPD-UHFFFAOYSA-N 494.551 0.929 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)CN(C)S(C)(=O)=O)c1 914748623 SDJZSOJAGFPIFK-UHFFFAOYSA-N 470.529 0.148 50 20 JCGD Cc1nc2ncnn2c(C)c1CCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 917243825 RASNBTTUCNTFSP-QGZVFWFLSA-N 454.443 0.204 50 20 JCGD COc1cccc(C(=O)NNS(=O)(=O)c2ccc(S(=O)(=O)N3CCOCC3)cc2)c1O 919958431 KNSXYMIEBWHTKD-UHFFFAOYSA-N 471.513 0.045 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)NCc3ccco3)CC2)o1 920856002 NFLCXWGAHQDXDD-UHFFFAOYSA-N 468.488 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)COc3cc(Cl)ccn3)CCO2)C1 1779032001 JJBFWPATNDSRDS-OAQYLSRUSA-N 474.905 0.256 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1780931377 NKGHJIFEYYTRDG-LLGFUMIMSA-N 491.894 0.581 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968258 HOAHJNQXIQXOKT-RUZDIDTESA-N 497.600 0.745 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3C(=O)CSC3=S)C[C@@H]21 1783975690 QVJUCZPWTYDAEU-CYDGBPFRSA-N 478.434 0.857 50 20 JCGD Cc1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)ccc1F 1785628393 LFGZMOZCGFEDGQ-AXHNFQJDSA-N 456.478 0.435 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(-c2ccco2)no1 1787283442 JNHINZAIUJIWMJ-WJPUGNRLSA-N 465.271 0.522 50 20 JCGD CC(C)COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)ccn1 1787520537 OVXLUXXYPNOJJH-BVSLBCMMSA-N 481.358 0.703 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccccn34)[C@H]2C1 1787933660 GLRWYVZRGJYYGD-FNHZYXHNSA-N 463.498 0.240 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3nc4ncccn4n3)CCC2)cc1)c1ccc(B(O)O)cc1 1788141041 DNFMEFVAFMXMBB-UHFFFAOYSA-N 456.271 0.866 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NO[C@H](c4ccccc4)C3)[C@H]2C1 1788144536 QHTAWFMZPAUZBW-PWZKMPOXSA-N 492.536 0.796 50 20 JCGD 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CN(C(=O)OC(C)(C)C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)n(C)n1 1796508945 IDSPTXIROBOPDH-YXPYIKCWSA-N 485.969 0.594 50 20 JCGD CC(C)(C)OC(=O)CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748636 OCPFSFOFLIGRBC-YVWYUNDQSA-N 475.546 0.400 50 20 JCGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)[S@@](=O)c1ccccc1 1797754030 PLJNYHFWGUEQFU-DEAZOFBASA-N 485.566 0.085 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CS(C)(=O)=O)C2 1798521493 KRGPQKPOAPSTDW-FIIQBIKZSA-N 497.526 0.404 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1cncn1)C2 1798523193 VZKUBIFXSYJJDY-FIIQBIKZSA-N 472.458 0.576 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1O)C2)NC(=O)NCc1ccccc1 1799094720 HFIZOQAXWIESGH-BBIADKPPSA-N 481.553 0.942 50 20 JCGD COc1ccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(F)c1 1800833620 WQZHTYUQDUSSND-TUWKBJCVSA-N 468.290 0.431 50 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C=CCNC(=O)/C=C\C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1814437192 MMIWXQDXNAZAKX-RXQFDZFGSA-N 451.292 0.254 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1815233434 XGIBMGFYCUZRPC-DZGCQCFKSA-N 456.569 0.456 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccnc3c1OCO3)CC2)c1cccc(B(O)O)c1 1815360956 RSRPNQLMDSSPTB-CYBMUJFWSA-N 466.284 0.486 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817471143 AZVPFHHOZWYAFV-ICSRJNTNSA-N 462.319 0.360 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)n1cncn1 1819802202 ZMAAGCKOEROTLD-GHMZBOCLSA-N 455.504 0.220 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1 1826606281 ZESRSERHZVXUNW-NSCUCBQXSA-N 469.531 0.871 50 20 JCGD O=C(Cn1cnnn1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1829013766 BJCMMAOURNQFLO-FXAWDEMLSA-N 479.900 0.660 50 20 JCGD O=C(C[C@@H]1COc2ccccc2O1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725564 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cn[nH]c3)C2)C1 1832549694 XQBCAWUCXPCTOZ-HTAPYJJXSA-N 499.996 0.931 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1833263371 KGTIHTQLXKCTSI-ZDUSSCGKSA-N 494.394 0.634 50 20 JCGD CC(C)n1nc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cc1C(=O)O 1834000174 VCPUDVRBPQIPNL-SFHVURJKSA-N 469.970 0.947 50 20 JCGD Cc1cn(CC(=O)N2CCC(N3CCC(NC(=O)CCBr)CC3)CC2)c(=O)nc1O 1834423514 OFCDRAMZRQJDCW-UHFFFAOYSA-N 484.395 0.614 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nc(O)n4c3CCCC4)CC2)CC1)c1ccc(B(O)O)cc1 1834798395 PBVZAKSOMUSRCV-UHFFFAOYSA-N 495.389 0.104 50 20 JCGD COC(=O)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1835167905 RIFJUOLAFRQWFP-UHFFFAOYSA-N 494.357 0.047 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835749839 ACXQOHFTEVPIAN-KRWDZBQOSA-N 474.610 0.222 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835754380 JLBQTZJRHUSLQK-IAGOWNOFSA-N 494.358 0.743 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccccc3N)CCO2)C1 1835777722 ZOCIIMFBIQKXPR-QQHIZMLBSA-N 480.525 0.051 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)N3CCN(C)CC3)CC2)CC1 1836372898 LAGVRQIPQISHNI-FXAWDEMLSA-N 458.047 0.448 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836717926 FLBKFFVVOLOANG-SFHVURJKSA-N 493.948 0.890 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)o1 1837453710 NSJFTXYNUWLQEM-PBHICJAKSA-N 462.272 0.999 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)no1 1837546353 WYOFPHAAAHOMRP-DJJJIMSYSA-N 487.351 0.200 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)no1 1837920394 SRMVQMXTURLKEE-UHFFFAOYSA-N 498.345 0.304 50 20 JCGD O=C(c1cnn(Cc2ccccc2)c1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838016243 WAHKEIDNTPOGBY-DENIHFKCSA-N 462.934 0.601 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc4ncnn4c3)CC2)CC1 1838350810 GSEQYSRDRFYLGE-UHFFFAOYSA-N 492.540 0.654 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838527284 MDJFAPUNGFTVFR-JXFKEZNVSA-N 485.877 0.190 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cccc1F)CCO2 1838862641 DWPCXXADDBGAQI-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD O=C(Cc1n[nH]c2cc(Cl)ccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839045411 IFOFZNSSZFMYBT-PXNSSMCTSA-N 471.341 0.815 50 20 JCGD O=C(Cc1c[nH]c2ccccc12)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839070299 GQWNDIWSICAVKZ-RUZDIDTESA-N 477.326 0.160 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2)C1 1839141450 IZACMUULEBSWJB-AUSJPIAWSA-N 463.959 0.346 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2)C1 1839144326 VJFFTOFQBKDVLU-WHSLLNHNSA-N 477.002 0.702 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)N3CCN(C)CC3)C2)C1 1839966177 WUPSKJUDUNBJPW-ABSDTBQOSA-N 475.428 0.252 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(=O)ccn3C)C2)C1 1839966252 ZDJSQRBEWCXCHY-KXBFYZLASA-N 456.337 0.629 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4sc(C)cn4c3=O)C2)C1 1840152377 GWFMJCDNPJBRRY-QRWLVFNGSA-N 484.962 0.388 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1ccc(N(C)C)cc1)CCO2 1840315765 NTUNIOWJOKTYOW-VWLOTQADSA-N 489.617 0.515 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(CC(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)=NO2)C1 1841353790 PLCUOKNZYLBWNH-VFNWGFHPSA-N 470.954 0.945 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1C[C@H]3C[C@H]3N1C(=O)OC(C)(C)C)C2 1846383999 RNFITVOHEDBLBA-BRWVUGGUSA-N 463.579 0.961 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)C2 1846385878 GQFLSQSYDVBXQW-MNZLEMJZSA-N 463.579 0.676 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](Cl)COC)C2 1847046105 XGBQANADDRQRKI-KBPBESRZSA-N 461.943 0.900 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CNC(=O)c2cccs2)cc1OC 725741478 NXVNIHWUZVTTFQ-UHFFFAOYSA-N 470.529 0.011 50 20 JCGD O=C(COC(=O)CCc1nc(-c2ccccn2)no1)NNC(=O)[C@H]1COc2ccccc2O1 728323364 DNMWRXICEWFWBX-MRXNPFEDSA-N 453.411 0.595 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)cc1 729275061 KDPXUWDSFCUDPD-ZDUSSCGKSA-N 454.530 0.495 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(CN3CCC[C@H](C(N)=O)C3)c2)c1 731117859 KWYZASCCIAJTKK-IBGZPJMESA-N 487.582 0.932 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)c2ccccc2c1=O 748465239 MMVQEUMPWQSSLX-UHFFFAOYSA-N 492.540 0.494 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNS(=O)(=O)c1cccc(F)c1F 751267876 NUMWFAZMTSJAHR-UHFFFAOYSA-N 489.522 0.928 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)c1 873821273 HMGBCWZWMRWDIZ-IYBDPMFKSA-N 450.517 0.263 50 20 JCGD COc1ccc(N2C[C@H](C(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2=O)c(OC)c1 915077546 XIJZSDCPOCUKGF-CQSZACIVSA-N 461.496 0.921 50 20 JCGD COCCS(=O)(=O)CC(=O)NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 915638260 BSENOOTVMCMWCP-UHFFFAOYSA-N 497.595 0.638 50 20 JCGD CN1CCN([C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2cccs2)CC1 915901999 OZAOGCHDPFXBID-GOSISDBHSA-N 494.643 0.931 50 20 JCGD Cn1nc(SCC(=O)NN=C2CCN(Cc3ccccc3Cl)CC2)c(=O)n(C)c1=O 915958666 PVDVCUZVSAHTKS-UHFFFAOYSA-N 450.952 0.993 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCS(C)(=O)=O)c2)cc1 916734782 XYCFXZRWZXGYLA-UHFFFAOYSA-N 455.514 0.692 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3ncccc23)C1 1777947077 WAWQCGIFKPXYLX-BMIDIIHHSA-N 492.540 0.991 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c21 1779032442 JZYIHPZQVHAWTJ-HSZRJFAPSA-N 479.497 0.035 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)C(=O)CC4)CCO2)C1 1779037396 ZPMOXOHAWPBNLN-DEOSSOPVSA-N 463.494 0.571 50 20 JCGD CC(=O)O[C@@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)C(C)C 1779205447 GZWDWOMKIXWOFR-TXTKFYIRSA-N 460.336 0.082 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3[nH]cnc(=O)c3c2C)C1 1780020261 WZZFKNLPKMXJOJ-WHSLLNHNSA-N 465.938 0.712 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3c[nH]c(=O)cn3)C2)C1 1780244074 GMPZEDMMZASPQL-RBZFPXEDSA-N 469.926 0.346 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CC(O)C1)C2)NC(=O)NCc1ccccc1 1780558724 HLQBXJOCKAHZDN-QDUPVPMBSA-N 487.601 0.617 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CC1(F)F)CCO2)NC(=O)NCc1ccccc1 1780969054 UODXDVPLASAMBW-LAUBAEHRSA-N 465.501 0.818 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1cccn1 1780969726 PIFOOXZLTBWUMG-DVECYGJZSA-N 483.573 0.620 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1781112297 WMHUINVLDHOUFI-LPHOPBHVSA-N 457.413 0.770 50 20 JCGD COc1c(C)cc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1C 1781871831 IPBABLLHEBQFSN-XMMPIXPASA-N 452.316 0.749 50 20 JCGD Cc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc(C)c1C(=O)O 1782172702 HAGGUBXWQFNFRI-DEOSSOPVSA-N 481.509 0.757 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)C(C)(C)C 1782210059 CFFUHRTUEGGCPN-HCLVMJGWSA-N 467.611 0.424 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1783533253 YKDGTCSTNYFRAG-CRTZDJKQSA-N 469.336 0.606 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCOC3)C2)C1)NC(=O)NCc1ccccc1 1784722569 NPVSNVRWFGJLFV-AUSIDOKSSA-N 459.547 0.199 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785127845 JHUMKODWAXCKDB-JOCHJYFZSA-N 458.707 0.786 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1785544856 BSLPWEGXFHGQAO-RISCZKNCSA-N 454.343 0.367 50 20 JCGD CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)CN3CCS(=O)(=O)CC3)cc2)CCC1 1786689781 LJXXROOVCSYDCK-UHFFFAOYSA-N 479.603 0.224 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCN3CCN(C)CC3)[C@H]2C1 1786729387 DZYFDJDYENPOIK-FJIDUMEYSA-N 459.429 0.777 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786981629 ABEMKOZLUYTPPD-YYWHXJBOSA-N 481.314 0.452 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1 1787450130 MHLOYGUHYITSFY-SMSYFYOWSA-N 479.933 0.957 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)nc2ccccn12 1788610409 QISOYPYHLUVFDC-SNRMKQJTSA-N 477.525 0.548 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)cco3)C[C@@H]21)NC(=O)NCc1ccccc1 1789725005 WWCKLCSCEFDOLA-VCOUNFBDSA-N 497.552 0.579 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc([N+](=O)[O-])c1 1792419864 LYIAZWWCWBQTSH-QCIWSRGXSA-N 482.497 0.861 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc([N+](=O)[O-])c1 1792420190 DHCRJOQKBWCIJZ-YVWYUNDQSA-N 468.470 0.039 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCOCCNC(=O)OC(C)(C)C 1793418068 IXFYMCARHNUMFZ-BCDXTJNWSA-N 483.610 0.929 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc[n+]([O-])c1)C2 1793878226 GPCDSZTZOWVNIZ-YVSFHVDLSA-N 468.938 0.655 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccn1)C2 1793881162 SDUPCUKABUECCC-XGUBFFRZSA-N 453.927 0.812 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1CCOCC1 1795468515 FAXXYLWHMSLQLS-ZMMAXQRCSA-N 489.013 0.430 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3ncc[nH]3)cc1)C2)c1cccc(B(O)O)c1 1795741053 YHVWOUGYXIFDBK-CEQLMSFQSA-N 460.299 0.274 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@H]1C[C@@]12C(=O)Nc1ccccc12 1796190438 XUVZKOPBLMEQNR-SDMFYXEBSA-N 459.311 0.528 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CNC(=O)c1ccco1)NC(=O)NCc1ccccc1 1796287987 LSOLAARZDFVAFI-ACDBMABISA-N 496.568 0.994 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)[C@H]1SC(=N)NC1=O)C2 1796892056 DCQUZPLIYSGAAF-VHKBWRPCSA-N 473.559 0.561 50 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O=C(NC[C@H]1CCN(C(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362552 MCTZCZOAOWUPJM-CRAIPNDOSA-N 464.247 0.026 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365156 WLVJKDPRTWTESR-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD Cc1noc(C)c1CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807369216 CIHKCODTTNKGLH-WMZHIEFXSA-N 462.315 0.929 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1807369383 IFQXDJUPPINWJX-CVDCTZTESA-N 487.325 0.748 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCN2CCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374110 IKGATCKIJZUHNM-REWPJTCUSA-N 450.348 0.567 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375374 OMSDMWOKGDCBQN-YJBOKZPZSA-N 461.230 0.191 50 20 JCGD CCOc1cnc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cn1 1807516142 ZRBHBLMOJPHXLU-UHFFFAOYSA-N 452.320 0.714 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)CC2)C1 1809980698 PDTADEWEBTYJDU-PZJWPPBQSA-N 467.375 0.612 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810299578 SMZXTNLCIIXKSS-IKSNEBHTSA-N 466.498 0.519 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccnc(Cl)n1 1810765934 IORCJNIRXDNIPH-LPHOPBHVSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2nn[nH]c2c1 1812298293 PBEATBLHYXGAOI-GCJKJVERSA-N 470.298 0.666 50 20 JCGD C[C@H](CBr)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CN2C(=O)CNC2=O)n[nH]1 1815595124 NFVJOMNDMNPYGA-ZYHUDNBSSA-N 455.313 0.985 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3nc4ccccn4n3)sc2C1)c1ccc(B(O)O)cc1 1816650696 XVMWLYXDXFZHAE-CQSZACIVSA-N 462.300 0.405 50 20 JCGD CC(=O)c1cc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n[nH]1 1817470562 DQMQAVMEDJTAPB-SFHVURJKSA-N 450.264 0.635 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1818113072 BCYBABWKEXSQHD-YSGZUTGPSA-N 485.549 0.909 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3ccn(C(F)F)n3)sc2C1)c1cccc(B(O)O)c1 1820619642 FDAACFDETALITE-GFCCVEGCSA-N 461.259 0.954 50 20 JCGD N[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1 1826907609 LUFWAYYOLYKSGU-FGZHOGPDSA-N 450.348 0.695 50 20 JCGD CN(C)c1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)o1 1827051411 XWIRPRAWYPXDPM-LJQANCHMSA-N 454.336 0.968 50 20 JCGD O=C1CC(C(=O)N2CCN(C(=O)OCc3ccccc3)[C@]3(CCN(C(=O)[C@H](F)Cl)C3)C2)=NN1 1829124291 NVRPLXIXGJTIJE-UWJYYQICSA-N 479.896 0.849 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)CC1 1829620616 RJHQXFHSNBHTJA-FQEVSTJZSA-N 489.341 0.316 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cscn1)CCO2 1834254157 NMAJULKPYFVXOU-RXULLKCLSA-N 460.516 0.347 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Cn3cncn3)CC2)CC1 1835117623 FUEMTDHWNQAFBS-LMZJGYQHSA-N 497.604 0.620 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1835738308 URNUOCVAMAVMIU-MRXNPFEDSA-N 485.358 0.561 50 20 JCGD C[C@@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)Oc1ccccc1 1835931992 KGDVQWZZBOIZLI-DFBJGRDBSA-N 482.342 0.294 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccc(F)cn3)CC2)CC1 1837556354 ORDSTEKTNJGVIG-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD O=C(Cc1cscn1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919326 GSPCORRHBVWLGS-UHFFFAOYSA-N 457.361 0.678 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839150847 ZBPTVNAQDAZWJI-RTBURBONSA-N 452.379 0.986 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccc(O)cc1 1839171311 RPSDROOIJUGDSO-UZUQRXQVSA-N 462.547 0.325 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(F)c(F)cc3F)CCO2)C1 1839288573 MWYJNRZWTDUWST-QFIPXVFZSA-N 493.442 0.486 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(O)c(F)c1)CCO2 1839303864 YSGYQBAPOFADTH-OJLHXUGZSA-N 487.488 0.735 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622599 LMKXNNAFSDWYEC-LAUBAEHRSA-N 498.422 0.962 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1839716330 GEFOKLBIIPKIOT-CVDCTZTESA-N 497.976 0.148 50 20 JCGD C/C=C(\C)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839820209 APXYAJUZHXKMBV-QFUHNLMYSA-N 473.574 0.755 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1839964679 YTSYNBJQVRBQCV-SCLBCKFNSA-N 467.324 0.368 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(S(C)(=O)=O)c3)C2)C1 1840030773 WINRIKDIZMFFEV-AUUYWEPGSA-N 489.388 0.944 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840182425 JCFFYSLDLLZKJJ-KOSHJBKYSA-N 476.574 0.628 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cc12 1840184441 MXNRQVGEOJHYSI-DEOSSOPVSA-N 471.558 0.919 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840184969 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465.345 0.160 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](C)Br)CCO3)C2)n1 1840033307 ADTXTSPNEKMYQJ-FOIQADDNSA-N 485.379 0.527 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(OC)cc3C#N)C2)C1 1840154867 IFBXHWOJOCCLCT-DENIHFKCSA-N 465.934 0.820 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1840518241 JIWIVUYUOURVFO-ZZTDINLMSA-N 486.554 0.233 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C1 1841298592 CTYQXBUKXQMBFT-FRQJIFLKSA-N 476.534 0.209 50 20 JCGD O=C([C@H](Br)Cc1ccccc1)N1CC2(CCCN2C(=O)CNCP(=O)(O)O)C1 1842875069 YLWQXSOUPRSZAW-OAHLLOKOSA-N 474.292 0.921 50 20 JCGD COC(=O)N(CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)Cc1ccccc1 1843012417 NDIKRGHAHSJRTD-UHFFFAOYSA-N 465.315 0.452 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(S(N)(=O)=O)c(Br)s2)n1 728731653 UTEDEMNMRBENID-UHFFFAOYSA-N 497.374 0.470 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1)c1ccc(Br)cc1Cl 728869815 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PQEVWZPGEHPPAI-JOCHJYFZSA-N 453.455 0.171 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(F)cnc1Cl)CCO2 1779032349 NSTLHZRECQVCAY-HXUWFJFHSA-N 462.869 0.630 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCc3cnc4[nH]ccc4c3)CCO2)C1 1779034129 NPNRHVDEOCZDKV-XMMPIXPASA-N 477.525 0.638 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)o1 1779371762 MFUHUBNNMOGZCT-VGOFRKELSA-N 463.535 0.739 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnn3n1)C2 1779372205 BNTTVGNZFMMEHT-AUSIDOKSSA-N 478.513 0.169 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)N(C)C(C)=O)CCO2 1780097782 JWSPATFSYQEOHE-PEBXRYMYSA-N 476.486 0.830 50 20 JCGD CN(C)c1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1780642455 IDXGYZMISWUVTJ-HSZRJFAPSA-N 452.515 0.508 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780775033 VDXOWTOLJLJHMM-HPTBWKMGSA-N 451.337 0.898 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)C3CCN(c4ccccn4)CC3)C2)C1 1780958624 RUAHTZBPJIEXLI-RUZDIDTESA-N 478.358 0.122 50 20 JCGD CN1CCCn2nc(C(=O)N3CC[C@]4(CN(C(=O)CCBr)CCO4)C3)cc2C1 1782562775 UGCMAWVLKPKOBD-IBGZPJMESA-N 454.369 0.947 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1783771561 QMDWMSJLKOTURQ-HXOBKFHXSA-N 481.594 0.659 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)CC1 1784084430 QTTFYCGPWODKIZ-JONQDZQNSA-N 459.971 0.871 50 20 JCGD O=C1CSc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)ccc2N1 1784090892 QBAMLVKNWDDZOJ-SDADXPQNSA-N 453.948 0.924 50 20 JCGD CCn1nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c2ccccc21 1787215244 QRGCONYZAPEEMF-ZRCAFCQKSA-N 491.552 0.962 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3nnc(C)s3)C[C@@H]21 1787506839 PZBWOJHHEYEOKO-NBSPSWBDSA-N 487.586 0.893 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4c(c3)NC(=O)CO4)[C@H]2C1 1788364152 UZFLWMWOOVINCD-XSWJXKHESA-N 451.907 0.865 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3ON=C(c4ccccc4)O3)[C@H]2C1 1788521451 DBQRSIPCOBLVFB-QHXHSKPESA-N 451.907 0.955 50 20 JCGD C[C@H](Nc1nccs1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610403 PTMKKZYXYOHDER-PYTWLRIVSA-N 473.559 0.236 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611365 WFTLYGDHDMRJLR-PJODQICGSA-N 495.462 0.345 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccccc3Cl)[C@H]2C1 1791473467 YNAVCTFMCMPLIX-YZZRYBLGSA-N 466.966 0.726 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl)c1ncn2c1CNS(=O)(=O)c1ccccc1-2 1793113943 ZHSVFHZPNBMANG-UMPJEAMMSA-N 493.973 0.516 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1csc2c1CCCO2 1796091763 JOFHIHUCOZCWFH-CCWDJLKJSA-N 456.329 0.270 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)c(C)nn1C)C2 1796441266 PWVBSYIMYMKOJV-LVTGYEAHSA-N 459.482 0.205 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796441388 GDGFNRDWAYBHNB-OJTCYLHXSA-N 460.535 0.015 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1799247703 FJIGMWAQIKVQRZ-AKIOZOGOSA-N 479.933 0.957 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(OCC2CC2)cc1F 1799421399 ULLHKCUVWZTZIM-FEJSZKPUSA-N 482.317 0.811 50 20 JCGD CN1CCC(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1802569058 MASCAMSYJBZVAQ-IRLDBZIGSA-N 450.348 0.423 50 20 JCGD CCOc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cn1 1804917573 RDPSMKJXTYESAP-GCJKJVERSA-N 475.314 0.584 50 20 JCGD CN(C)c1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1 1805344047 QCIJKXNQTSQHFC-PXNSSMCTSA-N 463.303 0.449 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)CC1 1807092869 VIYZTMWDJWPDFH-MRXNPFEDSA-N 488.589 0.597 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCNC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362919 MWOORYQQNJRMJO-WMZHIEFXSA-N 489.341 0.229 50 20 JCGD CC(C)(C)OC(=O)CC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807364103 HRAABMHWJQHVFP-PGRDOPGGSA-N 467.331 0.813 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364342 FDPWVIUTURPJJC-IYERYRBDSA-N 451.332 0.632 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807367991 PHADKTQGNRSVKT-QPPBQGQZSA-N 475.358 0.985 50 20 JCGD Cn1cc(CCC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1807431224 YWYHPMXONDJHTB-AVRDEDQJSA-N 476.541 0.766 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc2c(c1)CNC2=O 1810037434 SHORKEMRQCNTHH-AUSIDOKSSA-N 484.321 0.638 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)C2CCOCC2)[C@@H]1c1cccnc1 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O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1nc2c(=O)[nH]c3ccccc3n2n1 1818583979 ICFWRLRCXFUNCN-ZANVPECISA-N 487.929 0.853 50 20 JCGD Cn1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)cc1O 1819401583 JBZFHEHTYGRHQQ-HNNXBMFYSA-N 453.463 0.467 50 20 JCGD Cc1ccn(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819792836 BWVQKCQDZVZADP-GFCCVEGCSA-N 454.516 0.573 50 20 JCGD O=C(/C=C/C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)NCc1ccco1 1820055009 MRWNHGRYHUQWOQ-SCOAYWHSSA-N 494.338 0.514 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1824462339 RKNKFVBTHNGOGG-FUHWJXTLSA-N 473.640 0.307 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@](C)(O)CC(=O)O)CC2 1826090155 XGINHZBBPSRZTJ-WYRIXSBYSA-N 455.537 0.044 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1827971944 PTCWBNBAVLEWES-HNNXBMFYSA-N 488.375 0.964 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1COc3ccccc3O1)CCO2 1832499619 VLCVADGQNYLYDW-RRMPHLOHSA-N 454.907 0.537 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1832544989 XKGMZQBOLUFKFU-SVQXRNPESA-N 487.981 0.512 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832793137 DWTLLIYXMVQTGW-GUYCJALGSA-N 474.312 0.279 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccon1)CCO2)NC(=O)NCc1ccccc1 1834489016 IODRRKNBRPXWLI-QHCPKHFHSA-N 486.529 0.091 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CNCP(=O)(O)O)CC2)CC1 1834665643 PVCVVEHFZPBSDU-OAHLLOKOSA-N 483.344 0.456 50 20 JCGD Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccc1F 1834797540 WEZBCDDLEVPYIA-UHFFFAOYSA-N 468.338 0.708 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCc3ccc[nH]3)CC2)CC1)c1ccc(B(O)O)cc1 1834797897 JFIOHCKLPSNDBG-UHFFFAOYSA-N 452.364 0.513 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)c3ccccc3Cl)CC2)CC1)c1cccc(B(O)O)c1 1834801488 PKNJBWPUAMVTET-HSZRJFAPSA-N 499.804 0.939 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835449737 QYDNOAWUPJCYKQ-APWZRJJASA-N 462.385 0.339 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1 1835645146 UYRQRUVDDDXRRH-LJQANCHMSA-N 458.632 0.474 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(C(F)(F)F)ccn3)C2)C1 1835931316 MNMMYAPCOXJEQZ-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD O=C(Cc1cc(F)ccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934398 YIXZQJKUMKYHLY-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cncc2cnccc12 1836088308 FXRNACOOMKVVRT-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)NS(=O)(=O)CC)CC2)CC1 1836395116 SKEQFYAOYLNBFP-RHSMWYFYSA-N 451.033 0.903 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3cccc(Cl)c3)CC1)CCO2 1836578183 UVTUCCFUTIFMOR-XMMPIXPASA-N 498.772 0.822 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(O)nc3)CCO2)C1 1838645553 KASCHPIZWARWKW-KSFYIVLOSA-N 498.964 0.989 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1 1838789406 OWPFEXARCWFUJT-UHFFFAOYSA-N 499.659 0.218 50 20 JCGD O=C(NCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)c1ccc[nH]1 1839199357 VDWALKSUACQUET-CRAIPNDOSA-N 475.315 0.282 50 20 JCGD O=C(c1cc2cccnn2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201180 YTYUJHIRKUFDRI-WMLDXEAASA-N 456.272 0.490 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203088 ZFDGQMYAELXZLQ-RFUYNDQBSA-N 487.326 0.347 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCOCCOCCOCCOC)CCO2)C1 1839220235 BYBHIKPNHRSKPH-DENIHFKCSA-N 495.013 0.547 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1839964380 PWUHYMVKQBCBKU-KXBFYZLASA-N 466.336 0.973 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)nc(O)n3)C2)C1 1839964417 RASSXOARRDDSGL-APPDUMDISA-N 459.297 0.131 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCc3ccccc3C1)CCO2 1839994460 YVABRFZFPIEERL-SQJMNOBHSA-N 472.586 0.621 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1840031974 JFZNEKJRQVFBDK-FZKQIMNGSA-N 452.309 0.583 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1 1840184425 LLSIDJYPATUZPP-MHECFPHRSA-N 489.573 0.079 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010497 VVIQHTKQOSMPPG-IBGZPJMESA-N 471.363 0.973 50 20 JCGD C[C@@H](CBr)C(=O)N1CC2(CCCN2C(=O)C2CCN(S(C)(=O)=O)CC2)C1 1843837060 VYECSIKJOSQOKM-ZDUSSCGKSA-N 450.399 0.892 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](F)(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1843953769 RWLKYBFVLFNZCM-QHCPKHFHSA-N 475.326 0.533 50 20 JCGD CN1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1845039153 KKBGDNLEMSQABI-FQEVSTJZSA-N 456.591 0.878 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H]2C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1846157704 HMEPDZGEHNTYPW-NTKDMRAZSA-N 483.374 0.831 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1847064140 ARFRHFUQVDXKIO-UHFFFAOYSA-N 450.499 0.241 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2cc(OC)c(OCC(N)=O)c(OC)c2)c2ccccc2c1=O 15721004 OJXHUJZXORBJQS-UHFFFAOYSA-N 469.454 0.373 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1 725741965 WSSKXARPIRGVAU-UHFFFAOYSA-N 468.561 0.066 50 20 JCGD CC(C)Nc1ccc(S(=O)(=O)NCC(=O)N([C@@H]2CCS(=O)(=O)C2)N(C)C)cc1[N+](=O)[O-] 728180376 ZLUQFIUVLBJVLX-CYBMUJFWSA-N 477.565 0.186 50 20 JCGD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728889731 OEOBFRUCCXMJNZ-AWEZNQCLSA-N 462.532 0.216 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2F)c1 729276068 WLOHJZGLGOTGQK-NSHDSACASA-N 458.493 0.325 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)COc2ccccc2O)C1 730782229 JPEVBSVZABRBDU-CQSZACIVSA-N 452.489 0.624 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)COc1ccccc1O 730836344 QULHOTWNHFDFGK-UHFFFAOYSA-N 451.457 0.058 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)c1cccc(NC(=O)C[C@H]2SC(N3CCCCC3)=NC2=O)c1 753003098 TZYUYEFXWGZEKX-MRXNPFEDSA-N 488.570 0.785 50 20 JCGD CCn1c(=O)c2ccccc2n(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1=O 756514173 AEKYEGIDQRDRKM-UHFFFAOYSA-N 458.858 0.841 50 20 JCGD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1 912764997 WUQUPUAAVMPUTK-UHFFFAOYSA-N 454.486 0.681 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cc(C)nn1C)N(S(C)(=O)=O)CC2 917523037 SWANSFFOVMRXGF-OAHLLOKOSA-N 465.532 0.456 50 20 JCGD O=C1CCc2cc(S(=O)(=O)NNC(=O)c3csc(N4CCOCC4)n3)c(F)cc2N1 917723497 GXSBTFJRQDTILF-UHFFFAOYSA-N 455.493 0.627 50 20 JCGD COc1ccc(S(=O)(=O)Nc2ccccc2C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 920746264 VHTPLSZQPWLZDB-ZDUSSCGKSA-N 482.540 0.627 50 20 JCGD Cc1ccc(C(=O)NCC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)s1 1251590098 OASUGXURVLUHJH-UHFFFAOYSA-N 451.574 0.866 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(OC)c1 1780534918 OJHXHDITMSVHNO-QHCPKHFHSA-N 454.288 0.141 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](N)c1ccccn1)CCO2)NC(=O)NCc1ccccc1 1780969425 GPVQQZMLUPZIFZ-DHLKQENFSA-N 495.584 0.258 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1)NC(=O)NCc1ccccc1 1780970635 WEEALFSGRTYESS-OFVILXPXSA-N 487.601 0.979 50 20 JCGD COC(=O)[C@H]1CCC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)C1 1782164208 FLSOZDTUXQGBMS-YBJWPOLQSA-N 480.606 0.853 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783023483 WSACRMQLDLFZJB-CNNODRBYSA-N 496.402 0.974 50 20 JCGD Cn1c(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc2ccccc21 1783898154 CQBWLXHTQMYSOW-APTRMMRNSA-N 475.354 0.694 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1cccc(Cl)c1 1783934766 MCGCDECFVQXFPA-GGAORHGYSA-N 493.992 0.720 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)C1 1783950179 LDTXBNLGBIAXCV-MOPGFXCFSA-N 466.362 0.992 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCNC(=O)OC(C)(C)C)C2)C1 1785334114 MGAFCVZMDMLCSZ-VUEBRRCKSA-N 490.561 0.865 50 20 JCGD CN[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21)C(=O)O 1786893977 PGOLCIKAMVVPCH-QXKUPLGCSA-N 490.985 0.161 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4cc(Cl)ccc4n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979581 ALYQURJEASBTIG-QSFXBCCZSA-N 482.733 0.575 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(F)cccc4n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981978 URZGFINRIFTMCK-IEZWGBDMSA-N 466.278 0.060 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4ncccc34)C[C@@H]21)c1cccc(B(O)O)c1 1786983296 MLMGULANWSTJAE-HYVJGQCMSA-N 459.311 0.822 50 20 JCGD CCc1oncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508618 CXDKEIPVEYYXQD-WILUMGJWSA-N 456.503 0.964 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)ccn1 1787508846 MMXGIRYIWWHRHQ-JFNRATEESA-N 495.540 0.767 50 20 JCGD COc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)cn1 1787509106 ZYPPXEGGTJLBJZ-XGBLWMCESA-N 469.502 0.213 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C[C@@H]21 1791293753 HSHNCVMOFZOWPY-IEZWGBDMSA-N 467.530 0.401 50 20 JCGD COc1cccc(Cl)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1792019177 VHKNYVBLQDSEPK-KNBMTAEXSA-N 472.734 0.936 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1792094922 NSKCHAAEOIUWKP-BUKVSMQUSA-N 499.760 0.885 50 20 JCGD CC(C)(C)OC(=O)N1CCn2cnc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)c2C1 1792981873 YEEVFJIGDXRJNF-FSDCSDTHSA-N 497.980 0.437 50 20 JCGD O=C(C[C@H]1NC(=O)NC1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1793945651 RSNLQBILGIGNIW-WXQHOCMDSA-N 493.358 0.180 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCS(=O)(=O)CC1 1794088744 KHVAYNCRVDAVSE-XQLPTFJDSA-N 450.399 0.386 50 20 JCGD COc1ccc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)ccc2c1 1795734256 LNSNQIOYPYEVGF-FEJSZKPUSA-N 475.310 0.440 50 20 JCGD Cc1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(C(F)(F)F)o1 1796407919 QBYKBOCWYJBHPH-GNXNZQSNSA-N 482.419 0.517 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)C(=O)c1ccccc1)C2 1796439565 LNOQIHOFSLTSBL-SZGIVFOPSA-N 494.552 0.482 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccoc3cn1)C2 1797753880 JHZMLKIOWYPVGI-HBCWATKFSA-N 450.455 0.343 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(CS(C)(=O)=O)nc1)C2 1797954752 GRIYHHXOFGBIRX-HGKCTWBKSA-N 469.636 0.681 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCSC(=N)N)C2 1798522324 PCECSNVWAPROCY-IVWMJMPLSA-N 479.515 0.740 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl 1799282683 VBTXICGSOPANMQ-QYTFOEQGSA-N 495.404 0.581 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C 1799353444 DERCYSXBIOOJRZ-DGADGQDISA-N 463.959 0.106 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1(O)CCC1)NC(=O)NCc1ccccc1 1801587053 RTZRWFSBDWHRMG-HATOLVCRSA-N 473.574 0.227 50 20 JCGD COC(=O)C1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN(C)NC(=O)NCc2ccccc2)C3)CC1 1801708373 MIBJNUWHCVSWGL-REPLKXPHSA-N 471.558 0.924 50 20 JCGD C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1803008801 OUXOAOIUUKPNLM-XNRPHZJLSA-N 477.296 0.843 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)N2CCCC2)[C@H]1c1cccnc1 1804152819 JIGRJIYDZFPKNG-YADARESESA-N 472.590 0.863 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)c1 1805131492 SNMQDJRDDGAGRL-UHFFFAOYSA-N 484.383 0.929 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1F 1807369716 SMYXOZPJXLKBIG-XLIONFOSSA-N 465.294 0.576 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCCC2(CCN(C(=O)c3ccc(B(O)O)cc3)CC2)C1 1807372387 NPPISWLLJGRTIZ-UHFFFAOYSA-N 450.304 0.019 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809968843 GNSMSLPZAYAPTC-UHFFFAOYSA-N 499.398 0.465 50 20 JCGD CN(C)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809975074 RYBUJCZHOGBRPD-UHFFFAOYSA-N 450.348 0.986 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1nc(O)n2c1CCCC2 1810589698 JIUPNQTZSPLCEB-PGRDOPGGSA-N 489.341 0.633 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccccc2C(N)=O)[C@@H]1c1cccnc1 1811283074 LWUQEDPIXUMFFP-KKSFZXQISA-N 487.520 0.812 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc3c2NC(=O)C3=O)[C@H]1c1cccnc1 1813073353 LOHFVUYQHWNLPN-ZHRRBRCNSA-N 492.536 0.909 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1nccc3nc[nH]c13)CC2)c1cccc(B(O)O)c1 1815354921 XGAANHGKVSAKNR-ZDUSSCGKSA-N 462.300 0.634 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2 1817283031 QTWQDJUFPKZWHQ-UQJRAWQTSA-N 488.574 0.562 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cnnn2)[nH]n1 1818112162 VEZGCELOOZURCJ-AQXNZCSYSA-N 453.467 0.223 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401489 DQOIMTOFRHFQCU-HNNXBMFYSA-N 463.520 0.149 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819789939 AOYDZVGZMVMINV-FZMZJTMJSA-N 459.532 0.282 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn3cccnc3n1)CC2 1819796808 HIZCGGQCLQCJNF-LLVKDONJSA-N 477.510 0.724 50 20 JCGD Cn1ccc(=O)cc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797881 NZORMUFYZGYVLC-LLVKDONJSA-N 467.511 0.380 50 20 JCGD C=C(CC(=O)OCC)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1822928096 QZHPKOKXXIRRDE-GFCCVEGCSA-N 472.527 0.877 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824530757 PVQBYCIYLPCURY-LJQANCHMSA-N 458.563 0.833 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CCn3cncn3)sc2C1 1826606282 ZESRSERHZVXUNW-PKCARXMOSA-N 469.531 0.871 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057501 GLBHFHBEUICJIM-LAUBAEHRSA-N 457.380 0.905 50 20 JCGD N=C(N)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1 1828974651 PXRSSSZFGJOWMT-OXQOHEQNSA-N 468.917 0.456 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1)CCO2 1830418618 KXAOBQATBQFBEI-RQTOMXEWSA-N 482.317 0.379 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1830540433 QANFYUXKPCVNBK-KDOFPFPSSA-N 462.341 0.316 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)C3(C(=O)Nc4ccccc4)CC3)C2)C1 1830724776 CDCGVHRARHNVOD-DYESRHJHSA-N 465.934 0.461 50 20 JCGD CC(C)[C@@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)N1Cc2ccccc2C1=O 1830726559 QRLCZPUAYMNJHH-MZLICYQSSA-N 493.988 0.723 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1831329299 LLXUIVDJTZHASP-COXVUDFISA-N 474.407 0.007 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)CC1 1832288458 LXTBQFWGWCVWKE-RERIAJOISA-N 469.550 0.988 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)cn3)C2)C1 1832549697 XZEGDOPOMYVCAD-JTSKRJEESA-N 498.964 0.989 50 20 JCGD O=C(NCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)c1cccs1 1833030922 ALCNHPYPIFFIKB-GOSISDBHSA-N 474.377 0.719 50 20 JCGD Cc1oc(C(C)(C)C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1834198906 VQRHUMFHAPUVGQ-RUZDIDTESA-N 484.358 0.949 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C(F)(F)F)o1 1834216986 UTYXETKJPHCBSW-OAQYLSRUSA-N 496.247 0.670 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)nc3)CC2)CC1)c1ccc(B(O)O)cc1 1834798028 NQQQSQDRNNWNQL-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3nccc4nc[nH]c34)C2)C1 1834822500 QWQWQNWKWGVBJH-SFHVURJKSA-N 452.309 0.813 50 20 JCGD O=C(C#CC1(O)CCCCC1)N1CCOC[C@@]2(C1)CN(C(=O)CCBr)CCO2 1834823526 ZXLLPWSBJNFQEC-HXUWFJFHSA-N 457.365 0.926 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939718 FPGLEIRVMACABK-YASZXKAXSA-N 494.353 0.549 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccs3)CCO2)C1 1835968440 JRXPZDSOIZGDPE-GZNAHNRGSA-N 450.561 0.591 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(C(F)F)c3)C2)C1 1837456357 GWNGSFKIGFRVSH-JOCHJYFZSA-N 490.467 0.402 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CS[C@@H]1CCCCO1)CCO2 1837510153 CYAUWLDMCZEXMF-NHCUHLMSSA-N 472.608 0.076 50 20 JCGD O=C(CC(F)(F)C(=O)O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920396 TZRLAXWHWHXBAS-UHFFFAOYSA-N 468.262 0.089 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cc(CO)on3)CC2)CC1 1838394759 UKFSZXOITOYEHM-UHFFFAOYSA-N 472.502 0.091 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1F)CCO2)NC(=O)NCc1ccccc1 1839098193 FVBVSVQKSIIDMH-YYDVJCTNSA-N 477.537 0.147 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1839146741 VCSNHYLLPDSWQS-MGPUTAFESA-N 451.911 0.418 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4c(c3)NC(=O)CS4)CCO2)C1 1839578431 BUEIPMIKAZVBIS-XOBRGWDASA-N 484.962 0.450 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc4ccc(F)cn4n3)CCO2)C1 1839623437 ZIKYDIBLXMTOMV-YJYMSZOUSA-N 484.326 0.969 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc[nH]n3)C2)C1 1839743233 FBZLHPRGYIFJJR-LFEYGZQNSA-N 458.425 0.760 50 20 JCGD Cn1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)n1 1839801736 APOZLMDXVWBNBU-DYESRHJHSA-N 492.374 0.891 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nn(C)c(C)c3Br)C2)C1 1840154587 ZYSPLLBJNSSTCQ-ACJLOTCBSA-N 493.786 0.815 50 20 JCGD COc1ccccc1CC(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184696 BEUUAPAQDOKSPI-QHCPKHFHSA-N 462.547 0.067 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840333529 BOROXOCFEAYHRS-XDHUDOTRSA-N 482.541 0.029 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCCc3cccnc3)CCO2)C1 1840511379 LORNOUWBCCIOOI-DYMLFOFBSA-N 496.568 0.995 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840867559 XJYUJNSBAJWGLI-KKSFZXQISA-N 475.970 0.300 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C[C@@H]2C[C@@H]21 1841359418 USQLVYLKGQZTKB-WDSOQIARSA-N 469.347 0.581 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C1 1844263502 LDBTZWWGLGZLBD-KRWDZBQOSA-N 488.545 0.138 50 20 JCGD Cc1nn(C)cc1C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038309 OMZXOZINMYGOPZ-UHFFFAOYSA-N 453.547 0.892 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)Cc1ccc3ncnn3c1)C2)NC(=O)NCc1ccccc1 1845039254 XJYWJAHPFPTDLI-UHFFFAOYSA-N 490.568 0.821 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OC(C)(C)C)C2 1846386093 BFOMVJCBHALEFP-KRWDZBQOSA-N 491.593 0.422 50 20 JCGD CN(CCCC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)C(=O)OC(C)(C)C 1847076220 DTGRLQKRXVDFTB-UHFFFAOYSA-N 459.352 0.831 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1847082094 JMXKECHMKSXNSK-OYLFLEFRSA-N 484.557 0.972 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)=NO2)C1 1847562358 CCDTZZLBOYLZTD-SOUVJXGZSA-N 456.927 0.554 50 20 JCGD Cc1cccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 9746190 XRBJOOIIPROJIC-UHFFFAOYSA-N 462.528 0.925 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)c1ccc(C)c(S(=O)(=O)N2CCOCC2)c1 15884637 FGDGNJXZNSYIRW-UHFFFAOYSA-N 463.512 0.865 50 20 JCGD CCN(CC)S(=O)(=O)N1CCN(C(=O)NNC(=O)c2cc(Br)c[nH]2)CC1 22423141 SMXKSPPKLJZSBY-UHFFFAOYSA-N 451.347 0.336 50 20 JCGD C[C@H](NC(N)=O)C(=O)NNC(=O)CN(Cc1ccccc1)S(=O)(=O)c1ccc(Cl)cc1 26773271 LHWZMKQYJVCXSH-ZDUSSCGKSA-N 467.935 0.735 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CS(=O)(=O)NC1CCC(C)CC1 726869264 NKLUJMAQUPCBDQ-UHFFFAOYSA-N 459.594 0.547 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)cn1C 729451926 KBFMDRCRYKFUFC-UHFFFAOYSA-N 458.544 0.932 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)COc2ccccc2O)CC1 730825412 AECDBCMJDNLZTA-UHFFFAOYSA-N 451.480 0.181 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCc2nc(O)c3cnn(C)c3n2)cc1OC 900690459 FQMDFMKSXGZYDH-UHFFFAOYSA-N 458.431 0.023 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCc1ccccn1 915885042 GLQJEAQNCLFNDH-UHFFFAOYSA-N 461.544 0.608 50 20 JCGD O=C(NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)c1ccc(-n2cnnn2)cc1 916105831 MBIZSKNCAQSZQJ-UHFFFAOYSA-N 477.528 0.070 50 20 JCGD O=C(NCCNC(=O)c1ccco1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 916259295 CJGJKICMBYPMEI-UHFFFAOYSA-N 463.516 0.828 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)NC[C@@H]3COCCO3)c2)cc1 918109283 ZITALCUHDYQXLD-QGZVFWFLSA-N 464.500 0.855 50 20 JCGD CCCn1nc(C(=O)NNC(=O)CN2C(=O)c3ccccc3S2(=O)=O)c2ccccc2c1=O 921192415 LOUKYYPSVPJANR-UHFFFAOYSA-N 469.479 0.412 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1nc(C)no1)C2 1778090836 BLEAATJPLYCMMH-MIBZKUIYSA-N 471.518 0.568 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778113881 GFBMEJDMLTUBAC-QFBILLFUSA-N 450.001 0.895 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccn2nccc2c1 1779161855 HRBGLOKDGZMNKK-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCSC1)C2 1779376187 ZSOXYQWIAOCPPY-QXATTWAWSA-N 461.588 0.956 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(Cl)nn2)C1 1779632959 RVPZNTXFUFSEBD-FOIQADDNSA-N 452.943 0.631 50 20 JCGD Cc1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)sc1C 1779981992 UMWXNASMFWXPAS-XMSQKQJNSA-N 457.361 0.881 50 20 JCGD COC(OC)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780558684 CXFWQEVBFAWVKD-NTKDMRAZSA-N 491.589 0.465 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)N1C[C@H]2C[C@H]2C1 1780967943 FHPQZEPTGBESNE-QSAXNBNMSA-N 498.628 0.503 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccn(C)n1)CCO2)NC(=O)NCc1ccccc1 1780968632 CRMZWMWZCNJSJR-HSZRJFAPSA-N 469.546 0.210 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1O 1781980124 QHRIQYYJISCGBH-HSZRJFAPSA-N 469.498 0.547 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc([N+](=O)[O-])c1OC 1782116870 SETKNYXNOKGCIY-QHCPKHFHSA-N 499.285 0.049 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)n1cnnn1 1782866569 CVBYTFJVCCBZLK-XTVULVGKSA-N 457.441 0.949 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](Br)Cc4ccccc4)C3)C2)O1 1783019103 SJPHBFHCHBUSLM-GUXCAODWSA-N 466.332 0.931 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(=O)O)ncn3)C[C@@H]21 1783969731 PBGPQGVMWFFCQL-YXMPFFBPSA-N 455.309 0.799 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]4C3)CC2)CC1 1784092539 MNIJHTXQQYUZPB-UVUJQTEASA-N 499.052 0.289 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)C1CCC(F)(F)CC1 1784272369 GKHHFXNJWPPNHE-WDSOQIARSA-N 450.291 0.785 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3COc4ccccc4O3)[C@H]2C1 1785043524 LJVKIDAGKVCFDT-CPLUKWAASA-N 460.531 0.179 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCn3cncn3)C[C@@H]21 1785079775 ZNBCYBCNGAEFKJ-QAETUUGQSA-N 484.985 0.780 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Cl)CCO3)C(=O)C1 1785669894 QZPBUCAAIAEECL-JXFKEZNVSA-N 476.933 0.430 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1787507712 LTMSAGLADZTOHV-BCJGNJTBSA-N 472.315 0.791 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nn(C)c4c3CCC4)C[C@@H]21 1787508640 FEIPFJHZJSJWHX-MDUUWBQSSA-N 481.557 0.636 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3ON=C(c4ccccc4)O3)[C@H]2C1 1788521447 DBQRSIPCOBLVFB-BWRRFVNYSA-N 451.907 0.955 50 20 JCGD COc1cc(C)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610255 SUHWWWYFVRPTNV-JHVJFLLYSA-N 467.526 0.909 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)s1 1788611542 LWSAOTATQRMHJY-RCBQFDQVSA-N 459.528 0.662 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc2ncsc2[nH]1 1788786101 OAFZWTLRFYRUSC-YEWWUXTCSA-N 454.317 0.211 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)CCOC1 1789914008 QAOXMWPLRJVVLJ-KUSYAZKWSA-N 475.970 0.250 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[S@@](=O)c1ccccc1 1790598096 ZFWVBHVQIMVVPH-OJZOHFENSA-N 484.383 0.156 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccc(Cl)cc1 1792947294 JPKUSSWNQJKSDK-ZSBFGKGUSA-N 471.901 0.425 50 20 JCGD CC(C)(C)OC(=O)N1CCC(F)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CC1 1792972926 WIUBFPMGFBBWGM-FZKCQIBNSA-N 477.961 0.915 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)[C@H](F)C1 1792974867 GANVCECIEDIACD-IZKTWJBDSA-N 477.961 0.771 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792983124 FGHUILVPRAPYDU-RMCNWUJSSA-N 457.955 0.574 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1COCCN1C(=O)OC(C)(C)C 1793603605 YYBHUSPWUJDKOF-ZHCJQAHYSA-N 475.970 0.466 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)C(F)F)NC(=O)NCc1ccccc1 1793705887 MULKVTJTXCYDHC-SCAQPMJSSA-N 489.470 0.823 50 20 JCGD NC(=O)[C@@H](N)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1795637900 SNOAWZYLWWNQQU-OREBXVKISA-N 481.391 0.175 50 20 JCGD Cc1ocnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798269453 HAKIKRJFDRNIDG-RMFSNUHRSA-N 470.530 0.532 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798440321 XOBVYTOINPXILV-NRSFXHEJSA-N 451.531 0.942 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799341982 AYZOBXIVSOITMX-PPCPHDFISA-N 468.320 0.152 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1799365010 JESHPURUAQCDAA-OPDFLTKYSA-N 454.351 0.655 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1c(=O)oc3ccccc31)C2 1800974109 KTBKNPZJEQAWHY-NXEZDXNNSA-N 451.907 0.828 50 20 JCGD O=C(CN1CC(=O)NC1=O)NC[C@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1804187517 YSOSZHDDLQOLEY-CXAGYDPISA-N 452.309 0.424 50 20 JCGD COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804971073 LNHMTAVGSOFDGE-FXAWDEMLSA-N 461.287 0.193 50 20 JCGD CN(C)c1ncc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)o1 1807365627 ZEWGRYYLSMPYNX-PXNSSMCTSA-N 463.303 0.449 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807616725 OJEZOGXBULFJJB-PZJWPPBQSA-N 496.373 0.994 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810249503 YJKHSVPPRXBLIJ-HLAWJBBLSA-N 451.332 0.654 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810295327 SGQWAXKOXKGONR-DBVUQKKJSA-N 467.530 0.314 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc(Cl)nn1 1810680238 CRRGBNMBOIRGTN-UZLBHIALSA-N 465.706 0.838 50 20 JCGD O=C(CCc1ccc(O)nn1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1812324551 QQMYEWVMHPIWBH-FDDCHVKYSA-N 475.314 0.209 50 20 JCGD COC(=O)C1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1812690186 NLGTZYGAHIPKBB-YJBOKZPZSA-N 466.498 0.353 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1 1813071467 SQCDRDDKKZMURV-UWJYYQICSA-N 464.530 0.817 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cncn1-c1ccncc1)CC2)c1cccc(B(O)O)c1 1815354794 FFNNMNRZGJDJMW-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD Cc1nn(C)c(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c1F 1816242926 IKGBXWFQLOTQCJ-INIZCTEOSA-N 454.271 0.890 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)[nH]n1 1819402129 OTVATEFMIBIDJU-INIZCTEOSA-N 479.457 0.516 50 20 JCGD CC[S@](=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1819515333 YUIIBODTFHMZQV-JTZKDVPQSA-N 464.573 0.526 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(O)n1)CC2 1819796063 YZEZDTFSKRDNQB-SNVBAGLBSA-N 453.484 0.782 50 20 JCGD CCc1cc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)n(C)n1 1820633026 PVKXHEYKHPGQSJ-GFCCVEGCSA-N 468.543 0.977 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H]2CNC(=O)C2)n[nH]1 1821961558 JBFQRCOFRXHZJD-PXGVHXGZSA-N 454.491 0.672 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)C3CCC4(CC3)OCCO4)sc2C1)c1ccc(B(O)O)cc1 1824899302 FKEIELJVARMWRA-KRWDZBQOSA-N 485.371 0.982 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826090202 ZWNHTGTYZIVIJA-RYUDHWBXSA-N 455.537 0.990 50 20 JCGD O=C([C@H]1CCCS1(=O)=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060640 WAIZUCWWGBEORG-WOJBJXKFSA-N 462.377 0.177 50 20 JCGD O=C([C@H](O)CCl)N1CCC([C@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)CC1 1827674372 VYIYWLBHXSXBDU-IAGOWNOFSA-N 450.001 0.631 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](N)CN)CC1)NC(=O)NCc1ccccc1 1830165327 BWLUGTZCCDNZHI-LEWJYISDSA-N 473.622 0.238 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccccc1 1830408039 RZSNYVHVMWBODD-CBGDNZLLSA-N 469.922 0.140 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)nc2ccc(Cl)cn12 1830735755 MMWZNZFPNHRNCT-YWZLYKJASA-N 471.341 0.966 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)C(C)C)CCO2 1830870578 XKKVDDWJNVLYNM-KNQAVFIVSA-N 479.486 0.607 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3COc4ccccc4O3)CC2)CC1)[C@@H](O)CCl 1833308497 UNWJMQBFBWNFLM-PXNSSMCTSA-N 451.951 0.998 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833310984 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COc1ccc2oc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2c1 1835930515 LDTUDMCLOTUTRA-RUZDIDTESA-N 494.309 0.505 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c(C)n1 1835939878 LVRMRJJUHWDOTL-RUZDIDTESA-N 481.358 0.081 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1836634647 KSUBXGZMCYNFFH-WHSLLNHNSA-N 475.970 0.300 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CNC(=O)c3cccnc3)CC2)CC1 1837123331 OTSFCVIVNRYLCI-UHFFFAOYSA-N 488.589 0.183 50 20 JCGD Cc1nc(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cs1 1837163126 MAQPZQAUVMRUDW-UHFFFAOYSA-N 471.388 0.986 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cc(C)on3)CCO2)C1 1837545641 WVYPDIGPMWPZTM-QRWLVFNGSA-N 456.927 0.577 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n[nH]1 1838394521 GAFAVVFHSIDYIE-UHFFFAOYSA-N 455.519 0.643 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202707 NDYYMQBEZQXAQB-GUYCJALGSA-N 468.320 0.658 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)n4ccnc4n3)CCO2)C1 1839549766 JPXULRVWEOPGRB-MGPUTAFESA-N 451.911 0.362 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3nscc13)CCO2 1839575655 CZGYULGRWNMGFI-QHCPKHFHSA-N 481.339 0.360 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1839946054 WJUAOPBHCPYBMG-DFBJGRDBSA-N 466.343 0.549 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4ncccc4n3)C2)C1 1839964731 AZPGBIQKGJCWNX-KUHUBIRLSA-N 466.336 0.973 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)N3CCN(C)CC3)C2)C1 1839966184 WUPSKJUDUNBJPW-ZWOKBUDYSA-N 475.428 0.252 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1 1840033815 ROPJVTWGFGGHCO-RBZFPXEDSA-N 466.332 0.783 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3CNc4ccccc4O3)C2)C1 1840153002 AQBUXYDKUIMHKX-HYFFOGBASA-N 467.950 0.960 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(O)c4ccn(C)c34)C2)C1 1840154539 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1845014603 XNXFYZNPEFIJSO-LLVKDONJSA-N 483.388 0.828 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCn2ccnn2)C1)NC(=O)NCc1ccccc1 1846623366 BGWGQJOQHSIUTE-UHFFFAOYSA-N 454.535 0.218 50 20 JCGD COCCOc1cc([N+](=O)[O-])c(C(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1OC 24757130 AFTSPBGSLJKAOF-UHFFFAOYSA-N 471.426 0.950 50 20 JCGD COc1ccc(Br)c(C(=O)NNC(=O)[C@@H]2CC(=O)N([C@H]3CCS(=O)(=O)C3)C2)c1 728527487 KYMJJKJVLNUJEO-MNOVXSKESA-N 474.333 0.254 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728959859 RBTZUGYOWXYHAJ-UHFFFAOYSA-N 492.334 0.896 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CCCC(=O)NC(C)C)N(S(C)(=O)=O)CC2 729516524 YTEAGYWLYYTNKW-KRWDZBQOSA-N 498.602 0.795 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2cccc3cccnc23)c1 747428887 QXZJDBHCXKEGNF-UHFFFAOYSA-N 457.512 0.888 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)NCc1cccs1)N[C@@H]1CCS(=O)(=O)C1 751363326 SSEWLWGYDSHOKL-SNVBAGLBSA-N 478.599 0.419 50 20 JCGD O=C(NCc1ccc(Cl)cc1)C(=O)NNC(=O)c1ccc(N2CCCS2(=O)=O)cc1 857480062 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O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1779351247 OEVPSXYMDDXUGK-LJQANCHMSA-N 451.210 0.471 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)nc1 1779371229 UYQUXNXCMLBONK-HYBUGGRVSA-N 481.557 0.587 50 20 JCGD NC(=O)c1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2 1779937723 NFYWHTQJBIQQIS-KZULUSFZSA-N 454.325 0.488 50 20 JCGD CC[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)N(CC)CC 1782209480 SGCRPSRTWVJUQG-YCRNBWNJSA-N 453.628 0.994 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1782563702 FYOCYEFZCSDVCB-OTZYPNAKSA-N 496.572 0.296 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782784578 VVZBUAQCJDEHAM-QGZVFWFLSA-N 457.281 0.371 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)C(Cl)(Cl)Cl)C2)C1 1783270432 UZZQKIPLJDSJAF-OAHLLOKOSA-N 450.710 0.499 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984842 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475.509 0.498 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)CCOC1 1800142080 LEOQDEDNLDGPKU-NRAIQUKZSA-N 487.362 0.302 50 20 JCGD C[C@@H](NC=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800436051 JSSJVTUPFPNNMO-SOVHRIKKSA-N 452.349 0.717 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)ccc(F)c1F)C2 1801010831 XVVDXIKMJKOSSE-NGVSDPCNSA-N 456.465 0.609 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C(F)(F)F)ccn1)C2 1801011927 VEVQPMOFZMXUFM-IVWMJMPLSA-N 457.453 0.677 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)n1cncn1 1801359133 KTXAELAHBXFPML-FIIQBIKZSA-N 472.458 0.576 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368246 RBZAXXXMINAQRR-FDDCHVKYSA-N 460.299 0.424 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCc2cncnc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371052 OXZAQKFZWMSEPX-NZQKXSOJSA-N 459.315 0.504 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc2n(n1)CCCC2 1809865868 SQZWPXPZFKLZAE-AUSIDOKSSA-N 473.342 0.928 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810304140 ABQDXNMZYPTWNL-ZFUCPZCZSA-N 484.513 0.016 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813068481 NBEAEDOFBPZMRI-SYNHAJSKSA-N 467.592 0.141 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813068699 PZPULNUXZPVHRD-WLJPSVCKSA-N 456.547 0.319 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)cn1 1813069726 AXPLPNTULNISMX-VGSWGCGISA-N 469.546 0.963 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1 1813072475 DWWXNBFDXHOVRZ-JTSKRJEESA-N 464.530 0.817 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(CO)on1)CC2 1817281609 KELGVOPDMQHRCC-IVWJEFBKSA-N 471.499 0.983 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1 1819403965 POSJMUSHOUTXJS-JKSUJKDBSA-N 475.531 0.291 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3cccnn3n1)CC2 1819798032 RFDZWNVGEADMCF-NSHDSACASA-N 477.510 0.724 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2 1822478749 RCNVPBGGJCHQGK-JQWIXIFHSA-N 469.976 0.560 50 20 JCGD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052435 ZEEUHBYOUQTMKA-QGZVFWFLSA-N 455.280 0.545 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCCC3)sc2C1 1828401198 GJUDDQGPLADMMA-CYBMUJFWSA-N 457.560 0.853 50 20 JCGD N=C(N)SCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828946178 ODMYYEVKNOGCMM-IIBYNOLFSA-N 498.005 0.665 50 20 JCGD O=C1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](F)Cl)CCN3C(=O)OCc2ccccc2)=NN1 1829056852 QQDVZMLBPLLAHV-DYESRHJHSA-N 479.896 0.849 50 20 JCGD O=C(Cn1nccn1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829232088 LAMSOGQWMHUDFY-PGRDOPGGSA-N 490.948 0.330 50 20 JCGD Cc1c(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)cn2[nH]cnc(=O)c12 1829597325 VGOYZLYIBIJSOS-OAQYLSRUSA-N 491.357 0.558 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](N)c3ccccn3)C2)C1 1830538209 YEWZZIYLKDMCLN-IDHHARJASA-N 455.353 0.569 50 20 JCGD CC[S@](=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830541369 ZORYNONRONKKMP-CHLCXMBXSA-N 453.399 0.633 50 20 JCGD O=C(c1cc(Cl)c2nncn2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830730562 BFRXGYFDKTZRQW-RDTXWAMCSA-N 458.302 0.052 50 20 JCGD O=C(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)Nc1ccc(F)cc1 1830733812 UDRKCRSNXMPFAZ-OXQOHEQNSA-N 457.886 0.210 50 20 JCGD CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)CC1 1832111634 MJHTWOYFBXBKSO-QRWLVFNGSA-N 493.960 0.739 50 20 JCGD COCc1oncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835235458 KHCICWLYQPNJPG-UHFFFAOYSA-N 485.545 0.319 50 20 JCGD Cc1cc2cccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2[nH]1 1835930584 NYLUWMLTBGDQJL-RUZDIDTESA-N 477.326 0.540 50 20 JCGD O=C(/C=C/c1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935458 FUAHBULZRJAGEO-HBRDYDSTSA-N 450.300 0.150 50 20 JCGD COc1ccc(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1O 1836600136 IUKXCEDCSXCKLZ-UHFFFAOYSA-N 496.369 0.936 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921715 VIKKMVMJYGPGQK-UHFFFAOYSA-N 479.342 0.391 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1838101479 QBCDSCNWHBLJFR-GNYKCMPYSA-N 488.589 0.986 50 20 JCGD O=C(c1nc2ccccn2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199382 NSWNFBGVJGPWKD-CXAGYDPISA-N 456.272 0.490 50 20 JCGD O=C([C@@H]1Cc2ccccc2CN1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199850 XBROGSNPYATYMZ-ABSDTBQOSA-N 470.339 0.848 50 20 JCGD O=C([C@@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839201941 NZELCILMHQSKJJ-YGOYTEALSA-N 450.074 0.824 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1 1840154058 JVYFVRUBYIUSJI-QVKFZJNVSA-N 479.921 0.764 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)n4ccnc4n3)C2)C1 1840154653 BOLVZNKNPHSWGD-QRWLVFNGSA-N 451.911 0.362 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1840184796 BVYAPPJKCRMZIM-ROUUACIJSA-N 453.367 0.052 50 20 JCGD CCOC(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)OCC 1840282707 MRJPNDZMOPFZHP-WBVHZDCISA-N 455.321 0.923 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1840289827 NZYRKFDYNQPMBJ-WAWZGNHOSA-N 477.917 0.903 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840738123 PMTOMXHVHZXYBD-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc1 1843012238 RPDAPFICPIIGOQ-UHFFFAOYSA-N 479.342 0.289 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012685 FRKCZYHGYAUCPO-UHFFFAOYSA-N 459.352 0.734 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015051 CGCVRTYDMQEIHX-UHFFFAOYSA-N 455.301 0.884 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)C1 1846134176 NXSRWNBXHQDSDZ-HGKCTWBKSA-N 463.579 0.676 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H](F)CN1C(=O)OC(C)(C)C)C2 1846385124 UZNIQUXJVJFELN-CVEARBPZSA-N 469.558 0.910 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]3O1)C2 1846386060 ZCENNZXHENPVNS-KURKYZTESA-N 493.605 0.587 50 20 JCGD CN(CCCC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)C(=O)OC(C)(C)C 1847076909 YENOLXBACGHFAH-UHFFFAOYSA-N 459.352 0.831 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1847723766 OOZIGWLUWMYCJS-OALUTQOASA-N 475.351 0.113 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CCN1C(=O)[C@H]2CCCC[C@H]2C1=O 15315234 RHIRPOILYWMLOK-BGYRXZFFSA-N 455.559 0.911 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1nc(-c2cccs2)n(-c2ccc(F)cc2)n1 729276040 VYXLUWJTXIEXKW-SNVBAGLBSA-N 452.493 0.834 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCN(C)C(=O)OC(C)(C)C)nc2)CC1 729611283 MGTFVEWIGVBIAG-UHFFFAOYSA-N 471.584 0.511 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2c(F)cccc2Cl)c1 730583783 KQKCKKSQEJIOSV-UHFFFAOYSA-N 456.883 0.920 50 20 JCGD COCCCOc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cn1 751043406 MTVARWAPEXHLIW-UHFFFAOYSA-N 478.527 0.593 50 20 JCGD CC(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 915802110 KHXIYWKJZJAOGA-UHFFFAOYSA-N 495.579 0.964 50 20 JCGD COC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1 917718378 XPALDRUKVNDNEM-UHFFFAOYSA-N 473.554 0.943 50 20 JCGD CCS(=O)(=O)c1ccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)cc1 917720140 CQTUYFBUTKRXEN-UHFFFAOYSA-N 489.597 0.419 50 20 JCGD O=C(NNC(=O)/C(=C\c1ccco1)n1nnnc1-c1ccccc1)N[C@H]1CCS(=O)(=O)C1 919889461 MMKNZHQTUPGODP-LUYJPIOASA-N 457.472 0.449 50 20 JCGD COc1ccc2nc(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)ccc2c1 1777894176 KZOLIXAWTNJXPN-VWLOTQADSA-N 475.310 0.681 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1778344681 AVGDZYLXWINAAX-GXYOHSSGSA-N 459.971 0.919 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1C[C@]1(F)Cl)C2 1779374686 CENWJOBVRTVJRP-PBGAUENZSA-N 453.902 0.737 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374715 YZBRCPKFHZOKHJ-UZSYQUHHSA-N 477.518 0.374 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(=O)ccn1C)CCO2 1780097845 OFOGEGCBFQVPLW-QHCPKHFHSA-N 484.465 0.976 50 20 JCGD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1OC 1780385222 SKZRTJPTGJAWQX-RCZVLFRGSA-N 482.342 0.825 50 20 JCGD CC(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780558680 CIJIFSHHUWKTCQ-AUSIDOKSSA-N 459.547 0.436 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)c1ccccc1)CCO2)NC(=O)NCc1ccccc1 1780968756 FCFVWCRVOBYPKG-BVAGGSTKSA-N 495.580 0.896 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3c2OCCC3)C1 1781266071 ZZIPEBLOWSSPFA-VGOFRKELSA-N 462.551 0.166 50 20 JCGD CCNC(=S)NCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1782646957 ZRAQQVUCZCWDQR-NRFANRHFSA-N 493.542 0.448 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cn3c(Cl)cccc3n1)CCO2 1783934688 KKXLPARTZWUCRO-NRFANRHFSA-N 462.938 0.804 50 20 JCGD CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784092087 GDTQSYFGTOKJKZ-GQGQLFGLSA-N 494.397 0.905 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21 1784444227 IKVOOULERSDONK-NDKCEZKHSA-N 454.387 0.077 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786979592 BIUWHDHCPBMCCW-QQOZLPODSA-N 451.332 0.460 50 20 JCGD C[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)NC(=O)OC(C)(C)C 1786979707 ATJWJJSGBDYYOZ-LQJIQPLVSA-N 489.378 0.263 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786981901 OTFUERKILFTSEE-HARLFGEKSA-N 466.343 0.899 50 20 JCGD Cc1cn2c(=O)c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)cnc2s1 1788037099 UWOLQCLGYDGEOP-MHEUCROKSA-N 454.936 0.257 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21 1788639876 HVVUXNQAJYXHAB-XLAORIBOSA-N 458.584 0.312 50 20 JCGD COc1ccsc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789077079 ZVAYLUNSZNUPBM-NUTKFTJISA-N 459.528 0.662 50 20 JCGD C[C@@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nccnc3C(N)=O)[C@H]2C1 1789090517 IWTHSGRBSFKCNM-CYDGBPFRSA-N 454.325 0.200 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4ccc(C#N)cc34)[C@H]2C1 1790330276 FOLPWCUGAQRDAP-IEZWGBDMSA-N 467.530 0.401 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1791434862 ZWZMDZIDRUGDKZ-GVRJEKJASA-N 473.954 0.492 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792979154 XUVPZHHEKCPWQY-VPSLKNMFSA-N 491.894 0.340 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)[C@H]2OCC[C@H]21 1792982664 LSGLGBWXQUOVMF-UATDDVEISA-N 487.981 0.200 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(Cl)c(F)c1)C2)c1cccc(B(O)O)c1 1795737834 YWUGFLSDMBGXKT-VPTLXERWSA-N 460.698 0.605 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(C(F)(F)F)n1)C2)c1cccc(B(O)O)c1 1795740213 FXCMMXVUTCUGCY-JJLQDPRZSA-N 469.250 0.359 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1c(I)ccnc1F 1796510014 LDOYDOWZEVQZJD-PKCZLINISA-N 497.692 0.628 50 20 JCGD CCOc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1OC 1797754280 PTBJZKUHQFEQNE-GPVSGQMNSA-N 497.552 0.538 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799040031 XLSWDASETKYDGJ-XEMDLRDOSA-N 474.363 0.328 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cccn2)cc1 1799600788 IGMZEUBPMVVWNC-OPMZPASUSA-N 454.531 0.449 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1800976952 DRNHLWZOSXZUFC-DMUMMCEESA-N 481.981 0.176 50 20 JCGD CCOC(=O)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)Cc1ccco1 1801234044 NCDIJWJLIWWPOB-CXHZTBPHSA-N 457.911 0.427 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(-c2ncc[nH]2)cc1 1801818535 JAXDLWBHXBXDHH-CEQLMSFQSA-N 460.299 0.274 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)[C@@H](O)c2ccccc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362728 HWFGPKCYVHSWCC-PUHATCMVSA-N 459.311 0.815 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCCn2ccnc2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368510 UKSRNWGPAYNVLY-OFNKIYASSA-N 461.331 0.758 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2cscn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371693 XWWHHGDTUZXWLC-UTKZUKDTSA-N 450.329 0.780 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3ncnn3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376848 WRQHMSOAHQGIDE-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)Cc2ccc3ncnn3c2)[C@H]1c1cccnc1 1807416448 FQUULKVENWGQCM-YADARESESA-N 478.557 0.746 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1CC[C@H]2CCC(=O)N2C1 1807736634 VEAFTVBHJKPHSB-CGCKEFBRSA-N 490.369 0.482 50 20 JCGD Cn1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c2c1CCC2 1809359878 IPFXTVCGHGEMTP-MBSDFSHPSA-N 473.342 0.617 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(O)nn2)[C@@H]1c1cccnc1 1810297685 CMJOCKGIWUWXEX-IFXJQAMLSA-N 462.470 0.209 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc(O)nc2)[C@@H]1c1cccnc1 1811462272 YIZAMWROQDBKJK-YWZLYKJASA-N 461.482 0.814 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccc(-n2cncn2)c1 1811824688 VJXKMHWOCHRJLL-QPPBQGQZSA-N 496.336 0.976 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813089846 AJXNHANHTAETFJ-YSIASYRMSA-N 457.361 0.195 50 20 JCGD Cn1cc(CCC(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1 1815354867 WALIXXLCFWVIKU-INIZCTEOSA-N 453.333 0.415 50 20 JCGD O=C1Nc2c(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3cccc(B(O)O)c3)CC4)cccc2C1=O 1819344899 SBKAUYQTFZGMRR-CYBMUJFWSA-N 490.306 0.497 50 20 JCGD O=C(Nc1cccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1820046015 PQHSHDGTCGKAKJ-AWEZNQCLSA-N 465.300 0.082 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2 1826644679 YNQUOUMBYYFDBB-LERXQTSPSA-N 454.940 0.125 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830647693 XSSBCEJUGZSSEH-WIYYLYMNSA-N 453.898 0.837 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)cc1 1830727058 ZXBJXYUCMBSTFP-PSHVLCQKSA-N 452.935 0.855 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NO1)CCO2 1831263180 NJKLSWBIUXZJNO-GBXCKJPGSA-N 487.557 0.009 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832724031 KCJYBLIXIUCGSB-UTKZUKDTSA-N 452.939 0.675 50 20 JCGD CCc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833973043 PESHLAZWEMTZDR-UHFFFAOYSA-N 464.375 0.823 50 20 JCGD Cc1nscc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834042359 PPXMAHUZGJTTAQ-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1C 1834173183 SUFRUZCYUDWMCT-UHFFFAOYSA-N 468.562 0.226 50 20 JCGD Cc1ncsc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834224517 UUVXICCJZLCIBE-UHFFFAOYSA-N 471.587 0.949 50 20 JCGD CCc1[nH]nc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1F 1834797563 ZLCVSBCPCRUPFE-UHFFFAOYSA-N 471.342 0.290 50 20 JCGD CCOc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)cnc2c1cnn2C 1836377933 CKAOSHCXJCVNHX-HTAPYJJXSA-N 495.964 0.691 50 20 JCGD Cc1ccc(F)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457091 XJDPSDOPGSTZST-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD CNC(=S)NCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1837467205 ZLWMCSPATLXVOF-DLBZAZTESA-N 455.408 0.163 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=N/O[C@@H]3CCCCO3)CCO2)C1 1837531493 NTFOIWSJPZCZEK-LVZGSSTFSA-N 457.600 0.823 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)c(=O)[nH]c1C 1837710254 RCDUULRGLYDODJ-HXUWFJFHSA-N 452.584 0.308 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)C3(Br)CC3)CC2)CC1 1837920319 ZMASNGOOIQMYCV-UHFFFAOYSA-N 479.180 0.906 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC2)CC1 1837922032 CPUUOXSXHGUPOY-IRJFHVNHSA-N 458.364 0.530 50 20 JCGD O=C(c1cncc(C(F)(F)F)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838179916 UMHZDZFXBRMTJT-WMLDXEAASA-N 451.829 0.770 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)nn1 1838754686 RJHDKMMUDRFQQO-GOSISDBHSA-N 458.357 0.888 50 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GWDBDKKFFOLXKS-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C#N)cc3Cl)C2)C1 1840185889 ZRHLWFMXZWAQFD-JOCHJYFZSA-N 477.949 0.655 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)cn1 1840187560 JCTQYQVELLLYFL-SFHVURJKSA-N 480.370 0.500 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCSC1)CCO2 1840862964 PXFOZZXQIUWUOR-TUGUMKMLSA-N 477.587 0.720 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843013925 DWDKDJQQSGUMJI-UHFFFAOYSA-N 457.336 0.440 50 20 JCGD C[S@@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847442445 GLOVLTGWVXEQSZ-SNKCDODMSA-N 466.000 0.450 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1 15639379 VFWLRNBJSPNDRO-NSHDSACASA-N 451.954 0.566 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)COc3ccc(C)c(C)c3)c2)CC1 15886458 PJACBPBXWDWMQJ-UHFFFAOYSA-N 488.566 0.996 50 20 JCGD C[C@@]1(C2CC2)NC(=O)N(CC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)C1=O 22245146 HXAXWWVWZZBAPC-QHCPKHFHSA-N 499.549 0.647 50 20 JCGD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 726380248 ZMOCXLXOSHBSRR-LBPRGKRZSA-N 458.500 0.393 50 20 JCGD O=C(CCNC(=O)c1n[nH]c2ccccc12)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 726883854 MVTPFKAILPDIKL-UHFFFAOYSA-N 484.538 0.929 50 20 JCGD CN(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(=O)OC(C)(C)C 728713414 SZLPTMOTOITHNB-UHFFFAOYSA-N 456.521 0.335 50 20 JCGD NC(=O)c1ccc(S(=O)(=O)N2CCN(C(=O)NNC(=O)Cn3ccc4ccccc43)CC2)o1 729511236 XYMIOOGHCNODJZ-UHFFFAOYSA-N 474.499 0.081 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)COc2ccccc2O)C1 730778729 UHKGYADBGRXDNP-CQSZACIVSA-N 451.505 0.359 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1OC 789852656 OURCJFAZICFGCH-UHFFFAOYSA-N 475.483 0.335 50 20 JCGD CCn1c(CCC(=O)NNc2nnc(C)c(O)n2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 817277568 KCYLVGVSHICGKY-UHFFFAOYSA-N 490.546 0.352 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3ccc(Cl)cc3)cc2)CCN1 914462948 IOWMCOUQTZGTGM-UHFFFAOYSA-N 450.904 0.464 50 20 JCGD Cc1ccc([C@H](CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)N2CCOCC2)o1 916229231 NAYNASBCRMBJIU-SFHVURJKSA-N 479.559 0.856 50 20 JCGD Cc1cc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)ccc1N1CCNC1=O 919690653 SEPDJUJVAMKELG-UHFFFAOYSA-N 451.892 0.900 50 20 JCGD CSCC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919886511 UMNMFUITKZJNMN-LSSCYMHBSA-N 490.629 0.216 50 20 JCGD O=C(CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 921299000 UHRFYXPFMPZMSD-JENIJYKNSA-N 495.627 0.958 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nc3ccncc23)C1 1777908097 FWNLNMCWYQGXJK-WZONZLPQSA-N 478.513 0.398 50 20 JCGD NC[C@H](N)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1778003342 VYKGHGXZGQANNT-LXGFNABISA-N 467.408 0.793 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4ncoc4c3)C2)C1 1778005006 KCFUAOSVKWZQOQ-QFIPXVFZSA-N 450.455 0.584 50 20 JCGD C[C@H]1CCc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cnccc3C(=O)NN)C4)n[nH]c21 1778605498 TTZJHKYYUITKJR-NDGOPHNLSA-N 481.557 0.899 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4ncoc4c3)CCO2)C1 1779032722 WWUSPWTUAMKWEY-JOCHJYFZSA-N 450.455 0.584 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779545321 CCHLYRKHBDZNFR-DYESRHJHSA-N 463.611 0.664 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccnc2C(N)=O)C1 1779941837 UFMZZTZFFDSHTC-QQGDVQBRSA-N 458.346 0.939 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1780713560 YKSWAFXYRVUIMW-LSTHTHJFSA-N 457.163 0.730 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(-n2cccn2)cc1 1780968082 YRNDRYWLGMKJNO-ZEQKJWHPSA-N 488.353 0.993 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)Cc3cnn(C)c3)CCO2)C1)NC(=O)NCc1ccccc1 1780969691 PFKXBOOPPWTVQL-DEOSSOPVSA-N 483.573 0.139 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)C1CCC2(CC1)OCCO2 1781642266 KHKBXCKUFJFODU-ZJSXRUAMSA-N 486.374 0.427 50 20 JCGD C[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)N1CSCSC1 1782214778 MOGCHTCDBHTJIO-CSODHUTKSA-N 487.692 0.916 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1 1782482997 STSSHHYLWQNJCB-QFIPXVFZSA-N 467.461 0.458 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(Br)nc1F)CCO2 1783936146 HBWFVGJVIAUWCD-IBGZPJMESA-N 486.342 0.800 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783937066 FGBSHONAISNMQH-QFIPXVFZSA-N 450.511 0.580 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3cc([N+](=O)[O-])cn3)[C@H]2C1 1785218428 AWWVAEDLBYMKJX-MXAVVETBSA-N 458.313 0.945 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1787395325 GMSIIEKTEDLLPB-HTVCTNPSSA-N 482.347 0.542 50 20 JCGD Cc1cn(CC(=O)NC2(c3ccc(NC(=O)c4cccc(B(O)O)c4)cc3)CCC2)c(=O)nc1O 1788150416 XHKYGDXNKTYJGQ-UHFFFAOYSA-N 476.298 0.385 50 20 JCGD COc1ccc2[nH]cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]43)c2n1 1789189908 BDGVLRRVLWFUMP-ZVZYQTTQSA-N 472.546 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1ccc(C2(NC(=O)[C@@H]3CCC(=O)NC3)CCC2)cc1 1789519714 GFZVVWLXYGCHQU-CQSZACIVSA-N 450.499 0.959 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4cccnc4nc3O)C[C@@H]21 1791293817 LADLPMGIUYNBAU-SZMVWBNQSA-N 470.530 0.302 50 20 JCGD COc1ccc([C@@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1792827440 PGRPZCHITJGGJN-HCBXPFHNSA-N 452.316 0.382 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc[n+]([O-])c1)NC(=O)NCc1ccccc1 1794543375 KJSNONDGEOPSSG-WKCHPHFGSA-N 466.542 0.918 50 20 JCGD Cn1nccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1794782811 GTKAQCWZNCPRFY-FQLMCAECSA-N 455.943 0.755 50 20 JCGD COc1ccc([C@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795737689 JVPTZBOPBCBUES-XCRNZQRYSA-N 452.316 0.382 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(C)c3c1CCC3)C2 1796442087 QDUYCHVRJSEMRI-DHMDNZFNSA-N 467.530 0.246 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1796909668 MBMOLFYBABTPCD-DVWBAYGPSA-N 472.590 0.838 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)C2)NC(=O)NCc1ccccc1 1799097490 MQOWDABRQAIWOI-UPHUGPLXSA-N 499.528 0.472 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(-n2cccn2)cc1 1799598770 CHHUYMQGFYRPTF-HATOLVCRSA-N 460.299 0.069 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](N)Cc1cccnc1)C2)NC(=O)NCc1ccccc1 1799871576 OMQLZBLEYJXUEN-BJESRGMDSA-N 493.612 0.936 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1)C2 1800971390 YCHWLHDSSCYMGH-YVSFHVDLSA-N 489.997 0.592 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1Cl 1801792827 XTMAPVIBXRFZGS-HBCWATKFSA-N 473.917 0.864 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NC(=O)c1ccccc1 1802112995 JEUCRJLPNQTMDI-XAMPQXRZSA-N 494.552 0.529 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(-n3cncn3)c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365364 IUEDFHZPLJCLDK-ZJSXRUAMSA-N 496.336 0.976 50 20 JCGD O=C1Cc2cccc(C(=O)N3CC[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)c2N1 1807373498 SGZBWSZKHSKLNT-CYFREDJKSA-N 484.321 0.889 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CN2CCOCC2)[C@@H]1c1cccnc1 1808413979 DEPKQNWCUUKDEB-ZFUWBFJQSA-N 481.557 0.554 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1)[C@@H](F)Br 1808662616 NINODAKLAPKHRD-LEWSCRJBSA-N 479.270 0.218 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnn3ccncc23)[C@@H]1c1cccnc1 1809390465 ZHDKRZCWUIICLE-VGSWGCGISA-N 464.530 0.817 50 20 JCGD Cc1noc(CC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)n1 1815562777 RJHCSQDXBRZOTP-SNVBAGLBSA-N 456.488 0.302 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819400211 DVUQVBKRMKISLH-NVXWUHKLSA-N 456.507 0.629 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)COc2cccnn2)n[nH]1 1822755387 OTNVINZLABZQOT-INIZCTEOSA-N 465.474 0.583 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1827030686 FYYUZMKPHWBFIU-LRDDRELGSA-N 453.333 0.815 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CC(=O)NC2=O)CC1 1827677181 LTGYPNQLWNMGDC-GTPWMTBTSA-N 485.545 0.292 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](O)N2CCOCC2)CC1 1828967186 MLUQODLTNSGGLM-AZDINULQSA-N 488.589 0.391 50 20 JCGD NC[C@H](N)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1829050524 QZWDSLZTUIPUGI-YWZLYKJASA-N 472.373 0.528 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCOCC3)C2)C1 1830538120 WHFJHUJUAAWLGM-LPHOPBHVSA-N 462.385 0.196 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830538716 NTEPQZUMYNXWHO-MLLBMZPXSA-N 498.378 0.608 50 20 JCGD CC(F)(F)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1831678924 GKFNLUOFFMFVGX-NRFANRHFSA-N 454.279 0.118 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnnn1C)CCO2 1833232719 UTOCGSMARJAEGJ-NRFANRHFSA-N 488.457 0.032 50 20 JCGD CC[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1833262676 SNIZVFSJLHHOHU-JOCHJYFZSA-N 488.633 0.675 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833263691 RDLHAVRLDPVUDZ-OAHLLOKOSA-N 480.212 0.583 50 20 JCGD CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)NS(=O)(=O)CC)CC2)CC1 1833451337 FSKZIXWFBHCUEU-YOEHRIQHSA-N 451.033 0.903 50 20 JCGD COc1nn(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1833860961 PLOIYXPVDQZNNP-UGSOOPFHSA-N 459.341 0.530 50 20 JCGD COc1nn(C)cc1C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1834081358 FYAFACFTNLICNG-JVWAILMASA-N 498.588 0.748 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4ccccn4n3)CC2)CC1)c1cccc(B(O)O)c1 1834799942 GXOHPKGTBWDENG-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD Cc1cccc(CCC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1834800131 XEOIUOJXGCIODW-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)ncc1[N+](=O)[O-] 1834800152 SXECFXHFWNCZSY-UHFFFAOYSA-N 495.345 0.477 50 20 JCGD COCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1835226673 QTRIXZGYICXGJS-YWZLYKJASA-N 463.959 0.611 50 20 JCGD COc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)ccc1O 1836303203 CTDUYPVWKGWILN-UHFFFAOYSA-N 475.590 0.959 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](N)Cc1cccnc1)CCO2 1836505771 CWTKIXMVVDDTMG-URLQWDBASA-N 455.353 0.191 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)N1C[C@H]2C[C@@H]2C1 1837921180 JGHSYVQMZDTZKV-MISYRCLQSA-N 469.391 0.319 50 20 JCGD O=C(/C=N/N1CCCCC1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921242 PFHJEQIGHFGVIA-NLRVBDNBSA-N 470.379 0.450 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922006 AIZCGWLPJLIFDO-UHFFFAOYSA-N 474.363 0.568 50 20 JCGD Cc1noc(CC(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1837950181 NYOMLDBANUTPFF-UHFFFAOYSA-N 471.518 0.231 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)[C@H]3CC[C@H](O)CC3)CC2)CC1 1838395304 BJSBYCGVCUCKTA-QAQDUYKDSA-N 473.574 0.848 50 20 JCGD O=C(c1ccc2nonc2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200706 LLAVAAXPBYLQEH-WMLDXEAASA-N 457.256 0.983 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1 1839489170 OSUXEECUAWWNLJ-KKSFZXQISA-N 461.906 0.758 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cnn3c1OCCC3)CCO2 1839517287 SYYUHBDWTLANEL-SFHVURJKSA-N 457.325 0.521 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(N(C)C)o3)C2)C1 1839963643 QWWPMFYCXAIUBP-ACJLOTCBSA-N 459.341 0.984 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1840077351 OEPIAWARKDORAS-NRFANRHFSA-N 476.643 0.364 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1 1840185312 JYYWTZSCKGBOSE-XMMPIXPASA-N 484.557 0.315 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)cc(Cl)n3)C2)C1 1840186033 ZGUUSDPLKACPFP-FQEVSTJZSA-N 488.372 0.831 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(C(=O)OC)cc3)CCO2)C1 1840279683 WOLHTEOMPUVDJA-PGRDOPGGSA-N 468.934 0.726 50 20 JCGD C=C1CC(C(=O)N2CCCC23CN(C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C3)C1 1841018553 WDFUIHRISZPJFX-NRFANRHFSA-N 497.401 0.972 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@@H]1F)C2 1843428586 CETDGQBCYWNHTG-QYZOEREBSA-N 489.353 0.364 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@H]1CC[C@@H]3CCC(=O)N3C1)C2)NC(=O)NCc1ccccc1 1845039179 NQHACGADHVFBOB-LEWJYISDSA-N 496.612 0.937 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1846311627 PPVRKHJVJFKUBH-IBGZPJMESA-N 473.379 0.980 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)cc1 10601936 JNAYMFUCMJSLQG-GOSISDBHSA-N 477.495 0.518 50 20 JCGD C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 27229820 PUIXZQBAKFHCCO-UHFFFAOYSA-N 490.563 0.457 50 20 JCGD O=C(COC(=O)CCNC(=O)c1[nH]nc2ccccc12)NNC(=O)[C@@H]1COc2ccccc2O1 110927489 XRNVGJZBWUXNIS-KRWDZBQOSA-N 467.438 0.213 50 20 JCGD O=C(Cc1cccnc1)NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1 728856139 HYSNYMWSFJCDGU-UHFFFAOYSA-N 452.436 0.474 50 20 JCGD O=C(CCNS(=O)(=O)c1ccccc1F)NNC(=O)C1CCN(c2ncccn2)CC1 728889308 BYKUOYBWOYFRBM-UHFFFAOYSA-N 450.496 0.348 50 20 JCGD O=C(NCc1cccc(C(F)(F)F)c1)NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 742454091 STWVGMNJGMSVOO-GXTWGEPZSA-N 462.450 0.571 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)Cn2c(CS(C)(=O)=O)nc3ccccc32)cc1C 793202619 KYLLTPDQMUCJKX-UHFFFAOYSA-N 457.512 0.984 50 20 JCGD O=C(C1CCN(S(=O)(=O)c2ccc(Br)s2)CC1)N1CC[C@@H](B(O)O)C1 864234105 MUBCCJHKVRTUSO-LLVKDONJSA-N 451.173 0.987 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@H]2CS[C@H](Cc3ccccc3F)C(=O)N2)c2ccccc2c1=O 891625029 KCNKKWKABBPRDA-IAGOWNOFSA-N 469.498 0.677 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCN(CC(=O)NNC(=O)Cc3nc(C)cs3)CC2)c1 914576021 PLFOJMZCDSVXHE-UHFFFAOYSA-N 461.544 0.617 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CC(=O)N(c3ccc(F)c([N+](=O)[O-])c3)C2)c1 915166083 ZBXAWGOONIMZMM-GFCCVEGCSA-N 464.431 0.952 50 20 JCGD CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CC1 916134420 LULIQCIIZPTFPQ-UHFFFAOYSA-N 473.621 0.891 50 20 JCGD CCC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 917542089 ZKTXNHLWKFBRSV-GOSISDBHSA-N 480.587 0.436 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCc1nc(C2CC2)no1 918233971 XEWJAVRYNZIAJP-UHFFFAOYSA-N 478.531 0.431 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC=C3C(=O)NC(=S)NC3=O)cc2)cc1 920977813 OOTALPLJRXUKHI-UHFFFAOYSA-N 487.563 0.465 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3c(n2)OCCO3)C1 1777953750 JFETXGUOMOCHLN-NTKDMRAZSA-N 496.524 0.293 50 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JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(N2CCOCC2)cc1 1787545630 HABGZCJEGKQBSP-OYDLWJJNSA-N 493.369 0.110 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)CBr)C[C@@H]21 1788468993 GQMWKVBDFLUNJO-CXOVXGEYSA-N 450.330 0.062 50 20 JCGD C[Si](C)(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)co1 1788589674 MVYFDESYRAGFEV-JVPBZIDWSA-N 485.617 0.730 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(F)nc3F)C[C@@H]21 1788607756 FJWVKLMANQGZDN-UVBJJODRSA-N 460.441 0.265 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)c[nH]3)C[C@@H]21 1788610127 FFHZXZACHGWGAB-KCTSRDHCSA-N 480.447 0.939 50 20 JCGD O=C(COc1cc(Cl)ccn1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788728763 ZOHSVINWTLACMA-SNRMKQJTSA-N 473.722 0.087 50 20 JCGD O=C(Cc1ccc2ncnn2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1789717319 YCKRHMBVPMKMEI-AYMQEEERSA-N 454.300 0.942 50 20 JCGD Cc1nnc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)o1 1789726655 KIQCUDIPTZVGLC-UFYCRDLUSA-N 499.572 0.246 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc([N+](=O)[O-])c1OC 1790301460 TWWHQBFTVPNREK-ONQXIZJVSA-N 471.894 0.805 50 20 JCGD O=C(CN1C(=O)CSC1=S)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1792313999 SKTRULCLMKUABZ-UHFFFAOYSA-N 483.380 0.974 50 20 JCGD CC#CC[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)c1ccccc1 1795734566 RSCYZXIZRVEIGU-DVKRWUGUSA-N 460.339 0.767 50 20 JCGD CCOc1c(F)c(F)cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1F 1795741445 ZJEUQVXVKNNVJU-VTEUUUEMSA-N 492.259 0.699 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1796189929 DUFYILJPQQOAHX-HTUFRPJOSA-N 477.370 0.254 50 20 JCGD CC(C)(C)OC(=O)N1C[C@]2(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)C[C@H]1CO2 1796191703 PDFWNMOWMDKSGR-MDFABALLSA-N 499.373 0.397 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccnc1C)C2 1798522939 GRYAXRFYKUBWNH-VPTLXERWSA-N 471.470 0.928 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798577684 MJVUCDIMGSOEMM-AYWYSENESA-N 482.589 0.899 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccc(O)cn1)C2)NC(=O)NCc1ccccc1 1799098231 CYMHJHJWEKBURE-NHKMSHSESA-N 496.568 0.266 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O)C2 1799268427 SIHDCRNMHQCHCY-IAFLNBNSSA-N 459.971 0.821 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl 1799273911 VCUWESXJJLZLOC-QEAYJNAZSA-N 468.378 0.698 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCNC(=O)c1ccccc1 1801950076 DCVVGJIUYHRXEM-IIMWNBLQSA-N 494.552 0.530 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1 1804197028 CUDBIHKMYJEZMJ-ZVZYQTTQSA-N 487.420 0.601 50 20 JCGD 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NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2nccnc2C(N)=O)CC1 1828923864 BYNHFAONHRFJCX-QGZVFWFLSA-N 480.529 0.121 50 20 JCGD C[C@@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)n1ccnn1 1828924652 WMQIYDNVUHZBMU-KXBFYZLASA-N 454.535 0.771 50 20 JCGD COC(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1829931327 FTJZNPHUUWNORW-YCRPNKLZSA-N 477.986 1.000 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1 1830730829 DXWSTLDDFHSOOA-XLIONFOSSA-N 470.910 0.331 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732006 OVNHMNVVWHEMMI-DNVCBOLYSA-N 462.330 0.803 50 20 JCGD O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830735593 IWOSXHUPSJLPJX-DNVCBOLYSA-N 467.866 0.141 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1830883223 CJLVXQZFHNNMNJ-TYILLQQXSA-N 467.922 0.253 50 20 JCGD Cc1cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)nn1C 1830945682 PLCXJWDHAIEBPI-AUUYWEPGSA-N 457.369 0.758 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1)n1cnnn1 1832289373 TVBNQHZQNDMOFV-KDOFPFPSSA-N 455.523 0.166 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C)c(C)n1)CCO2 1833690913 XUQQUNUIVYDQQJ-JZZXMACJSA-N 482.541 0.902 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)CN3CC(=O)NC3=O)CC2)CC1 1833711943 NXHYCDBJXNHKHR-IBGZPJMESA-N 462.378 0.346 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CCCC1)CCO2)NC(=O)NCc1ccccc1 1834651382 VLJDYZMXRQQPTP-RUZDIDTESA-N 487.601 0.979 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CCO2)C1 1835350845 DMCXOAXRDKIVPC-RXVVDRJESA-N 488.990 0.343 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCN(C)CC3)CCO2)C1 1835404719 LGXWILBYLWDXTE-PXNSSMCTSA-N 475.428 0.254 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCC4)CC2)CC1 1835609157 VJMWELFHZWNUJR-UHFFFAOYSA-N 480.573 0.327 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)Cc3cscn3)CC2)CC1 1835736941 LRIZGVQORVDGSI-UHFFFAOYSA-N 471.587 0.570 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cn3ccncc3=O)CC2)CC1)[C@H](F)Br 1836413450 CSDLUNUKYNLYIK-KRWDZBQOSA-N 458.332 0.505 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836781387 QRKKQDORMAPDPI-VLIAUNLRSA-N 498.378 0.260 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ncsc13)CCO2 1837070258 BIDJUOCSNFGVLU-QHCPKHFHSA-N 481.339 0.360 50 20 JCGD CN(C)c1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1 1837324054 SQJBQWWYBSITIY-UHFFFAOYSA-N 480.374 0.753 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc(C)c1O 1837461248 RHCBOQROLUODAW-XMMPIXPASA-N 483.525 0.391 50 20 JCGD C[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2)c1ccccc1 1837461335 USIUWHIHEFWFAI-AVRWGWEMSA-N 481.553 0.949 50 20 JCGD COCc1c[nH]c(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)c1 1838515397 WWJZVIHCCHQDLX-VUEBRRCKSA-N 486.529 0.365 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncn(C)n3)C2)C1 1838527444 SVIDRPWPXRYJPV-OAQYLSRUSA-N 488.457 0.032 50 20 JCGD O=C(c1cc(Br)c(O)cc1F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838608547 VRVRWDGQZONZFE-YJBOKZPZSA-N 495.729 0.964 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3c(O)cc(O)cc3O)CC2)CC1 1838678341 FROUEPWCMBWKPH-UHFFFAOYSA-N 478.546 0.789 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1Cl)CCO2 1838865903 UTIWXKXVAZYRND-QFIPXVFZSA-N 458.707 0.404 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1F)CCO2 1839000143 UUCAKKZGWDPEDI-NRFANRHFSA-N 454.474 0.408 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839036214 VFFZUNRMNGEOLB-OXTHUFEASA-N 471.913 0.000 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)c(=O)[nH]c1C 1839151090 HZGSFNLCOOBOPS-RBUKOAKNSA-N 461.346 0.693 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3ccc(O)nn3)C2)C1 1839155571 XUVZXMAVRVZUIG-MSOLQXFVSA-N 463.318 0.254 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1839964632 XNKCEPHDNDMBSY-ZWOKBUDYSA-N 469.380 0.581 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cc(C)on3)C2)C1 1839965415 XTIVETNXSVVPEG-KUHUBIRLSA-N 487.351 0.343 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(OCF)cn3)C2)C1 1840030959 BIVGKDJEWOVTAQ-SJKOYZFVSA-N 461.288 0.636 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1 1840035197 JMIAKBRHHUQWOW-SGTLLEGYSA-N 452.309 0.811 50 20 JCGD CC[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)CC1 1840056962 BBKHDNUNOSDTEW-JXQFQVJHSA-N 458.364 0.653 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)C2)C1 1840150234 IBFQKUFWMZLCST-XOBRGWDASA-N 472.926 0.486 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn(C(C)(C)C)c3)C2)C1 1840183685 UDAOIYFEWICADM-QFIPXVFZSA-N 464.567 0.081 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841534752 YGVRDNFJDLVCLN-QGZVFWFLSA-N 458.563 0.451 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@H](CCCNC(N)=O)NC(=O)OC(C)(C)C)C2 1846365768 UWXXTKKVPVQKEW-CABCVRRESA-N 490.001 0.785 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847565550 UONRNMPNUMKDFP-LTIDMASMSA-N 461.868 0.953 50 20 JCGD CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CC1 728204098 TXOJWOAJYDVBHD-UHFFFAOYSA-N 466.969 0.247 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc(Cl)s1)NNC(=O)[C@H]1COc2ccccc2O1 728340011 FFFOFVANVSRCTB-GFCCVEGCSA-N 489.915 0.210 50 20 JCGD O=C(NNC(=O)N1CCOCC1)[C@H]1CCCN(S(=O)(=O)c2ccc(Br)cc2)C1 745988202 VMAWTOWILYYSPZ-ZDUSSCGKSA-N 475.365 0.923 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)c3ccc(C#N)cc3)cc2)CC1 747175253 GXJGMNBUEKOSGJ-UHFFFAOYSA-N 455.496 0.486 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)c2ccccc2c1=O 748466513 ZQIANHJKWSYBCR-UHFFFAOYSA-N 464.530 0.485 50 20 JCGD CS(=O)(=O)Cc1nc2ccccc2n1CC(=O)NNC(=O)c1csc(N2CCOCC2)n1 788874224 HUIDDQFJIGUBEA-UHFFFAOYSA-N 478.556 0.335 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 807135062 JWXDYOBWIIEGTH-UHFFFAOYSA-N 472.531 0.837 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1C(=O)[C@H]2CCCC[C@@H]2C1=O 807726223 CBYFIZPZLOKMOY-STQMWFEESA-N 451.863 0.828 50 20 JCGD Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 818024637 QPWNABADTKVBME-WQRHYEAKSA-N 473.490 0.830 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)NCCc2cccs2)cc1 914465294 PETIEYVZLCLCCQ-AWEZNQCLSA-N 471.582 0.465 50 20 JCGD CCCCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)CC1 916110337 XCJWCWBUBNETFD-UHFFFAOYSA-N 474.605 0.540 50 20 JCGD CCS(=O)(=O)NCCNC(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 916516357 LVKJPIIZECBHKA-UHFFFAOYSA-N 475.574 0.432 50 20 JCGD CNC(=O)CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1 918235654 PADBZVRPNWZSFH-UHFFFAOYSA-N 463.516 0.966 50 20 JCGD CSCC[C@@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)NNC(=O)NC1CC1 920822889 YNPYUDQJKTVUCC-OAHLLOKOSA-N 492.023 0.935 50 20 JCGD Cc1c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)ccc2c1OCCO2 1777930949 NNXDBIGGTMLYFF-ATIYNZHBSA-N 494.353 0.887 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ncc1[N+](=O)[O-] 1779030159 HCJVIWPTGYORLJ-OAQYLSRUSA-N 469.458 0.054 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3cncn3c1)C2 1779372698 XOQIPRRBRWYYQD-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD CCCOc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1780836636 NJVYDQRXTFOHTQ-XMMPIXPASA-N 452.316 0.913 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC1(F)F)CCO2)NC(=O)NCc1ccccc1 1780969052 UODXDVPLASAMBW-DYESRHJHSA-N 465.501 0.818 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)c(O)c(Cl)c3)C2)C1 1782008561 DZDIGSQOCQOUKD-HXUWFJFHSA-N 454.911 0.568 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C1)CC2 1782988910 WDMZEICLBBMKIL-IBVKSMDESA-N 478.354 0.624 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784038452 RCDGUKOZPKAXNT-NYDSKATKSA-N 479.317 0.754 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CCCO4)C2)C1 1784957338 ZMNLEPHWUUGYEV-XMMPIXPASA-N 450.300 0.449 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785547187 SIYRWYUVVARFGU-MEDUHNTESA-N 464.407 0.850 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(N(C)C)c3)[C@H]2C1 1785552890 SUMKAMFAWMSYCU-BORRTEJMSA-N 481.557 0.875 50 20 JCGD COc1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786978652 IALZFPZWYXHCLR-RRPUWOKSSA-N 466.343 0.601 50 20 JCGD Cc1cc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)no1 1788611337 VLARQUSKOUIGCV-KFLKEAKISA-N 454.487 0.288 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1792223525 OMZWMKUMKJOPJH-YTFOTSKYSA-N 479.933 0.957 50 20 JCGD O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2 1795114418 GFMHCVDBZJZMJG-DRXBFXEBSA-N 489.330 0.559 50 20 JCGD CN1CCCn2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)cc2C1 1795116578 UQDGRTWAIVZUAZ-ZSBFGKGUSA-N 454.369 0.707 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn(-c3ccccc3)n1)C2)c1cccc(B(O)O)c1 1795740231 HUNAMAOLXRHNNG-OPMZPASUSA-N 460.299 0.069 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)cc1 1795747913 SVRIVWCDNIAYMO-BCDXTJNWSA-N 464.588 0.780 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798640741 KHHASZFHUKQROM-PLACYPQZSA-N 488.589 0.122 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)cco1)C2)NC(=O)NCc1ccccc1 1799095091 TUSKGTVMZIMQGA-OPMZPASUSA-N 483.525 0.189 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799347665 NIJJCWIWMXMLAS-JLUCKKNBSA-N 478.340 0.520 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803146961 RSZDTQPOGMJIPM-OQIJWPOYSA-N 462.938 0.158 50 20 JCGD O=C(CN1C(=O)CNC1=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1 1804094859 VESNUXRYUZHTOZ-NILFDRSVSA-N 456.272 0.330 50 20 JCGD CCc1[nH]nc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1807361678 HBTMDZFVNOCQGW-HRAATJIYSA-N 465.294 0.819 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnn3ncccc23)[C@H]1c1cccnc1 1808174309 YMIXIBGLDSCSPT-IIBYNOLFSA-N 485.508 0.756 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2CCC3(CCCN(C(=O)[C@H](F)Cl)C3)CC2)N1 1810913526 QSUOZRVFODCNKW-LZWOXQAQSA-N 474.986 0.932 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2c[nH]c(=O)cn2)[C@@H]1c1cccnc1 1811452471 ZMRJFZXCHIHLON-ODZZAOHFSA-N 476.497 0.619 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1812348752 PINYIKHGASLSFG-GWJPWWOOSA-N 495.584 0.674 50 20 JCGD Cc1nccn1CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1812405736 WXFJIBKWEALILF-DYESRHJHSA-N 462.514 0.605 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(=O)c2cccn2C)[C@@H]1c1cccnc1 1813478819 IGPRYGONIDEUOV-UTKZUKDTSA-N 454.531 0.682 50 20 JCGD O=C(CNC(=O)c1ccco1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354638 OFVVNXKUZGXQAB-CQSZACIVSA-N 468.300 0.072 50 20 JCGD Cn1nc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)c2c1CCC2 1818717667 PRHHQUVISFDTFV-LJQANCHMSA-N 462.319 0.931 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc2c(c1)CNC2=O 1819203241 VPZONNSPEYRTEE-HXUWFJFHSA-N 473.298 0.953 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H](O)Cc1ccccc1 1822078611 AOPOPJGKDGCKMV-RTWAWAEBSA-N 462.315 0.999 50 20 JCGD O=C(CN1CCCCC1=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1822300102 XUMUZIMIYXBGOH-SFHVURJKSA-N 453.308 0.408 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2 1824556111 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COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(=O)O)n(C(C)C)n3)CCO2)C1 1833609029 ACJHNMPBXHUGCV-XOBRGWDASA-N 472.926 0.486 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C)nc3OC)CCO2)C1 1833864655 LUUSQOQIFMINMH-RDTXWAMCSA-N 459.341 0.672 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccnc(Cl)c3)CCO2)C1 1834181589 DDZFNOUVTIOKLE-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)COc3ccc(O)cc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797837 LBBNARMNJMRILF-UHFFFAOYSA-N 481.358 0.336 50 20 JCGD Cc1cncc(CCC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834800190 YMMQKVHOXFPEFG-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(Cl)ccn3)CC2)CC1)c1cccc(B(O)O)c1 1834801000 FTVHLKLXCHIXKS-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)n1 1834819594 RTJHJZIXOYSEGD-LJQANCHMSA-N 456.337 0.874 50 20 JCGD COc1cc(Cl)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835942135 XKZPFQSPMIFFBN-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD CCc1noc(C)c1C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1838055595 GMYWXFMWUDEQNV-JKJLQIMHSA-N 486.529 0.749 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839109013 WNNUMUKCLXJRQY-LPHOPBHVSA-N 473.412 0.006 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1839154255 IJBVLASFWOJRHC-UXHICEINSA-N 470.357 0.965 50 20 JCGD O=C(c1cnc(OCF)cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839197714 GLKBXAJOKBELKE-CZUORRHYSA-N 465.251 0.543 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)C1 1839199202 SCQMWJSIBKGSKQ-MOROJQBDSA-N 465.316 0.723 50 20 JCGD O=C(CSc1nc[nH]n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839203459 LTLGDVMMWYGBOX-BXUZGUMPSA-N 452.306 0.044 50 20 JCGD N#Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)ccc1Br 1839400979 LBIDAWGSIYJZOX-APWZRJJASA-N 486.750 0.990 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1840031201 ISEHXCTXOBCCBH-ACJLOTCBSA-N 474.377 0.718 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1 1840153808 ZRMJEWGGCBEUKV-IIBYNOLFSA-N 463.922 0.796 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C)ccc3-n3ccnn3)C2)C1 1840154696 CXPQAYHLSNIEEP-GCJKJVERSA-N 477.949 0.900 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840186557 KWRVCSJXPGBILB-BFUOFWGJSA-N 484.377 0.522 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C#N)CCC1)CCO2 1840813720 QJERPSHSMSJAPA-NJRDNMGOSA-N 456.503 0.271 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@]13C[C@@H]1CCN3C(=O)OC(C)(C)C)C2 1846385833 BPNYTDJQKFDTMM-HJPURHCSSA-N 463.579 0.962 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1846476016 VGYUUNXJISOJST-UHFFFAOYSA-N 451.483 0.531 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1 1847502296 NSFDQCWRIOMKFY-CAEXGNQWSA-N 487.420 0.399 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1cccc(Cl)c1 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NC(=O)c1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cc1 784064615 WCXXBOULPYXDSS-UHFFFAOYSA-N 488.547 0.887 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCC[C@@H]2SC[C@@H]3NC(=O)N[C@H]23)c1 788881191 GIGSNVOHVGBEIX-ZOBUZTSGSA-N 469.589 0.424 50 20 JCGD CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1ccc(N2C[C@H](C(=O)O)CC2=O)cc1 914746341 QXFJZXSLHWTJRD-CQSZACIVSA-N 477.495 0.911 50 20 JCGD O=C(NNC(=O)c1ccc(Cn2cccn2)o1)c1cccc(S(=O)(=O)N2CCOCC2)c1 915801717 CWLLRZUYJJPYOG-UHFFFAOYSA-N 459.484 0.620 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)cc2)c1 915884660 PKCOVDUBLIGSNN-UHFFFAOYSA-N 483.572 0.509 50 20 JCGD CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(S(N)(=O)=O)c1 915938636 CQUQGYVSSWLDQF-UHFFFAOYSA-N 466.541 0.509 50 20 JCGD CC1CCN(CCNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 916451546 JVWJIDMBTYICEX-UHFFFAOYSA-N 481.619 0.702 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCCS(=O)(=O)Cc2ccccc2)c2ccccc2c1=O 916635816 FNZVHOFOSBWVDY-UHFFFAOYSA-N 457.512 0.975 50 20 JCGD CCCC(=O)N1CCC[C@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 917515437 KAMKAIULBYMKEX-IBGZPJMESA-N 494.614 0.826 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O)c1cccc([N+](=O)[O-])c1 918547305 NUBPKWPXRRCBLU-OAHLLOKOSA-N 474.451 0.993 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N[C@H]2CCS(=O)(=O)C2)cc1 920848695 GSIXOVADNKXRAY-MJSCBBHESA-N 457.512 0.644 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)c1ccc(CN2C(=O)CNC2=O)cc1 921147427 OWJNNOWNSBJZGV-UHFFFAOYSA-N 464.526 0.712 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091558 KIZHIDBHXXRCQV-ADXZCDIFSA-N 474.562 0.549 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1778440861 NCXFOWUGBXLKTC-QHCPKHFHSA-N 454.531 0.755 50 20 JCGD COc1ncccc1CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028454 LVKCXVDCEAUNAI-HSZRJFAPSA-N 468.514 0.165 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1 1779111259 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COc1ccc(COCC(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1783936948 BJDARTIRXIXZLB-QHCPKHFHSA-N 462.547 0.415 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1[N+](=O)[O-] 1783937896 PRTNFJIVJAVWOU-NRFANRHFSA-N 463.491 0.420 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H]3C[C@H]3N1C(=O)OC(C)(C)C)CCO2 1783939747 KXQRLWDRQGTPLP-SVHPSLOZSA-N 493.605 0.587 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CNC(=O)OC(C)(C)C)[C@H]2C1 1783989909 IRJBZNOECUPUEC-CWVYHPPDSA-N 492.411 0.883 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(Cl)c1 1785122021 XKKACTTXKYAUJA-QFIPXVFZSA-N 458.707 0.786 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1785584823 XSIFNHDNTLVVKC-CYFREDJKSA-N 489.378 0.503 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncn3-c3ccncc3)[C@H]2C1 1785753031 CTKWXINHERPMND-ZRCAFCQKSA-N 490.524 0.173 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21)c1n[nH]c2c1CS(=O)(=O)C2 1787152457 RPTUGNQIVTUPBZ-COPCRZHJSA-N 479.328 0.122 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=N/N3CCCCC3)[C@H]2C1 1788601710 TUMXPMRRPNPONE-NPSJWGRCSA-N 471.562 0.572 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C[C@@H]21 1791253938 JIORGNDMBSQDOP-WSMBLCCSSA-N 488.932 0.418 50 20 JCGD CC#C[C@@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(O)cc1 1791332874 ANPAUBMBBLYQIC-VBCPDFOISA-N 490.365 0.863 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1ccc(C2(NC(=O)CCN3C(=O)C=CC3=O)CCC2)cc1 1791599287 CFLGTBWVSWVKTL-UHFFFAOYSA-N 455.515 0.809 50 20 JCGD Cc1cn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]32)c(=O)nc1O 1792132617 BKQHXLMBXBBLJE-WFTHSTBKSA-N 461.346 0.473 50 20 JCGD COc1ccc([C@H](O)C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)cc1 1792792153 SBTRWJSHNVPUDY-QOIOWGMHSA-N 453.499 0.679 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC2)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792975840 ZIHXMGJPFWNUMA-QEOTZNIISA-N 471.982 0.965 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@H]1c1ccc(F)c(F)c1)C2)c1cccc(B(O)O)c1 1795737851 ZXQLHPFZCSNRRZ-MHRUYAEQSA-N 470.281 0.652 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795740204 DSMRWUCUNHADTP-UPHUGPLXSA-N 454.336 0.223 50 20 JCGD COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c([N+](=O)[O-])c1 1797752767 FSNXTICPMQZRJP-USGNIVHTSA-N 498.496 0.048 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1799219827 USDRQENBXSNMPP-LJPSSGMGSA-N 478.458 0.836 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1799681639 GFTRQDMZJMXHEW-WJNVRWDZSA-N 450.330 0.204 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CC[C@H]2CCC(=O)N2C1 1799926427 NIUSCHLHYOKCIX-VIQHNZTISA-N 454.531 0.338 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1800710373 FUPQWGDJBMCDQF-WUUQAYSMSA-N 477.961 0.915 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)[C@H]2C1 1800723782 LONHXUAWLIUZPQ-LSIGDULCSA-N 487.981 0.058 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(OCC2CC2)cc1 1801820711 WJBKOQXVMIVRFP-JHDGKUDLSA-N 464.327 0.672 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1 1802235007 BUXHGKBVSYHBDA-ZHCJQAHYSA-N 475.970 0.466 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802344148 PDSNAHSHKDVKHS-RCJHGTSTSA-N 497.593 0.454 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803147736 GTLQUSTYIQVOSL-KYHPRHEASA-N 497.980 0.456 50 20 JCGD Cn1cccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1=O 1803831532 VSULRISBERWLGA-NQIIRXRSSA-N 460.299 0.094 50 20 JCGD Nc1nc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cs1 1807370390 CKVYEGXVHIBVTP-MAUKXSAKSA-N 451.317 0.434 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)/C=N/N2CCCCC2)[C@H]1c1cccnc1 1810290426 XLRZUKHKQJLRHN-HMRMIESSSA-N 457.579 0.932 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnc3c(c2)CCNCC3)[C@@H]1c1cccnc1 1813074871 UIOMOELMEKEGEL-CJFMBICVSA-N 493.612 0.857 50 20 JCGD CC(C)(C)n1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1 1815343563 ACDZHADCHFMGQK-CQSZACIVSA-N 468.348 0.709 50 20 JCGD COc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1 1815354679 ANISQKPDXAIOOQ-CYBMUJFWSA-N 453.289 0.161 50 20 JCGD O=C(Cn1cc([N+](=O)[O-])cn1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815820539 ZKWMWPJENOCWLT-QGZVFWFLSA-N 467.251 0.200 50 20 JCGD O=C(NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)c1cccnc1 1817470480 BRNPWUGPQSQTLJ-IBGZPJMESA-N 476.302 0.220 50 20 JCGD CC(C)n1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n1 1817471813 PAEVTRGPZQHTDL-QGZVFWFLSA-N 451.296 0.882 50 20 JCGD CN1CCCC[C@@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793904 VBHFBJOYKWAKGV-BLLLJJGKSA-N 457.560 0.852 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1)[C@@H](F)Br 1820932162 YMYBHMXZFRFEIU-IUODEOHRSA-N 480.360 0.823 50 20 JCGD C[C@H](Br)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1 1822185192 YMPJINPFLFCUNP-ONGXEEELSA-N 452.246 0.910 50 20 JCGD CN(C)c1ncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)o1 1827056107 OXJIXEGKJCUTAE-IBGZPJMESA-N 454.336 0.968 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)CC1 1827641615 FSPDSJJQEPZRFT-FCHUYYIVSA-N 479.585 0.883 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1827680536 NYLDRJMCBRJNLB-LWKXQZBCSA-N 493.373 0.734 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N4CCN(C)CC4)cc3)CCO2)C1 1829696498 BTDUNRGPZBNPIP-QPPBQGQZSA-N 495.020 0.762 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)N1CCN(C)CC1 1830237849 IKSIKUDLJPVZDZ-AUSIDOKSSA-N 470.423 0.236 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CCCC1)CCO2 1830319421 ZATOBWFTCPEELH-AREMUKBSSA-N 492.381 0.948 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830370033 HAJBGKAPYAEVKZ-NRFANRHFSA-N 464.987 0.778 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1830538618 LDUOYNIRCDCMIK-YEWWUXTCSA-N 475.409 0.500 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1C 1830543323 PUQKIBUXCWWAIT-SCLBCKFNSA-N 459.341 0.530 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4[C@H]3O)C2)C1 1830719508 FKVWVKIPYHCOQI-YXTQBTIXSA-N 452.935 0.339 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733376 KMLVVLOUFHCFDM-XLIONFOSSA-N 470.910 0.331 50 20 JCGD CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737836 HTOGLRGGLMNXQX-GSHUGGBRSA-N 492.013 0.982 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1831446723 MYQKTWSCGRCJKD-SJORKVTESA-N 457.376 0.585 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1832004580 HFRVPVJWDAZDEP-SXGZJXTBSA-N 479.933 0.613 50 20 JCGD O=C(Cn1ccc2sccc2c1=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832891750 RLXKEDHESVCFDX-MGPUTAFESA-N 469.947 0.119 50 20 JCGD Cc1cccc(/C=C/C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1833064229 NABGGYSMJLLSQF-CMDGGOBGSA-N 476.386 0.968 50 20 JCGD O=C(c1ccc(Br)nc1F)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833256934 XAKLDRHECZCGJK-PXAZEXFGSA-N 480.718 0.653 50 20 JCGD Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cs1 1834290051 OKKGARDSUIFNGL-UHFFFAOYSA-N 471.587 0.949 50 20 JCGD O=C(COCc1ccccc1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834608822 GPOGVJUNGJUGDH-UHFFFAOYSA-N 479.386 0.768 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3C[C@@]3(F)Cl)CC2)CC1)c1cccc(B(O)O)c1 1834801494 PPKVVZBEIRYXTH-RXVVDRJESA-N 451.735 0.476 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCCCC3)CCO2)C1 1835131277 NYNOXRIIMAWODK-IKUOUCRASA-N 488.589 0.453 50 20 JCGD COc1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1835737176 SCBFWYCPKFCJDG-UHFFFAOYSA-N 481.557 0.588 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCCCC3(F)F)C2)C1 1835927832 YQRVYENCZHBDRN-GHTZIAJQSA-N 466.290 0.262 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3c(n1)OCCO3)CCO2 1836470301 PRJRMJRBQTZLMV-OAQYLSRUSA-N 465.579 0.774 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3cc(Cl)ccc13)CCO2 1837085372 PAUYQACDJJDCSY-HSZRJFAPSA-N 498.732 0.280 50 20 JCGD Cc1ccc(OCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837457434 BFWHOTJWHCAWDQ-DEOSSOPVSA-N 483.525 0.143 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nc(O)n4c3CCCC4)CCO2)C1 1837760216 ZBVHDLGYIZCCLD-DJJJIMSYSA-N 471.352 0.778 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cnncc3C(=O)O)CC2)CC1 1838464096 WIFJSPZQGFRSBE-UHFFFAOYSA-N 476.534 0.160 50 20 JCGD CCSc1cccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838847890 FKWZZQFVQKPOQJ-QFIPXVFZSA-N 479.603 0.637 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049610 MGQZDWJPTBLRNI-KUHUBIRLSA-N 466.336 0.512 50 20 JCGD O=C(CCc1ccc(O)nn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839202552 JIECONGLEXWKEQ-WBVHZDCISA-N 461.288 0.262 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839390070 HVMRIGVNIFTWLI-NDBSJYDGSA-N 488.310 0.904 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)Br)C2)C1 1839686665 TZBNRXYRWNLHQO-AHIWAGSCSA-N 451.314 0.788 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)(C1)C2 1840003396 NWSHWKZEFOKVDO-NHHVLVNESA-N 487.981 0.490 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840009261 WLKOCTLKNLZDGX-LYZACZEUSA-N 487.981 0.300 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)Br)CCO3)n1 1840031147 GVKNRRPMDFSCOQ-ORAYPTAESA-N 469.336 0.893 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2 1840152252 CNUGLLQEUGERNZ-IERDGZPVSA-N 454.907 0.995 50 20 JCGD Cc1nn2cc(CC(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)nc2s1 1840187148 YHYKMCHULRTDGF-QGZVFWFLSA-N 462.359 0.902 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)ccc(F)c1F 1840703640 NMZKXYNSMTVZAS-QHCPKHFHSA-N 474.269 0.337 50 20 JCGD CCS(=O)(=O)CC(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1844691865 JANZWBZNRUKYGW-UHFFFAOYSA-N 453.473 0.772 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@]1(C)CCN(C(=O)OC(C)(C)C)C[C@@H]1O)C2 1846385125 VDCVELVBEXILIB-GAJHUEQPSA-N 495.621 0.571 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1)c1ccccc1F 1846385537 RAWFMWPSSZAHHU-JOCHJYFZSA-N 461.538 0.753 50 20 JCGD CC(C)(C)OC(=O)N1Cc2nccnc2C[C@@H]1C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1846555047 XWEMYPHMAXIVKW-IAGOWNOFSA-N 479.965 0.942 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN 1847948296 SWJPKQBAAVCWHQ-OKZBNKHCSA-N 488.545 0.136 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1ccccc1[N+](=O)[O-] 28580991 NDRWUYXFOCIMFY-UHFFFAOYSA-N 476.511 0.938 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc(CS(C)(=O)=O)c3)cc2)CC1 728213051 CMLUCGMTBZRJGT-UHFFFAOYSA-N 466.585 0.924 50 20 JCGD COc1ccc(C(=O)Nc2nc(CC(C)=NNC(=O)[C@@H](C)NS(C)(=O)=O)ns2)cc1OC 728436087 CPISEMKMRQFQHI-LLVKDONJSA-N 484.560 0.780 50 20 JCGD Cc1cc(C(=O)NNC(=O)NCCN=c2ncnc3n(C)[nH]c(Br)c2-3)c(C)o1 729625142 OWRZAOJEACWXKE-UHFFFAOYSA-N 451.285 0.765 50 20 JCGD CN1C(=O)N(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C(=O)C12CCCCC2 789370964 JERXGCWXUBBPBS-UHFFFAOYSA-N 471.923 0.345 50 20 JCGD CCn1nc(C(=O)NNC(=O)N[C@@H](C)c2cccc(S(N)(=O)=O)c2)c2ccccc2c1=O 916196709 FOCBBGHGJFXSCU-LBPRGKRZSA-N 458.500 0.769 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1c(CO)cnc(C)c1O)c(=O)n2Cc1ccccc1 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COC(=O)c1ccc(OCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)cc1 1783347417 KACZXBDWEIVRAC-NJNPRVFISA-N 468.934 0.966 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CCO2 1783536663 HRIWMKRMWPBKFX-JKDFXYPNSA-N 450.330 0.443 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@](C)(O)C[C@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1783644229 WYVBLTBEXASILE-LATRNWQMSA-N 475.970 0.176 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783932857 HPLQFGSMXMJKEK-AOMKIAJQSA-N 469.583 0.350 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784038391 QEWSKPWTESGRHY-NYDSKATKSA-N 479.317 0.754 50 20 JCGD Cc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1784908702 CSXHNBNXRRGAOV-PMVMPFDFSA-N 450.344 0.901 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(=O)n3C)[C@H]2C1 1785870163 VMDVVIWSFRYDGB-GDJYOZILSA-N 468.514 0.113 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc4sccc4c3=O)C[C@@H]21)c1cccc(B(O)O)c1 1786984490 MLMGYEMPAMSXNQ-VDGAXYAQSA-N 495.366 0.036 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3ON=C(c4ccccc4)O3)[C@H]2C1 1788520273 YHFIUEZXKDXLRR-CWNDDBTHSA-N 494.508 0.013 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1789192821 ALOVTXTYQGDCJK-BQFCYCMXSA-N 485.545 0.406 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCC(=O)NC3)C[C@@H]21 1789220686 DNUFUYFCKPTDLB-QIJLZVCCSA-N 488.497 0.640 50 20 JCGD CNC(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)[C@H]2C1 1789220938 QKPFPAGKCHQWIW-OWQGQXMQSA-N 462.459 0.250 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3cn4c(nc3=O)SCC4)[C@H]2C1 1789707654 HCIKCIVQEBKSLF-TUUVXOQKSA-N 454.980 0.889 50 20 JCGD N#Cc1ccc(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1790224596 SRACFYDDKQCSRS-LRQRDZAKSA-N 451.263 0.284 50 20 JCGD 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccn3cncc3c1)C2 1796441946 JFVACVXOYQDCSO-KEMUROEHSA-N 463.498 0.672 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc3n(n1)CCCNC3=O)C2 1796892562 QCTYLOTTXSGHNK-LCFLCXBCSA-N 480.529 0.402 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc2c(c1)[C@@H](C1CCOCC1)C(=O)N2 1797327847 ZMVHVSFFQRZDBQ-CULFCCOHSA-N 491.972 0.952 50 20 JCGD COc1ccc(C2(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)CCC2)cc1 1799262751 UFCSJJKATONECD-BBIADKPPSA-N 478.354 0.700 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799344677 QMCLWAWQSPBRBW-KHMAMNHCSA-N 494.358 0.902 50 20 JCGD CCNC(=S)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1800186020 ZDUCNEICQKVWKT-HBCWATKFSA-N 493.542 0.207 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cnnn2C)[C@H]1c1cccnc1 1804747771 QXUZTIUERHJHSY-CPJWQURSSA-N 463.502 0.664 50 20 JCGD 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COCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830538806 QSIZTXVGKUHDFL-UGSOOPFHSA-N 460.325 0.922 50 20 JCGD O=C(CCc1cccc([N+](=O)[O-])c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726868 UWWOCEQRESWWKH-PXNSSMCTSA-N 455.895 0.584 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1830736935 XUZYIVMPFCLGOJ-FHTPNYMGSA-N 487.981 0.300 50 20 JCGD O=C(CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)N1CCCC1 1832424898 SHWYWGDDCCLVOV-WMZOPIPTSA-N 464.332 0.536 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)C(C)(C)C)C2)C1 1832549320 HXTCVQUDRNBQFU-DMPWYTOCSA-N 492.013 0.982 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1832755370 HJRUYNPCZBHKRL-IERDGZPVSA-N 467.906 0.041 50 20 JCGD O=C(NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1)c1cccs1 1833032893 AJCVKHUSUQQJKC-RHSMWYFYSA-N 478.340 0.625 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CSCC(=O)O)CC2)CC1 1835118282 XUSYMBQOWNTGPR-MFKUBSTISA-N 492.602 0.510 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1835934301 UWTIJNGOIRUDEQ-FXSPECFOSA-N 494.353 0.249 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4c(s3)CCC4)C2)C1 1835935059 DISKKNLRPYTTQX-HSZRJFAPSA-N 470.356 0.300 50 20 JCGD Cc1cc(F)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835939113 FPRCWABOYSVJJT-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1836398753 SRVTWYJJDUNXSY-BEFAXECRSA-N 450.411 0.387 50 20 JCGD CC(C)c1nc(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)no1 1837133733 UJZMFZDNXUWPJK-UHFFFAOYSA-N 484.362 0.728 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](N)c3ccccn3)CC2)CC1 1837875903 SXVPSELDUAHIAQ-JOCHJYFZSA-N 460.579 0.453 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1837882332 XHFYTLCTLLSMFT-UKRRQHHQSA-N 451.337 0.268 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3Cc4ccccc4CN3)CC2)CC1 1837920105 AXERGWJDGFHGRJ-VWLOTQADSA-N 491.397 0.693 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnco3)C2)C1 1838526766 CDPDSZBUQDOQJD-NRFANRHFSA-N 474.426 0.892 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](NC(C)=O)c3ccc(F)cc3)CCO2)C1 1839038565 OUCBUELOCGDNJW-XQBPLPMBSA-N 485.940 0.713 50 20 JCGD Cc1n[nH]cc1C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054077 GCPSHPDONYUGEZ-XMMPIXPASA-N 499.572 0.134 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)N(C)C(=O)OC(C)(C)C 1839075217 WSYWRBZLZBDJDZ-QEEYODRMSA-N 463.959 0.298 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)n1 1839197829 JIQNOFRFPDNRKQ-MAUKXSAKSA-N 473.299 0.801 50 20 JCGD C=C(C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1)C(F)(F)F 1839893398 TZRMSRVNYVGILM-RUDKWAFVSA-N 471.436 0.695 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1839987022 JFDRXKVHCVRRRJ-SFHVURJKSA-N 464.357 0.753 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3CNc4ccccc4O3)C2)C1 1840184424 LLSIDJYPATUZPP-KOSHJBKYSA-N 489.573 0.079 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cccnc4[nH]3)C2)C1 1840184595 WNIAZKVXFPEPAC-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)C(=O)c3cccn3C)CCO2)C1 1840481220 JWXYCUAIXVVMII-AUUYWEPGSA-N 456.337 0.695 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1F 1840794770 VCUYOEGNUWRNRF-QFIPXVFZSA-N 466.510 0.277 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC3(CCCN3C(=O)[C@@H](O)CCl)C2)[C@H]2OCC[C@H]21 1841353674 JUOYCXFPKRZGIC-XUWVNRHRSA-N 457.955 0.814 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccnn2[C@H](C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1 1842060942 XRZCIDMDPMALBE-JKSUJKDBSA-N 467.954 0.978 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@@H](N)Cc1cccnc1)C2)NC(=O)NCc1ccccc1 1845038783 SGCSVAMBTQEHGF-NRFANRHFSA-N 479.585 0.501 50 20 JCGD O=C(c1cc(=O)n2[nH]nnc2n1)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1 1845941360 VFLXLSCUHIZMLM-AWEZNQCLSA-N 486.330 0.636 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@@](C)(O)CN2C(=O)OC(C)(C)C)C1 1846231371 QAGDVENFUXSXLZ-KSFYIVLOSA-N 481.594 0.323 50 20 JCGD CS(=O)(=O)c1cccc(S(=O)(=O)NCC(=O)NCCSSCCC(=O)O)c1 2088603245 WODLPVOJCKYVHX-UHFFFAOYSA-N 456.589 0.341 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNc2nc3ccccc3c(=O)n2CC)c1 11155522 AKUFVCGGFLOXHZ-UHFFFAOYSA-N 474.543 0.752 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2cc(S(=O)(=O)NCCOC)ccc2C)c2ccccc2c1=O 17190847 ACOHASPQAHAXSV-UHFFFAOYSA-N 487.538 0.724 50 20 JCGD O=C(NNC(=O)c1nn(-c2ccccc2)cc1O)c1cccc(CN2CCS(=O)(=O)CC2)c1 116206624 NMAULQRAIRIPCW-UHFFFAOYSA-N 469.523 0.883 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)COc3ccc(C#N)cc3)CC2)cn1C 747695772 GYBHAUNCVBXZHV-UHFFFAOYSA-N 460.516 0.227 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2CCN(c3ccncc3)CC2)c1 748344349 UWRMVUZFZIPZMF-UHFFFAOYSA-N 460.560 0.641 50 20 JCGD CC[C@H](C)[C@@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)N1CC[C@H](B(O)O)C1 864233722 JUTOZRKLKAKMTN-GDZNZVCISA-N 473.788 0.810 50 20 JCGD CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1 913391789 BWEXCLHRYVPGNU-UHFFFAOYSA-N 459.572 0.958 50 20 JCGD O=C(NNS(=O)(=O)c1cccc2c1COC2=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 918727221 YFXXGWLVCCUDHZ-UHFFFAOYSA-N 465.509 0.765 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)NCc1ccco1 920858302 LCPMUNGULZZRJA-HNNXBMFYSA-N 492.963 0.545 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1779028451 LSQOYNFCQIGOOY-QFIPXVFZSA-N 455.519 0.394 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCCCC1(F)F)CCO2 1779029784 YUXMTMJFJPGSTR-OXJNMPFZSA-N 451.474 0.954 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)COc3ccccc3F)CCO2)C1 1779034071 LPTCUEDCKJGBJM-JOCHJYFZSA-N 457.462 0.347 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1779956622 YYRNCNIYCOZGKV-PIGZYNQJSA-N 455.334 0.983 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(OCCCO)cc1 1780064719 CEGIBQCHNUYODQ-ZEQKJWHPSA-N 496.369 0.569 50 20 JCGD CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3CC[C@@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)C[C@H]1CO2 1781060549 HHXFFHNDHWGKPK-RSMHBEIYSA-N 473.954 0.194 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(-c4cc[nH]n4)cc3)C2)C1 1781881845 KDUAFCHMZYPLKT-DEOSSOPVSA-N 475.509 0.833 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1783169659 DTSZCJROKHJCLG-AFBRZQFHSA-N 460.959 0.473 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)(C1)C2 1783435851 YSDNBJGLKOHSGF-XGBHPCTLSA-N 457.955 0.863 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21 1783965817 SZSRAHWOCYSCNN-VGWMRTNUSA-N 480.425 0.423 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1784191339 ANZRINZDLNJTEW-KSWRQPAISA-N 475.970 0.202 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1784243346 BMEWIEMXKBAWCF-VWLOTQADSA-N 465.359 0.509 50 20 JCGD COc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(Cl)c1 1785065442 LJCZKFDZAODVAP-XJABCFGWSA-N 486.761 0.864 50 20 JCGD COc1cc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)ccn1 1785104840 GWYGTNYBOFNGTF-FHWLQOOXSA-N 461.563 0.376 50 20 JCGD Cn1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1C(F)(F)F 1785527014 RQNMDXUBQDNGGV-JQFCIGGWSA-N 480.252 0.026 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983885 DGIGEBCOXNHCGC-YSSFQJQWSA-N 487.749 0.721 50 20 JCGD Cc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1[N+](=O)[O-] 1786984880 UJRLQNJQXZBQCG-VCOUNFBDSA-N 481.314 0.419 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ncsc3Br)[C@H]2C1 1787549454 OSPITIGBMRMRTF-AVGNSLFASA-N 488.408 0.872 50 20 JCGD Cc1nccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)n1 1787695019 OYZISZVPYRYDET-ONTIZHBOSA-N 495.584 0.725 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)ncn3)[C@H]2C1 1789058406 DJOKPXSUTSSYLW-PJODQICGSA-N 459.894 0.036 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3CS(C)(=O)=O)C[C@@H]21 1791252198 CTTMYXLSVZAWDY-SCNOPHJPSA-N 473.979 0.473 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1C[C@H]1c1ccc(F)cc1 1792806586 BHICOIFEAWYMNU-OQZLWFJBSA-N 452.291 0.512 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(S(C)(=O)=O)c1)C2 1792869934 DQMGMWORCBAVLU-ZIEJDFEHSA-N 474.377 0.719 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792982990 XPGXHCQWMKIREV-YMSVYLFOSA-N 459.927 0.102 50 20 JCGD CNC(=O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1793285388 DCKQENZAXVUJIE-RCJHGTSTSA-N 452.349 0.718 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccc(Cn2ccnc2)cc1 1793976351 CDBSGRITLVIQHP-ZPDHQFRZSA-N 494.596 0.907 50 20 JCGD Cc1ccc2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)sc2c1 1794975731 RIHXIIJPMCAVOY-CWPLJXCYSA-N 465.340 0.802 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1scnc1C(F)(F)F)C2)c1ccc(B(O)O)cc1 1795732492 MOWAMQFLGZMOBM-DABQJJPHSA-N 469.250 0.359 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)cc1)C2)c1cccc(B(O)O)c1 1795739780 MALVJONDXBYREL-HGKCTWBKSA-N 462.233 0.902 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CN(Cc2ccccc2)CCO1)c1ccc(B(O)O)cc1 1797855028 HLSVPYJMCBPVRJ-UEQSERJNSA-N 477.370 0.519 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797953885 OBMSFKCMSHDYIV-JYYAWHABSA-N 459.616 0.313 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccn1)C2)NC(=O)NCc1ccccc1 1799094643 BPFBHUCSUQQUJN-HATOLVCRSA-N 466.542 0.631 50 20 JCGD COC(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2)C(C)C 1800208909 FHJNLCBXOGNWIR-COZGXFGHSA-N 486.997 0.596 50 20 JCGD C[C@H](N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)C1CC1)c1ccccc1 1800347440 UNZDTDQTZUHROS-USDRJLJOSA-N 491.397 0.699 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)c1)C2 1800976871 BHYALXSZONUCER-HNJRGHQBSA-N 451.951 0.980 50 20 JCGD Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c(C)n1 1801229820 WUKDRILTRHXKKP-OPMZPASUSA-N 466.542 0.533 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CCC(=O)N1C(=O)OC(C)(C)C 1802619012 QSWSKDFWJODYRQ-YYIAUSFCSA-N 479.578 0.924 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1ccnc1 1803310440 MELABUHRXBFMRG-OXFYSEKESA-N 462.514 0.857 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H](CNC(=O)C(F)(F)C(F)(F)C(=O)O)[C@@H]1c1cccnc1 1804044095 VVNDRHZBEIVUBD-ZBFHGGJFSA-N 497.210 0.436 50 20 JCGD O=C(CNC(=O)c1cccs1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804572900 RXESAGGOBKWZDL-GCJKJVERSA-N 492.366 0.573 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](O)c2ccccc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370722 JWVIJPMTPAQPJR-WWNPGLIZSA-N 459.311 0.815 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnn2ncccc12 1808174217 QKBKKIGZRGTRDV-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD COCCn1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1808653403 QBUBGFOZCNBYSW-DENIHFKCSA-N 477.330 0.238 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810305395 LDZDNIKMYXFZTH-BPAFIMBUSA-N 465.514 0.021 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1 1810837481 JEALFXIBKRGRIQ-SIKLNZKXSA-N 460.299 0.798 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H](O)c3ccccc3)sc2C1)c1ccc(B(O)O)cc1 1814369815 HBKVBLVICWZGRE-LPHOPBHVSA-N 451.313 0.782 50 20 JCGD NC[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)c1ccccc1 1815339608 JWKSEWJXCRXXOV-QZTJIDSGSA-N 464.356 0.791 50 20 JCGD CCC[C@@H](Cl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816668580 LBRARBGFJJRIBL-RKDXNWHRSA-N 450.912 0.902 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)[nH]n1)c1ccc(B(O)O)cc1 1817472221 BJLRYBMJAUIUEZ-KPFFTGBYSA-N 479.346 0.796 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476119 GQYNMLYCSWTYPS-KBXCAEBGSA-N 463.307 0.686 50 20 JCGD COCCn1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)n1 1817610610 JTEUYXKFCLZECH-OAHLLOKOSA-N 469.332 0.205 50 20 JCGD O=C(CCc1ccc(O)nn1)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1821637148 CJFACAXRQQFFOO-GOSISDBHSA-N 464.291 0.524 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCCNC3=O)[nH]n1 1822415582 CEFMTEFKEGRGAH-INIZCTEOSA-N 485.549 0.419 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(O)ncn2)CC1 1824654989 FPXOZTYYQVRCLJ-SFHVURJKSA-N 453.503 0.728 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](Cl)COC)sc2C1 1825994081 HKGLZLHWNCUPRG-OUAUKWLOSA-N 452.986 0.637 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccccc1C(N)=O)CC2 1826088667 INRWTEMPTHINCH-LBPRGKRZSA-N 458.544 0.841 50 20 JCGD O=C(c1cnc(O)nc1O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059841 XARWHJLUMMIOBP-SFHVURJKSA-N 454.292 0.115 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1830540872 UWWHBHJTBAGUBN-LIRRHRJNSA-N 469.336 0.508 50 20 JCGD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830720454 ZUYHRDJRKOTKOT-APWZRJJASA-N 476.313 0.847 50 20 JCGD O=C(c1csc(-c2cccnc2)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728281 RKAJERVTSYARJD-OXJNMPFZSA-N 466.947 0.875 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2N1 1830735046 CLOPQMFBAHHDDX-LAUBAEHRSA-N 451.907 0.241 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1830904321 PSJSXDFAMBJHOD-HSZRJFAPSA-N 463.579 0.394 50 20 JCGD C/C(=C/C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C(=O)O 1832551107 BFCXTHXFLAYOAC-QWWPPESWSA-N 489.953 0.606 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(O)n3)CCO2)C1 1834187642 SDLBUXGTSVKBSB-AOMKIAJQSA-N 498.964 0.989 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn(C)cn3)CCO2)C1 1834447392 JIIMTCBYVHOKLS-QFIPXVFZSA-N 487.469 0.637 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C#CC3(O)CCCCC3)CC2)CC1)c1cccc(B(O)O)c1 1834801320 YCOGYGJOGJJEHE-UHFFFAOYSA-N 481.402 0.250 50 20 JCGD Cc1noc(C)c1CC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835736920 AGPMUHBSBLYSLW-UHFFFAOYSA-N 483.573 0.718 50 20 JCGD CCn1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)cc1C 1835738127 USXWYQOKDSDYTP-UHFFFAOYSA-N 482.589 0.709 50 20 JCGD O=C(c1ccc(Cl)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932134 PVEMIXAAZQCLGP-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ncccn3)CCO2)C1 1836114413 LEMCTDHREPIDEQ-SUMWQHHRSA-N 459.366 0.809 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1OC 1836275553 QFQABBYKSWEBHK-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc2cccnn2c1 1836492012 UXDCEPBFOTVQBV-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CC[C@H](N)C(N)=O)CC2)CC1 1836671254 SOGDZGZQOCABEU-CJNGLKHVSA-N 461.401 0.609 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)N1CSCSC1 1837569555 MARJGZVCUVQDCS-KEYYUXOJSA-N 454.014 0.086 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(O)[nH]3)CCO2)C1 1838063618 RUOBOGDBZAVXCJ-RNODOKPDSA-N 487.941 0.317 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cc(CO)on3)CC2)CC1 1838558266 WEZWDHZDNVDVIQ-UHFFFAOYSA-N 451.524 0.152 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1839146216 WQRFPODDWXAYMR-XOBRGWDASA-N 453.927 0.104 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](F)Br)CCO2)C1 1839198654 MJNWHLGTBZQDQB-GUYCJALGSA-N 452.321 0.296 50 20 JCGD O=C(c1ccc(Br)cc1O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839268484 SZPZECITGCJRIQ-QAPCUYQASA-N 477.739 0.824 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc2c[nH]nc12 1839512214 QFZWDFPWPWPSIX-HSZRJFAPSA-N 472.546 0.314 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802032 KIJNNMHNENYEBD-WEMPKCCASA-N 496.402 0.172 50 20 JCGD CCOC(=O)C1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](Br)CC)CCO3)C2)CC1 1839966631 LGGSXBYORPWJFC-KSSFIOAISA-N 461.353 0.960 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nn(C)c4c3CCC4)C2)C1 1840032867 MMIXQZPHSYVEOE-BFUOFWGJSA-N 455.353 0.762 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1 1840155910 JUKWSWZUYSYKOO-OXJNMPFZSA-N 473.885 0.987 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3NC(C)=O)C2)C1 1840156193 KGLDNWGFDMRZQG-LAUBAEHRSA-N 453.923 0.969 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)[C@@H](F)C1 1841516780 FVKXSXRARVVSER-MOPGFXCFSA-N 489.353 0.779 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)Cn2ccc3sccc3c2=O)C1 1842020591 DJKXVKHHKPITTI-UHFFFAOYSA-N 466.523 0.579 50 20 JCGD O=C(c1ncsc1Br)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011348 UFPQKBRPCPFLEP-UHFFFAOYSA-N 450.123 0.716 50 20 JCGD CCOc1c(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cnc2c1cnn2C 1843214244 OAFWAHJGKSJIPJ-UHFFFAOYSA-N 463.303 0.178 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 9749787 ZITXCLIMUQJMSN-UHFFFAOYSA-N 478.527 0.626 50 20 JCGD Cn1nc(C(=O)NNC(=O)CCCCCNC2=NS(=O)(=O)c3ccccc32)c2ccccc2c1=O 14887937 UFZXCHKJLHSPSR-UHFFFAOYSA-N 496.549 0.994 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl 16785816 HLLKUPBAVOJKKG-GFCCVEGCSA-N 463.965 0.710 50 20 JCGD CCn1nc(C(=O)NNC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)c2ccccc2c1=O 105566511 DMJMWWKTYCGSHU-SFHVURJKSA-N 452.393 0.751 50 20 JCGD COc1cc(S(=O)(=O)N2CCOCC2)cc(C(=O)NNC(=O)c2cccc(C#N)c2)c1OC 728828083 JSKMPGVVERLZGK-UHFFFAOYSA-N 474.495 0.671 50 20 JCGD COc1cc2ncn(CCCC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)c(=O)c2cc1OC 789884466 XHBODBYKCVSYJM-UHFFFAOYSA-N 478.469 0.631 50 20 JCGD O=C(CCNS(=O)(=O)/C=C\c1ccccc1)NNC(=O)c1csc(N2CCOCC2)n1 912851830 JLMZRUNXBIPSLF-QPEQYQDCSA-N 465.557 0.721 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCc1ccco1 915907313 YFQFEUNFTWXHFT-UHFFFAOYSA-N 450.517 0.806 50 20 JCGD CCNC(=O)COc1ccc(CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1OC 916389109 PSBCIXOPHIQMNB-UHFFFAOYSA-N 468.474 0.330 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)C(=O)N(C)C)c1 916577610 QLOBGOSIBULFSX-ZDUSSCGKSA-N 463.516 0.917 50 20 JCGD COc1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)NC1CCCC1 919886040 SRCRRPNMBWZMLS-CQSZACIVSA-N 474.561 0.047 50 20 JCGD O=C(NNC(=O)[C@@H]1CS[C@@]2(c3ccc(F)cc3)CCC(=O)N12)N[C@H]1CCS(=O)(=O)C1 919889704 RTIYEFFGOLVYCV-SUNYJGFJSA-N 456.521 0.234 50 20 JCGD CC(=O)N1CCN(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@](C)(Cl)CCl)C3)CC1 1778911732 NVVZBVJUAZQSFU-JRGCBEDISA-N 477.433 0.901 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cnc(C(F)(F)F)cn3)CCO2)C1 1779030183 IFLYISZFXGCKIY-LJQANCHMSA-N 479.419 0.251 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(NC(=O)C4CC4)cc3)CCO2)C1 1779037084 MZTJTXYMEOIZDS-RUZDIDTESA-N 492.536 0.791 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1779333089 HKHMGQGUOYURKT-NYHFZMIOSA-N 453.503 0.024 50 20 JCGD COc1cccc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)n1 1779371323 OTSIZHIBYGFFQR-NTKDMRAZSA-N 482.541 0.459 50 20 JCGD N#Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1780410194 LRRMIGFLLGIQKP-HYBUGGRVSA-N 462.510 0.998 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnn3c1)C2 1782213433 QYBDCGBJIGYXRC-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1782469563 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CCC[C@@H](NC(C)=O)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826092336 ZRQYXFXEEJPHHW-DZGCQCFKSA-N 452.581 0.733 50 20 JCGD CC(=O)NCCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551009 FWRDEMUAINYTNY-XXBNENTESA-N 494.976 0.564 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCN1C(=O)c1ccc(F)cc1)CCO2 1830607234 SWFSQNFZEQFFSQ-YCRNBWNJSA-N 497.951 0.486 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830726896 VSIWHQGDJLETBQ-SIFCLUCFSA-N 461.943 0.052 50 20 JCGD O=C(NC1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1)OCc1ccccc1 1830730769 DPDQRYGHWUKXOR-PGRDOPGGSA-N 495.960 0.502 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737766 GYZZDLOPGHUYMI-GCKMJXCFSA-N 477.986 0.736 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CC(=O)OC(C)(C)C)CCO2)C1 1831993062 PLQJFNXOCFZBJS-AJPHYDNBSA-N 491.545 0.309 50 20 JCGD 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CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3cn(C)c4ccccc34)n[nH]c2n1 917393222 DCZXYWUQHYATHX-UHFFFAOYSA-N 468.547 0.850 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2cc(F)ccc2[N+](=O)[O-])cc1 917720963 MPEYAVQQOBBIJD-UHFFFAOYSA-N 460.465 0.673 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)Cc3ccc4c(c3)CCCO4)C2)C1 1778269104 MXNFWURZQCVQGJ-VWLOTQADSA-N 479.537 0.696 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1779321694 HZPIMUYEESJVKW-PFHKOEEOSA-N 451.337 0.898 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc(O)n3c2CCCC3)C1 1779576440 IDDKFTPZHQXWPV-HOYKHHGWSA-N 497.556 0.365 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCC(=O)N1)C2 1780054309 JGJNTJLJEFQIIP-LYHRCORUSA-N 488.497 0.926 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1[nH]nnc1C)CCO2 1780096886 KXINMCFEZZDICD-HXUWFJFHSA-N 458.431 0.704 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCS(=O)(=O)CC1)C2 1781901555 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CHRGCTWRDGLRGF-CPOKCXMASA-N 458.475 0.187 50 20 JCGD Cc1noc(C)c1CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797518 SQBXUROTLXGFPQ-UHFFFAOYSA-N 482.390 0.789 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C(F)F)CCO2)C1 1834909136 KSIQDFDIPVKKIF-SGTLLEGYSA-N 455.886 0.840 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835448766 WUZHOOACVHNLTI-OALUTQOASA-N 452.379 0.401 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737376 MYFMGAOCLJCCHY-UHFFFAOYSA-N 496.616 0.463 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)no1 1835773568 STODTIANQPTSDI-KRWDZBQOSA-N 488.358 0.975 50 20 JCGD CCCOc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835931312 MMBMEDIFIOWSQC-VWLOTQADSA-N 482.342 0.539 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1 1836414704 ZBAKSRMVBBPNFF-AEFFLSMTSA-N 466.348 0.864 50 20 JCGD 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CN(CC(=O)OCC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)S(=O)(=O)c1ccccc1 915007217 NBPHBWRLOJIVQS-UHFFFAOYSA-N 450.429 0.220 50 20 JCGD Cn1nc(SCC(=O)NN=CC2=Cc3cc(Br)ccc3OC2)c(=O)n(C)c1=O 915271197 NPQRNJDLFNHIMD-UHFFFAOYSA-N 466.317 0.912 50 20 JCGD O=C(CSCc1ccccn1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916734765 VOQKERQSRWDGFG-UHFFFAOYSA-N 450.542 0.797 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@H](O)CN1C(=O)Cc1ccccc1F)NNC(=O)c1ccc([N+](=O)[O-])cc1 919179823 CLIYOZSISVTKCF-WMZOPIPTSA-N 488.428 0.243 50 20 JCGD Cc1nc2sccn2c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032268 MJWPFKCUCAMZBV-OAQYLSRUSA-N 469.527 0.460 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccn(C(F)F)c1=O 1779582542 FDDCZLSMSPFMNL-WZONZLPQSA-N 489.284 0.365 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780095221 KQCJGTDLGZKZFW-PEBXRYMYSA-N 476.486 0.878 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1cncn1 1780968473 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NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1C[C@H]1c1ccc(F)cc1 1792807445 OVXYQLCOGFZZQM-FNNXOSRLSA-N 467.501 0.831 50 20 JCGD CCC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCCOCCOCCOC)C2 1793452973 OHUVIYBZPLWURI-DMUMMCEESA-N 464.987 0.680 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C[C@@H]1COc2ccccc2O1)c1ccc(B(O)O)cc1 1793477005 HXYLSGOLENOOTM-IYWMVGAKSA-N 450.300 0.848 50 20 JCGD Nc1c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)sc2nccnc12 1796191192 JMTOGSDDDBANTD-QDMKHBRRSA-N 451.317 0.519 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1nccs1)C2 1796440710 ZZIBOYGYIULLSM-CGEVSQDCSA-N 473.559 0.667 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1O 1798439538 HBGZVPCOCMYFQH-MUJYYYPQSA-N 453.499 0.894 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798640743 KHHASZFHUKQROM-WOZUAGRISA-N 488.589 0.122 50 20 JCGD Cc1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)co1 1799094641 BDCICNJKDCYXSP-RMFSNUHRSA-N 470.530 0.532 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(F)cn1)C2)NC(=O)NCc1ccccc1 1799094776 KCRSUFRCPQHXNW-OPMZPASUSA-N 484.532 0.770 50 20 JCGD Cc1cccnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799094831 BDHNAZNKWYEIEX-JHDGKUDLSA-N 480.569 0.939 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1799220695 RWJLNTKCRGGSSQ-RCJHGTSTSA-N 476.486 0.923 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCCNC(=O)OC(C)(C)C 1799260332 HQIRNJFGRQTVFZ-AYDFFVQHSA-N 478.384 0.901 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1800759778 HRZGYIDBHSJDFN-VYCZESIESA-N 496.406 0.706 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOCCOCCOC 1800839751 ZOZQUYWFIAIQSG-KYHPRHEASA-N 465.385 0.819 50 20 JCGD COCCOCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2 1800848901 UVQXAGBNADRGNN-YNVMFWSZSA-N 485.405 0.509 50 20 JCGD O=C(CN1CC(=O)NC1=O)NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1 1804190234 JYBNHFMARJHYKF-NILFDRSVSA-N 456.272 0.330 50 20 JCGD Cc1noc(C)c1CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804246434 ZNZGGPWOLCRHLU-CVDCTZTESA-N 462.315 0.929 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)COc2cccnc2)[C@H]1c1cccnc1 1804338749 GDMILYCMNFYCIZ-FDDCHVKYSA-N 454.531 0.934 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365833 ZGOGNVNYRKZZHE-DENIHFKCSA-N 477.330 0.238 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807945728 GYJYAROKKGVULN-KSSFIOAISA-N 470.566 0.379 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@@H](CNC(=O)[C@@H](N)CN)[C@H]1c1cccnc1 1808257941 FDMSOQFPRZAEIY-LUKYLMHMSA-N 468.986 0.506 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@@H]1c1cccnc1 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C[C@@H](Oc1ccccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361770 RGXQSUIZJNTLSN-CJNGLKHVSA-N 466.328 0.911 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472198 AKAKKURUWALZNZ-IBGZPJMESA-N 450.308 0.978 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3ncccn23)[nH]n1)c1cccc(B(O)O)c1 1817476129 HETIBAAUQUZFLZ-KRWDZBQOSA-N 459.275 0.752 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CSc2nc[nH]n2)[nH]n1)c1cccc(B(O)O)c1 1817479823 SROQVNSEXMUDQC-HNNXBMFYSA-N 455.309 0.306 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)n[nH]1 1817974214 HWSGLEXLPKBIEL-HOTGVXAUSA-N 495.581 0.660 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCc2ccc(O)nn2)[nH]n1 1822416359 BOEWSHBELRMDES-MRXNPFEDSA-N 458.523 0.903 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1CCC(=O)N1)CC2)NC(=O)NCc1ccccc1 1822518240 HDCWWTDAUFEKIL-RDJZCZTQSA-N 499.597 0.680 50 20 JCGD Cc1nn(C)c(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1F 1826080715 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COc1ccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(F)c1 1830738286 NHRZTGZKGNFXHV-IPJYHJMSSA-N 456.898 0.904 50 20 JCGD CC(C)(C)OC(=O)NCC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830738414 PIPMVBSCGUBXKR-BTYIYWSLSA-N 477.986 0.593 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)COc2ccc(O)nn2)CC1 1831119182 PTYJVNPPENUMGW-SFHVURJKSA-N 483.529 0.493 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(C)nn(C)c1C)CCO2 1831809401 FBNRSLHAZFPXOJ-DZQSVEARSA-N 485.545 0.241 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832877875 KXNYTPRISWYGBQ-UXHICEINSA-N 475.373 0.827 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1cccc(Cl)n1)CCO2 1833178239 FOSYPEIRQWIDTG-NRFANRHFSA-N 467.954 0.107 50 20 JCGD CC(C)(C)OC(=O)CC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833608885 LMWAKTHSWZEYTF-UHFFFAOYSA-N 473.379 0.283 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cc(O)n(C)n3)CC2)CC1 1833945218 LCQQRXDGQFSILF-CVKSISIWSA-N 484.561 0.445 50 20 JCGD Cc1nc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ccc1F 1833960272 APOKPCZYOASDEA-UHFFFAOYSA-N 468.338 0.708 50 20 JCGD O=C(c1scnc1C(F)(F)F)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1834570911 SGIZEHNPGCXGAV-BMIGLBTASA-N 457.858 0.832 50 20 JCGD Cc1c(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)nc2ccccn12 1834799912 DKUMYIJSTWHLHA-UHFFFAOYSA-N 489.385 0.822 50 20 JCGD Cc1c(F)ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1N 1835875027 MABSGAJBIYAXOJ-QFIPXVFZSA-N 465.526 0.159 50 20 JCGD O=C(c1cc(Cl)nc2n[nH]cc12)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836364838 CSTPJLZKIBFTEU-FZKQIMNGSA-N 458.302 0.281 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1836673042 LVMMRCIZXKZLFH-FOIQADDNSA-N 476.412 0.667 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cccs3)C2)C1 1837456248 GGVVQVALHZCVGQ-JOCHJYFZSA-N 473.555 0.449 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(O)c4ccn(C)c34)CCO2)C1 1838439708 IKOOLQCJIDXTKP-IERDGZPVSA-N 466.922 0.603 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(F)c3)CCO2)C1 1838911790 NNWWQIQNWCQRMB-QFIPXVFZSA-N 457.462 0.208 50 20 JCGD O=C(NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)c1ccco1 1839198935 GLXLPYQTRFCWSY-YOEHRIQHSA-N 462.272 0.156 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C3CC3)cc1)CCO2 1839438944 IQIJMRZAMOXJFL-VWLOTQADSA-N 464.327 0.628 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)c([N+](=O)[O-])c1 1839462434 SHVZRVPLZJQJCS-BEFAXECRSA-N 473.841 0.986 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc3ncccc13)CCO2 1839543865 SDLNXPNJHCOZJX-DEOSSOPVSA-N 491.508 0.012 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CNC(C)=O)C2)C1 1839962378 CHNPZYKSMUZAFJ-DNVCBOLYSA-N 462.385 0.779 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)c(C)n2n1 1840033072 SCUWCPVTVHYKJW-DJJJIMSYSA-N 481.351 0.595 50 20 JCGD COc1ccc(COCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1 1840252999 MDAYUYXNPOLBDW-WIYYLYMNSA-N 456.923 0.268 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccnc3c1OCO3)C2)NC(=O)NCc1ccccc1 1845039174 NFHQVIIQIXIWBH-UHFFFAOYSA-N 480.525 0.974 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cccc(B(O)O)c3)O2)C1 1847287935 RYTBCAYYSIRVBK-UFYCRDLUSA-N 499.373 0.350 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@@H](O)CCl)[C@H]2C1 1847562906 DPGIKDMMSXDWAP-IFTGGNMHSA-N 457.955 0.670 50 20 JCGD CC[C@H](C)N(C)CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 727229695 POKIXQATWFKMAJ-KRWDZBQOSA-N 469.608 0.701 50 20 JCGD CCOC(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CC1 728213224 VQKFJTSZPKCIDT-UHFFFAOYSA-N 453.565 0.934 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CSCc2cc(=O)n3ccsc3n2)n1 728720695 KNNXHISMHHKTNN-UHFFFAOYSA-N 467.554 0.687 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)c2ccccc2)c1 729275683 QHIFUMWDGJBTBY-CYBMUJFWSA-N 454.530 0.210 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CNS(=O)(=O)c1ccc(C)cc1 788144215 XLIJYPDQBVXIJJ-UHFFFAOYSA-N 469.903 0.940 50 20 JCGD COc1cccc([C@@H](CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)N(C)C)c1 915900860 ICWGXDROOAKZIP-HXUWFJFHSA-N 491.618 0.955 50 20 JCGD O=C(O)COc1ccc(Br)cc1C=NNC(=O)CSc1nnc(O)nc1O 915957820 WWIDGRCIHHNSCB-UHFFFAOYSA-N 458.250 0.751 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)NCCNS(=O)(=O)CC)c2ccccc2c1=O 916516266 IKCISGOZEWJZGK-UHFFFAOYSA-N 452.537 0.470 50 20 JCGD O=C(NNS(=O)(=O)c1ccc2nc(O)[nH]c2c1)c1cccc(S(=O)(=O)N2CCCC2)c1 916643975 NUUYPWQYVDAVOV-UHFFFAOYSA-N 465.513 0.676 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCOc2ccc3c(c2)OCO3)c1 916647133 LSURGICTEJSIKQ-UHFFFAOYSA-N 450.473 0.689 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1C(=O)O 917718374 XOVJABJHMBBZDR-UHFFFAOYSA-N 483.524 0.801 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNS(=O)(=O)c1ccc(C(=O)O)cc1 918061904 FCYKKMQCFKXUJZ-UHFFFAOYSA-N 497.551 0.348 50 20 JCGD CC(=O)Nc1ccc(F)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 919677776 CJSFEDBHGVDWKO-UHFFFAOYSA-N 464.475 0.880 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)Cc1ccc(S(=O)(=O)N2CCOCC2)s1 920006886 ZKGASVRFLPPYEC-UHFFFAOYSA-N 453.542 0.710 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@H]3CN(Cc4ccccc4)CCO3)C2)C1 1778275471 KQGHHTKEBOUGPG-WOIUINJBSA-N 451.951 0.317 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1779029382 WSGNVNQBTBHTJS-QHCPKHFHSA-N 468.514 0.165 50 20 JCGD Cc1c(F)ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1N 1779030707 GTEMGIUBAIDLNV-JOCHJYFZSA-N 456.478 0.472 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc4c(c3)OCO4)CCO2)C1 1779031717 WYOPQPMLOGXDGV-XMMPIXPASA-N 481.509 0.490 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1n[nH]c2c(F)cccc12 1779095727 WXJGFJQJEMKZOM-NTKDMRAZSA-N 480.305 0.823 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](O)N2CCOCC2)C1 1779410692 QSXIWQADPVPGRX-OHDICMOHSA-N 462.385 0.182 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]3O)C2)C1 1781116010 YQNVZUMTDTYMFZ-KQDGPHEJSA-N 475.970 0.298 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1 1783336676 SGYCPTQUKHKCHI-KRXPAMOESA-N 467.526 0.554 50 20 JCGD COc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783933100 QOPRPFNMHMVWNK-HXUWFJFHSA-N 453.927 0.560 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N2CC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1784011560 QAYSBOMMIUSSNZ-OALUTQOASA-N 466.362 0.992 50 20 JCGD Cc1cc(C)c(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(C)c1 1784359888 REFOYSZRBQDEGE-PMVMPFDFSA-N 480.370 0.964 50 20 JCGD Cn1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1C(F)(F)F 1786979920 OWVJDDPBEKDAAN-BPUTZDHNSA-N 480.252 0.026 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCC4)C[C@@H]21)c1ccc(B(O)O)cc1 1786980162 PJZPZKJAJIDPCX-XWGVYQGASA-N 462.355 0.691 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(OC)c1 1786984791 KEIVIXPWMGSBEN-BUKVSMQUSA-N 468.315 0.291 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCc3cccnc3)[C@H]2C1 1787107380 MOVWJENGEADQDD-VDGAXYAQSA-N 452.515 0.306 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1 1787449006 LAJFUGYYWDHNFL-LSTDLKDCSA-N 468.950 0.587 50 20 JCGD Cc1cn(CC(=O)NC2(c3ccc(NC(=O)c4ccc(B(O)O)cc4)cc3)CCC2)c(=O)nc1O 1788145341 LZIMMKCCRUUNBI-UHFFFAOYSA-N 476.298 0.385 50 20 JCGD CN(C)[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccccc1Cl 1790678381 XAEBALYFMWMVBH-RBQRNVLBSA-N 499.804 0.916 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)n3cncn3)[C@H]2C1 1791614825 GXGYXWHSADQIAP-MLZJRGSSSA-N 486.485 0.966 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792984196 VLMKZIGYYPEJOY-WUUQAYSMSA-N 477.961 0.915 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1793424983 IOSXMNAKEJBMAE-ACDBMABISA-N 469.347 0.795 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCSC(=N)N)C2 1793881148 SCKPKMXTOLTKOD-XFMPKHEZSA-N 478.015 0.725 50 20 JCGD CC[C@H](C)[C@H](N)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1795551157 JRSNZYMGLLRGSW-PYDYAWQMSA-N 474.606 0.296 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C\C(=O)NC1CC1 1797608877 CYWHEPCQIWHGAI-NEXPXWBLSA-N 484.981 0.543 50 20 JCGD C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)Oc1ccccc1 1797753775 FPLCBNOIQPJGAV-DBHNTLKXSA-N 467.526 0.746 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)ccc1F)C2 1797753923 CHJQIIJVMNHGLF-VTEUUUEMSA-N 459.453 0.409 50 20 JCGD CCc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)n(C)n1 1798167320 VYCVQUCQEHPHDU-IHHIPJHASA-N 455.519 0.320 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1[nH]cnc1-c1cccnc1 1798491063 LTKNGYDSNNCGEF-AIGIPFSKSA-N 490.524 0.809 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2c(nc1=O)SCC2 1799073319 GMAOLBODKHOCDT-JLVBRIDZSA-N 466.636 0.333 50 20 JCGD COCC1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)CC1 1799095417 SNJIRFLCZOIZQL-CEQLMSFQSA-N 473.574 0.349 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)c3ccccc3C1=O)C2)[C@H](F)Br 1799344124 AGSHVKNQJGPQSS-LZDSYCOUSA-N 482.306 0.953 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCOCCOCCOC)C2 1800644068 GVSUDTAXAMGDBD-DFGXFYAUSA-N 465.385 0.819 50 20 JCGD CNc1nsnc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1802472707 RBPHIQSTRTZGNG-CRAIPNDOSA-N 466.332 0.288 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803140306 CCHAZZIVGJPPSQ-AYOQOUSVSA-N 480.974 0.941 50 20 JCGD N[C@H](CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cccnc1 1807259904 NHOGURNYQKJUOP-BKULYWANSA-N 473.342 0.566 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365114 VTJPMGOZYNWZAX-XXBNENTESA-N 473.342 0.928 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C2=NNC(=O)C2)[C@@H]1c1cccnc1 1808417564 MNFQTJWPTDQRMV-KIKGRTIKSA-N 464.486 0.097 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@@H]1c1cccnc1)[C@@H](F)Br 1808661270 HOVLZBMPZUNNNK-NILFDRSVSA-N 478.282 0.823 50 20 JCGD O=C(/C=N/N1CCCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810283465 AVWAPXAFCYNYLN-NVQJOJJJSA-N 463.347 0.553 50 20 JCGD Cc1ncncc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302235 GYJMIIJNSCRKHH-JXFKEZNVSA-N 460.498 0.812 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2 1814934648 PJRPVILHHIFZDV-CYZMBNFOSA-N 475.999 0.897 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1815162743 NYXVPFHTALMHIV-MLGOLLRUSA-N 492.562 0.042 50 20 JCGD COc1nccnc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470980 OFIFVWXURSZVAF-MRXNPFEDSA-N 450.264 0.508 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3ccncc23)[nH]n1)c1ccc(B(O)O)cc1 1817471595 JVXSQSHVAPWYIT-SFHVURJKSA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc[n+]([O-])c2)[nH]n1 1819401739 QIPQGLQITHLNCJ-KRWDZBQOSA-N 450.459 0.661 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1819582879 UCRLQNYJXGLIHB-BLLLJJGKSA-N 454.491 0.405 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](C)n3cnnn3)sc2C1 1826977003 RAPXFVJKRSAZRG-XMUSQBDYSA-N 470.519 0.437 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)no1 1828986039 HKYNDISJSHZMAW-NRFANRHFSA-N 482.346 0.326 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1830541124 XXOUNTHTPFODGL-YVLOFKIZSA-N 498.374 0.939 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(-n2nccn2)c1 1830732101 RLNGLIPCABFRKO-NQIIRXRSSA-N 463.922 0.245 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1 1831298906 YPBLGMXYTBIJSD-ZVVDCOBXSA-N 452.935 0.855 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1831687133 JYJFPVKOENCMIG-KUHUBIRLSA-N 462.385 0.636 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccn1C)CCO2 1833909311 CLPKWPNMGNHQRJ-ZHNJOBQTSA-N 456.503 0.229 50 20 JCGD COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c(F)c1 1834009613 BCNNRGGCRSOYFF-UHFFFAOYSA-N 478.569 0.788 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801419 HMEYMJBWISKYDK-LJQANCHMSA-N 478.402 0.825 50 20 JCGD CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCN(C(C)=O)CC3)CC2)CC1 1835510851 KPTFSWQCEFMPIQ-FQEVSTJZSA-N 456.031 0.740 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc2cncn2c1 1835617329 NXIFEWRSVYLRFQ-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD CC[S@@](=O)CCC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835656013 TXZWFBFDYWAGTC-MGBGTMOVSA-N 478.619 0.029 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939991 RPMRGCSXCBARJU-UQBPGWFLSA-N 466.343 0.315 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1 1835986444 SQFIZNIAMFKQIH-DNVCBOLYSA-N 457.369 0.840 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1 1836711030 GQOPCEMCWGUQSN-RBUKOAKNSA-N 486.374 0.568 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/N3CCCCC3)CCO2)C1 1837440655 RIGNDIKXCYOBNB-CQTDXNOFSA-N 459.385 0.946 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837632862 ZVKLKFNOHMYHKK-ACJLOTCBSA-N 455.309 0.260 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837716060 ZFHGAMRCDWPIQT-JTSKRJEESA-N 478.622 0.508 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cnn4ccccc34)CC2)CC1 1837919277 AUKIGRDSTJFWNT-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD CC(C)CNC(=O)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838108616 WNIJUDOIXYYLPU-UHFFFAOYSA-N 453.584 0.130 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C#N)cc(OC)c3)CCO2)C1 1838583504 HGPIULJIJXYLHH-GHTZIAJQSA-N 451.907 0.891 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)nc1 1839052257 QRANWJPMJUCAAO-IIBYNOLFSA-N 455.939 0.604 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839219197 BBLDNVHMKJRNNN-WZONZLPQSA-N 462.547 0.283 50 20 JCGD Cc1cc(C#N)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839452800 XMNLNVKTTLETHU-XMMPIXPASA-N 478.509 0.249 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1839962821 RPDIEJUGYFUTRJ-ACJLOTCBSA-N 458.309 0.329 50 20 JCGD CC(C)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)CC1 1839974979 JOACLBVWHSXLNG-RLSLOFABSA-N 472.391 0.899 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1840034959 BTDMCIXKXTWHFR-KPZWWZAWSA-N 470.299 0.722 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840034985 CEXGRZVOPNHZJA-QEEYODRMSA-N 483.363 0.440 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840116016 RHSBLHAEOXMXSF-JKSBSHDWSA-N 492.013 0.839 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(OC)c(O)cc3[N+](=O)[O-])C2)C1 1840154426 WXQCTIPKHILHBU-VBKZILBWSA-N 487.893 0.633 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840276686 XAGLPMWHQPFUKU-JLHGSKIFSA-N 489.997 0.690 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)COc3cccnn3)CCO2)C1 1840408171 LEVLRODMTZZOII-KDOFPFPSSA-N 457.325 0.343 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)C(C)(C)S 1843012525 WTNURZMLMVGRTI-QGZVFWFLSA-N 491.419 0.785 50 20 JCGD COc1ccc(/C=C/C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)c(OC)c1OC 1843012697 GPBIRNUWXBBHJT-PKNBQFBNSA-N 480.326 0.923 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2nc3ncccn3n2)C1)NC(=O)NCc1ccccc1 1843719128 FRVPFIDGJXHCKG-UHFFFAOYSA-N 477.529 0.288 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844371766 XAAADBYSVVFTME-QGZVFWFLSA-N 456.547 0.227 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1845520124 UBDPJXPVQLJVBO-UHFFFAOYSA-N 452.276 0.471 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)Cc1n[nH]c(=O)c2ccccc12 28663285 SFQXMUAIUOXAPA-UHFFFAOYSA-N 499.549 0.267 50 20 JCGD CC(C)(C)OC(=O)N1Cc2ccccc2C[C@@H]1C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 727146250 URMNNOHGKKJAJY-HZPDHXFCSA-N 452.533 0.866 50 20 JCGD Cn1nnc2cc(C(=O)NNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)ccc21 729167707 QGQCZQDYFKWUMK-UHFFFAOYSA-N 472.527 0.383 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccoc1 747185844 BKVZQKIJDVTIGB-RCLKMUNOSA-N 455.514 0.434 50 20 JCGD CCC(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 747409758 LETFBPNWNPXYIJ-UHFFFAOYSA-N 454.530 0.909 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@]23CCC(=O)N2c2ccccc2C(=O)N3C2CC2)n1 762274502 MQRAQUJTLALVMK-HSZRJFAPSA-N 497.533 0.826 50 20 JCGD CC(=NNC(=O)[C@@H](C)CN1C[C@H](C)O[C@H](C)C1)c1ccc(S(=O)(=O)NCC(=O)O)cc1 916366335 TYMOZPZRSCGETG-SOUVJXGZSA-N 454.549 0.635 50 20 JCGD CCS(=O)(=O)N(C)CCCNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 916580039 BONUSKULWOMVDF-UHFFFAOYSA-N 454.597 0.201 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)N[C@@H]1CCCN(c2ncccn2)C1 916640529 LSTRFDMJHZXVJD-QGZVFWFLSA-N 489.558 0.111 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCCO3)cc1[C@@]1(C)NC(=O)NC1=O 917732392 URWCCRNBCRCLIC-HXUWFJFHSA-N 476.467 0.144 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CCc1nc2c(O)nc(=O)n(C)c2[nH]1 920275531 ZGMFQPNTPCAAJF-VIFPVBQESA-N 479.291 0.672 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2nc(CO)[nH]c2c1 1778516089 SJXOHGPNXYUTEC-PXDATVDWSA-N 492.341 0.176 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1779317025 YQYLWXDGQRGWAL-XMSQKQJNSA-N 492.485 0.115 50 20 JCGD COc1cccc(OC)c1C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1780538136 FONAKSYXRXKOIK-HSZRJFAPSA-N 454.288 0.141 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1781862278 XZGIJJCTZXNQOP-JKDFXYPNSA-N 450.330 0.443 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1 1782210486 WLZXJTLUZOQITI-ZFJSRUIDSA-N 476.574 0.616 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C/c3cccc(O)c3)C2)C1 1783274684 JEILNDKKNCFSJU-NVIZVJJSSA-N 451.483 0.548 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)CCO2 1783343448 JFXNBVSRGVMTET-TUXXCZFBSA-N 483.363 0.996 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)CCO2)C1 1783875710 SLNNTLAIDMQAMP-ASSNKEHSSA-N 474.905 0.268 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C[C@@H]21 1783966699 KARVPCGUPGIGGN-IWCQGFGOSA-N 494.452 0.669 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COCCOCCOCc3ccccc3)C[C@@H]21)[C@H](O)CCl 1784093682 DJNYXNRYELGOFO-KJJMTIBFSA-N 499.004 0.816 50 20 JCGD CC[C@H](C)[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1784555438 VOJNNBLYXFEPHO-NSYZTORCSA-N 489.617 0.719 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)c12 1786985022 KWBALZZEQOTBME-BPXKWBHBSA-N 477.326 0.763 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786985096 LPNVZNJFTMXSMY-BWPZPKMVSA-N 468.334 0.978 50 20 JCGD Cn1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)ccc1C(F)(F)F 1787743181 NROZCCALXOEWCB-ZVZYQTTQSA-N 479.264 0.631 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3ON=C(c4ccccc4)O3)[C@H]2C1 1788521455 DBQRSIPCOBLVFB-YJZCJGOMSA-N 451.907 0.955 50 20 JCGD CCc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610536 YEGMVNXZRUGSAV-QSFXBCCZSA-N 452.515 0.550 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1792098767 BKPZLDQSSLNRQL-YYWHXJBOSA-N 494.552 0.294 50 20 JCGD C[S@](=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1792893963 OBGOCTKHOXPEAX-JLVFJBGXSA-N 480.027 0.886 50 20 JCGD COc1ccc([C@H]2C[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1793299005 HVEMVQJGAMNLMP-HLSZOSTASA-N 464.327 0.382 50 20 JCGD Cn1cncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793881144 RTJUJXJGKNUJSD-FQLMCAECSA-N 455.943 0.755 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(CCO)CCO)C2 1794143962 ARPPQXAUHDAUJY-YVSFHVDLSA-N 477.002 0.043 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1794405502 VQJNPYAEOXERNK-FVCICTRLSA-N 474.377 0.614 50 20 JCGD Cc1cnc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)cn1 1794702842 QHBINXLHOSNPBZ-HATOLVCRSA-N 481.557 0.334 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@H](O)CN1C(=O)OC(C)(C)C 1796337098 GZQOIALZJUVKNS-ADHGMGHFSA-N 481.594 0.368 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Cn1cccn1)C2 1796439741 ZKEKHERTFYSPJV-ZTRWLKRLSA-N 455.519 0.243 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797754349 SDTLHQFQZABAEI-HEFCWWFNSA-N 462.510 0.829 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1802879954 OLJQKGBMTLZTIB-NSISKUIASA-N 467.530 0.314 50 20 JCGD CC(=O)c1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n[nH]1 1805261713 NIPQHVQINOIKQU-IIBYNOLFSA-N 455.519 0.700 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@@H](CNC(=O)CCBr)[C@H]1c1cccnc1 1806342371 HDWYPAYECLRVIB-NUEKZKHPSA-N 457.325 0.937 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1806343867 ZUCDOCLDHQZLDR-GUYCJALGSA-N 452.309 0.424 50 20 JCGD Nc1ncc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1 1807273351 AWQOJVKESUXIKB-QAPCUYQASA-N 451.317 0.434 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375644 UJWYKERLYBRQMU-WZONZLPQSA-N 460.299 0.424 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)NC2)[C@H]1c1cccnc1 1808410282 UGCMQRWBISQSMU-PWVVMDFHSA-N 479.541 0.748 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1 1812118393 JKPCCLDVKWFZNF-JXFKEZNVSA-N 490.524 0.693 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C[C@@](C)(O)CC(=O)O)[C@@H]1c1cccnc1 1813073597 KTBRZBWAORFCBI-KNXBSLHKSA-N 463.535 0.076 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347951 YZKMTSGATMBNOE-XJKSGUPXSA-N 453.333 0.582 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cn3cccnc3n1)CC2)c1cccc(B(O)O)c1 1815356556 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NC(=O)[C@H](N)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829051757 BAFUSHZVVKPKIF-NRJQMVOHSA-N 497.955 0.566 50 20 JCGD O=C([C@H](O)N1CCOCC1)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1 1830383299 XUUIBMVDXDMUCH-DAYGRLMNSA-N 450.349 0.947 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cn2[nH]cnc(=O)c12 1830543053 IZYSGMMGEWGASD-XCLFUZPHSA-N 496.362 0.432 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725157 GUENOUDTKJQYEU-DRSNIGMVSA-N 489.997 0.832 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732481 YZEHHYPPAZEDJT-QLVMHMETSA-N 453.923 0.306 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCCC1(F)F)CCO2 1831718451 FIJLSRNLGWQRAY-UTKZUKDTSA-N 481.500 0.581 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1831865163 IWWUMCXDEPSZAN-MBSDFSHPSA-N 475.546 0.534 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CN2C(=O)CSC2=S)CC1 1831877245 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1837919275 ATNPKARUABINKK-UHFFFAOYSA-N 451.332 0.616 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnsn3)C2)C1 1838526762 BZMBYEVWCNHCED-FQEVSTJZSA-N 491.482 0.755 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CSC(=N)N)C2)C1 1838528310 PWKABXNBCTVKEA-FQEVSTJZSA-N 495.514 0.217 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200948 SRBIMCVINSABCB-DYVFJYSZSA-N 459.272 0.167 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(NC(C)=O)c(O)c3)C2)C1 1840154853 HWIFMNXJWDPGIH-IIBYNOLFSA-N 469.922 0.674 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4ccc(C#N)cc34)C2)C1 1840155340 YPXJFAQGHXSAIB-IERDGZPVSA-N 461.906 0.758 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCCc3ccncc3)C2)C1 1840182533 NADAVGLHJKIDEE-QHCPKHFHSA-N 461.563 0.234 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C(C)(C)C)C2)C1 1840184234 XJVLVTPKTZEDMF-XMMPIXPASA-N 475.590 0.822 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](O)CCl)[C@@H](O)C1 1847559889 UZMALJLVCAWYLK-GVZUZGFXSA-N 459.971 0.796 50 20 JCGD COc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)cc1 9931192 CDLBVRMWDHVBOU-CQSZACIVSA-N 467.525 0.692 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCc1ccccc1CS(=O)(=O)N1CCOCC1 725872219 BSRGVSNSMFEIEI-UHFFFAOYSA-N 495.583 0.171 50 20 JCGD Cc1ccc(C(=O)NCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(O)c1 728342639 LGUUNBZJMPXKHP-SFHVURJKSA-N 457.439 0.351 50 20 JCGD O=C(NCCCN1CCN(c2ccncc2)CC1)NNC(=O)C1CCN(c2ncccn2)CC1 728951492 DJVFNDAHZHXWFR-UHFFFAOYSA-N 467.578 0.631 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1 729499367 QLXQTYJHIMTAEO-AWEZNQCLSA-N 483.547 0.801 50 20 JCGD CCc1ccc(C(=O)NNC(=O)COc2ccccc2O)cc1S(=O)(=O)N1CCOCC1 730782720 TXYFFWSVLPYQCK-UHFFFAOYSA-N 463.512 0.816 50 20 JCGD C[C@@H](CCN(C)C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 744866876 ZKOSHEVVWOYQNG-INIZCTEOSA-N 455.581 0.311 50 20 JCGD N#Cc1ccc(C(=O)NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccccc3)CC2)cc1 747175994 WGHOMAZVDGXFSR-UHFFFAOYSA-N 469.523 0.633 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc2nncn2c1 749714953 CXGIVPOLMVOKKL-UHFFFAOYSA-N 458.500 0.144 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cc1cnn(C)c1)c(=O)n2Cc1ccccc1 751315676 PUZKWDOEILPRGT-UHFFFAOYSA-N 492.540 0.188 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(C3CC3)[nH]n1)c(=O)n2Cc1ccccc1 913147593 DQEYBSNCEBTBLU-UHFFFAOYSA-N 476.497 0.490 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1 913391902 NAGGMUDGFDCPGA-UHFFFAOYSA-N 454.487 0.684 50 20 JCGD COc1cc(C(=O)NNC(=O)CNC(=O)c2c[nH]c3ccccc3c2=O)cc(OC)c1OC 916099461 OINWSBDDDCASFI-UHFFFAOYSA-N 454.439 0.745 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)c2cnc3nc(O)nc(O)c3c2)cc1 917021415 LCIJGWVCYREYAS-UHFFFAOYSA-N 452.456 0.932 50 20 JCGD CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)C1 918549624 LLDISHLQQOATRF-INIZCTEOSA-N 472.589 0.294 50 20 JCGD O=C(Cc1ccc(NS(=O)(=O)c2cccs2)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919889369 LNNGCZOSIXKURZ-CQSZACIVSA-N 472.570 0.609 50 20 JCGD CC(=O)N[C@@H](C)c1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)s1 1115981857 JFTUZOGORQHVKM-LBPRGKRZSA-N 452.562 0.961 50 20 JCGD COc1cc(C(=O)NNC(=O)C[C@@H]2c3cc(OC)c(OC)cc3CCN2S(C)(=O)=O)ccn1 1317858035 DJLIDKFRIQWPCS-MRXNPFEDSA-N 478.527 0.818 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1778165690 CRLSSWWYUNNJGW-QVKFZJNVSA-N 450.923 0.424 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc2ccccc2n1 1778429463 MQFXSLJXQLAIKD-RCZVLFRGSA-N 474.326 0.751 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)/C=C\C(=O)NC3CC3)C2)C1 1778831143 RPPPLKJVPOXYEA-FUMRIQNTSA-N 486.481 0.798 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCC=CO3)C2)C1)NC(=O)NCc1ccccc1 1778992362 RNYQDAVMUQSKIZ-HYBUGGRVSA-N 471.558 0.855 50 20 JCGD Cc1cnc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C4)cnn2c1 1779022838 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CC(C)(C)OC(=O)NC12CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)(C1)C2 1795736842 MAGAKRIKMAPVKF-ULCYKIJUSA-N 499.373 0.017 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3cc(F)ccc3n1)C2 1796442145 SYQSIFLCQWLMTQ-DFZQMDCHSA-N 481.488 0.811 50 20 JCGD N#Cc1ccc2[nH]nc(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cnccc3C(=O)NN)c2c1 1798443104 SHMMYJXTCJHBLJ-QDMKHBRRSA-N 458.482 0.999 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ncn2c1CNS(=O)(=O)c1ccccc1-2)[C@@H](O)CCl 1799093741 ROLLMBKPYTYRQN-LOUJCGABSA-N 493.973 0.516 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)ccn1 1799097270 LZTVSPXBCDDXNO-IUTQVRIDSA-N 480.569 0.939 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2 1799383393 XHXONFTVTTWZQH-HATOLVCRSA-N 490.670 0.514 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCNC(=O)C1 1801065420 OOUKTVMSUHRKGT-JBXGNFEISA-N 472.970 0.234 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]3c3cccnc3)cc21 1803142929 NXKDFJJHMJWSQK-JLSDUUJJSA-N 460.922 0.331 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)n[nH]2)[C@@H]1c1cccnc1 1807284970 PDNNAPRVXWVVIK-ACJLOTCBSA-N 450.459 0.142 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363659 NHWPQJDQLTZEHN-XUZZJYLKSA-N 496.336 0.976 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807366966 IUSNXAODMJVCOL-QGCDCVKKSA-N 461.331 0.847 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375638 UJWYKERLYBRQMU-JPYJTQIMSA-N 460.299 0.424 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375640 UJWYKERLYBRQMU-MBSDFSHPSA-N 460.299 0.424 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCC(=O)N2)[C@@H]1c1cccnc1 1808414362 IBAHBTRGHZTCSU-IHJYDIMASA-N 465.514 0.500 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnc2ncccn12 1809328312 CCVZCMVYCLJNDD-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1 1809867986 NKZPHLWIKMXWOY-VGOFRKELSA-N 469.546 0.753 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)N1C[C@H]2C[C@H]2C1 1810156444 HHCMHFWFLOVZRI-GWGVIPHVSA-N 462.359 0.421 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1810354645 UFDUJLOFFAPHHW-SLYNCCJLSA-N 450.612 0.590 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1810528839 BYSUTRROWCKHTB-QFAMNNHSSA-N 479.541 0.912 50 20 JCGD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nn1 1811208717 COZKHXJEPRWVFF-IERDGZPVSA-N 455.519 0.573 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(Cl)nc1)CC2)c1cccc(B(O)O)c1 1815347923 XNGYCYLZXZWXIJ-ZDUSSCGKSA-N 457.708 0.806 50 20 JCGD O=C(CNC(=O)c1ccco1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1815648844 BEJOWOGKYVCNML-AWEZNQCLSA-N 468.300 0.072 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCBr)[nH]n1)c1cc(=O)n2[nH]nnc2n1 1817814357 QGOLRCOUXIBLSV-LLVKDONJSA-N 464.284 0.627 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1822703357 ZMXJABFJZKDSHF-QZTJIDSGSA-N 487.565 0.245 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)CC1 1825491743 HLRVMAJOGMUFRI-IBGZPJMESA-N 453.304 0.313 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)CNC(N)=O)C2)C1 1829340841 QAJRCKBYZQNVIC-VGOFRKELSA-N 495.964 0.361 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829715604 CUYQJLNGEUNKQI-YOEHRIQHSA-N 450.399 0.275 50 20 JCGD O=C(Cn1ccc2sccc2c1=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726215 PLPLTLNDWKHDEP-MGPUTAFESA-N 469.947 0.119 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(Cl)c1 1830726599 RMAQOYJZXRUYIK-YLJYHZDGSA-N 461.342 0.947 50 20 JCGD O=C(C1CCN(c2ccccn2)CC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733525 OMXILSBYHDQCOT-XMSQKQJNSA-N 466.966 0.354 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)CCN2CCOCC2)CC1 1831871561 ULTGQCGVRZIXTA-FQEVSTJZSA-N 451.612 0.701 50 20 JCGD CNCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549071 DDHIDMPNSKVDHO-KKSFZXQISA-N 477.002 0.575 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)CC1 1833612984 KLFULNJMDYUEGE-WGSAOQKQSA-N 493.649 0.910 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccno3)CCO2)C1 1834151712 HIVQZZYJQYLAEJ-NRFANRHFSA-N 474.426 0.892 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1 1834423786 GGROCRNPVCOBQL-HNNXBMFYSA-N 495.422 0.952 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834719303 JEGPFOPKDRCMSO-SFHVURJKSA-N 479.390 0.447 50 20 JCGD O=C(Cc1ccc(F)cn1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834834447 HXAHOEVASYNTCR-UHFFFAOYSA-N 468.338 0.328 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cnc(O)[nH]3)CC2)CC1 1835117852 RNVQVFJSRZKSDF-MZJWZYIUSA-N 470.534 0.435 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCO1)CCO2 1836218571 MPENIPGFEKXJLQ-MRUHUIDDSA-N 475.970 0.754 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3nc[nH]c3c1)CCO2 1836934938 ZGJJQATZZOPHMQ-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccoc4cn3)C2)C1 1837460241 XYDWTLTUFUMNAV-QHCPKHFHSA-N 480.481 0.210 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1838568665 JTBHYIKHYUYCBT-OXQOHEQNSA-N 458.870 0.440 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c2ccccc21 1839201294 UGPJIVQJNXGUKE-FXAWDEMLSA-N 499.337 0.487 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3CCC4)CCO2)C1 1839530674 DIIBCSKLRWLNQO-KUHUBIRLSA-N 455.353 0.930 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nsnc3NC)C2)C1 1839961948 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O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(OCC3CC3)cc1)CCO2 1840749319 QTMSESVIELNKKT-SANMLTNESA-N 494.353 0.539 50 20 JCGD C[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)[S@@](=O)c1ccccc1 1844264977 GBTBUCJZWYVLGG-BBFFTDKLSA-N 455.540 0.698 50 20 JCGD O=C1CN(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@@H](Br)Cc2ccccc2)C(=O)N1 1848071417 YEMNEJVZMUXKQC-JYJNAYRXSA-N 463.332 0.746 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(OCC(F)(F)F)n1 1848335992 GSGHCCJOZDZHFZ-IRXDYDNUSA-N 463.221 0.832 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)C(=O)NC1CC1)n2CC 9889269 CNUAVMBZAJNWMT-UHFFFAOYSA-N 478.575 0.445 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)c1)C(=O)NC1CC1 9889698 IBFMDFNIOGGGGW-UHFFFAOYSA-N 485.566 0.233 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cc1c(C)noc1C)c(=O)n2Cc1ccccc1 10161446 ZXNMKDCRAGSBOR-UHFFFAOYSA-N 479.497 0.423 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)NNC(=O)CNC(=O)c1ccco1 725871729 FUPNVGYPPRQTDI-SNVBAGLBSA-N 468.264 0.601 50 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CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc(N3CCC[C@@H](C(N)=O)C3)cc2)c1 918117526 NHRSBTWHJIFPMO-QGZVFWFLSA-N 473.555 0.936 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1778063214 ZWAAFXLGWPJXJA-NRFANRHFSA-N 462.938 0.804 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)CCN3CCOC3=O)C2)C1 1778154851 OERCUJLZISPGHH-YCRPNKLZSA-N 488.969 0.791 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3cccnc23)C1 1778959267 VVKCNINNIKVDSX-VFHFUPNESA-N 492.540 0.991 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028433 FEAXHELSVIGQLQ-NPMXOYFQSA-N 490.561 0.289 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1)n1cncn1 1780968470 CTGLXAUMMKCKGW-FDDCHVKYSA-N 484.561 0.015 50 20 JCGD O=C1Cc2cccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)c2N1 1781352893 YHPCGZFBCSXJKA-CJFMBICVSA-N 477.326 0.302 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ccc(F)cn3n2)C1 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KAVUANMIGZKTKB-UHFFFAOYSA-N 460.343 0.737 50 20 JCGD NC[C@H](N)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Br)Cc3ccccc3)CC2)CC1 1835067228 MNJLOAMCVOOOTP-UXHICEINSA-N 480.451 0.850 50 20 JCGD N#Cc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1Cl 1835938164 NXAUBIYUMQNCQR-QHCPKHFHSA-N 483.717 0.275 50 20 JCGD COc1nn(C)cc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1837378281 QJUBBRMEPWGRBC-UHFFFAOYSA-N 464.567 0.414 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1F 1837455945 GTDHXKQJMNCIJQ-VWLOTQADSA-N 499.543 0.835 50 20 JCGD Cc1nc(C)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)s1 1837456383 HBXGGYYGGYAHDO-OAQYLSRUSA-N 474.543 0.142 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1F 1837456474 NEGRJQDNXPXDDY-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncc3Cl)C2)C1 1837459488 RUJZXMXFAVBQLF-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD Cc1cc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)ccc2[nH]1 1837460247 YJDFQECNTIKVME-RUZDIDTESA-N 492.536 0.859 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C)c1 1838901812 AJHMQYTUSPXVPY-XMMPIXPASA-N 452.316 0.367 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1839151508 UUGAPRIZEWBIAS-MOPGFXCFSA-N 494.397 0.791 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC)c(NC(C)=O)c3)C2)C1 1840154169 NXMYQBFPEDGJFX-HTAPYJJXSA-N 483.949 0.977 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841534751 YGVRDNFJDLVCLN-KRWDZBQOSA-N 458.563 0.451 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)Cc2n[nH]c3cc(Cl)ccc23)C1 1845025706 KOTDTRAWFYFTQY-UHFFFAOYSA-N 452.707 0.956 50 20 JCGD COCCOCCOCCOCC(=O)N1CCCC12CN(C(=O)[C@@H](F)Br)C2 1846257283 ZILDEPAAWIBSDT-OAHLLOKOSA-N 455.321 0.577 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cnccc1C(=O)NN 1847940293 PIEBWCUMMQHXEH-BZSNNMDCSA-N 472.546 0.970 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2cc(Br)c[nH]2)cc1S(=O)(=O)N1CCOCC1 23914120 FOYBOGWYBYGDAP-UHFFFAOYSA-N 487.332 0.882 50 20 JCGD Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cc(Br)c[nH]1 28717920 PPUMMYZSANEDMV-UHFFFAOYSA-N 460.310 0.211 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCC(=O)N(C)CCc2ccccn2)c2ccccc2c1=O 727608264 OJTIHEZOWHYWHQ-UHFFFAOYSA-N 451.487 0.457 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)N3CCOCC3)cc2)C1 728262340 DPLHVZPDABRGAE-GASCZTMLSA-N 460.578 0.588 50 20 JCGD C[C@H]1CN(c2ccc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cn2)C[C@@H](C)O1 728324139 QGFNEFFJOFIWMU-KHYOSLBOSA-N 470.482 0.839 50 20 JCGD CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1nnn(-c2ccc(Cl)cc2)c1C 747610310 BRGIGIUZDNSDEI-UHFFFAOYSA-N 462.923 0.654 50 20 JCGD CC(C)N(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 811848579 LHRRJEILDOTYAU-IBGZPJMESA-N 491.522 0.860 50 20 JCGD CCOC(=O)c1c[nH]nc1S(=O)(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 818783965 QAKRVRPZJIQCIV-UHFFFAOYSA-N 496.505 0.968 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(F)cc1)NNC(=O)CCN1CCN(c2ccccc2)CC1 913391785 BPSLRUJXMKHUDG-UHFFFAOYSA-N 477.562 0.854 50 20 JCGD Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 914881633 OPRSVNNKVPLEEA-IIAWOOMASA-N 471.963 0.907 50 20 JCGD NS(=O)(=O)c1ccc(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)s1 915188299 ZHVUXKDATGXMKE-UHFFFAOYSA-N 472.570 0.184 50 20 JCGD C[C@@H]1CN(CCCNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)C[C@@H](C)O1 916250083 VIFIYZGHSXXNGN-IAGOWNOFSA-N 467.592 0.914 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C(C)C)N2CCN(C)CC2)cc1 916258266 PYIRSRFQUWPOKC-LJQANCHMSA-N 468.624 0.218 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1cc2c(cc1O)OCO2 916720598 WDCMAVHWCSZJCA-UHFFFAOYSA-N 477.495 0.536 50 20 JCGD CCCCS(=O)(=O)N1CCC(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)CC1 917278541 ACCPEWUSUCSMRV-SFHVURJKSA-N 483.543 0.359 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)CNC(=O)NC1CCCCC1 917933879 STQALICPPAGBEB-UHFFFAOYSA-N 495.602 0.419 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)CN1CCCC1=O 920827492 ZNIIZIDVKLZNKF-UHFFFAOYSA-N 452.411 0.023 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1778082207 UTMJTIVJMSASTP-KQDGPHEJSA-N 475.970 0.034 50 20 JCGD Cn1ccc2cccc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c21 1779032075 LJSCAGIPFGGURI-DEOSSOPVSA-N 462.510 0.934 50 20 JCGD COc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nc1Br 1779922707 IPYTVCHSOHZZQD-HXUWFJFHSA-N 498.378 0.669 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCOC1)CCO2)NC(=O)NCc1ccccc1 1780968594 FJGYPGKBHRTNPF-WMZHIEFXSA-N 459.547 0.199 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781324946 GAKOCMPVKSFVDY-SNUQEOBHSA-N 482.347 0.783 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)c1ccc(N2C(=O)C=CC2=O)cc1 1783058713 SERUBHADEPZKGL-PMAPCBKXSA-N 475.929 0.843 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)Cn3c(=O)n(C)c4ccccc43)CCO2)C1 1783874745 KTXRCBHANJGHPC-YCRPNKLZSA-N 450.923 0.424 50 20 JCGD CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784092090 GDTQSYFGTOKJKZ-WPUCRFQZSA-N 494.397 0.905 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ncncc4c3)[C@H]2C1 1788380066 XLESNTNOMFOYAG-ZRCAFCQKSA-N 475.509 0.535 50 20 JCGD CN(C)[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccccc1Cl 1790678380 XAEBALYFMWMVBH-NWZJSZKRSA-N 499.804 0.916 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C(=O)NCc3ccco3)C[C@@H]21 1791255602 WVWPQPASGQPIBS-XBTWKOANSA-N 453.923 0.686 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ncn1)C2 1793878318 RSNRQAPUKRQRKL-LMWOUKEDSA-N 469.926 0.518 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1scnc1C1CC1 1794508846 NRJOSKHVDJSRQF-YWVIFJGQSA-N 456.528 0.536 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c[nH]c1C 1795732958 SHMSUYOUHGMEFA-BBIADKPPSA-N 497.357 0.016 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1-c1ccccc1)C2)c1ccc(B(O)O)cc1 1795734105 CMVIRTUJTADYSH-OPMZPASUSA-N 460.299 0.069 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN(Cc3ccccc3)C1)C2)c1cccc(B(O)O)c1 1795737408 YQZKOWMBSUYLSK-AGDMDRQQSA-N 491.397 0.482 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737776 SEARBJWOUKMCTK-JWVYWZTKSA-N 454.357 0.750 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1Cl)C2)c1cccc(B(O)O)c1 1795738818 GXXUPVNJSXKIRL-HBCWATKFSA-N 468.706 0.365 50 20 JCGD Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cc2c1-c1ncccc1OC2 1795935945 BGWOKBBBBWMGLX-CXHZTBPHSA-N 460.918 0.782 50 20 JCGD CCn1nc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c2ccccc21 1796023336 LOGALKCQPASHST-VPTLXERWSA-N 456.547 0.632 50 20 JCGD CC(C)n1nc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1C(=O)O 1796188207 BMQZPSFEBCNWIN-BJWYYQGGSA-N 454.292 0.408 50 20 JCGD CC(=O)O[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C(C)C 1796441888 DEGBVBGEPYHMDQ-QAMHDZDCSA-N 461.519 0.298 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)n(C)c(=O)n2C 1796983100 SYBZIEBJDFLNAC-KRXQYRFLSA-N 450.923 0.334 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)c1cnccc1C(=O)NN)CC2 1797753990 NXVIPGYPUHTTBN-OVCNXMPXSA-N 493.564 0.702 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1nc(O)n3c1CCCC3)C2 1798439881 MUISSWTWRGXHGY-BTTYYORXSA-N 453.503 0.489 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)ccc1O)C2)NC(=O)NCc1ccccc1 1799097678 SUMWXNZZUNXRJB-FEJSZKPUSA-N 497.552 0.647 50 20 JCGD CC(C)n1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)n1 1799097975 XWENQLCOEQVXSC-CEQLMSFQSA-N 498.588 0.408 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)CSC1=S)C2)[C@@H](F)Br 1799350534 VUKMQYMGPQKAAU-IWXIMVSXSA-N 454.343 0.127 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1)C2 1800971391 YCHWLHDSSCYMGH-YYIAUSFCSA-N 489.997 0.592 50 20 JCGD COc1ccc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCC(=O)NN(C)C)ccc2c1 1801011653 XMLMXFCFYDRJNI-GPVSGQMNSA-N 469.542 0.820 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1C[C@@]12C(=O)Nc1ccccc12 1801928704 BOVKLETYKWPLNN-LDEWZNRDSA-N 474.521 0.847 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803138200 YGMJJVHDMRWJDR-WCXIOVBPSA-N 470.954 0.573 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807365825 PKGJOADZWSHOSM-ZBFHGGJFSA-N 497.210 0.436 50 20 JCGD Cc1nnc(CC(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)s1 1807539742 ZDHAJISXLKVCPJ-IERDGZPVSA-N 459.576 0.863 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCc2cnc[nH]2)[C@@H]1c1cccnc1 1810295111 QFENNLHFZIFOBY-IIBYNOLFSA-N 462.514 0.756 50 20 JCGD COCCn1nccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817471849 RGUSQEKJILORFU-SFHVURJKSA-N 466.307 0.552 50 20 JCGD CC(C)n1cnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)n1 1817682741 DUXQMHOHKGDRIH-AWEZNQCLSA-N 454.321 0.535 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc2cn[nH]c2cn1 1819232886 LKCBFNLTDQXLFE-IBGZPJMESA-N 459.275 0.981 50 20 JCGD COCCn1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819796935 IUIDMFDDIMNKPD-LBPRGKRZSA-N 484.542 0.524 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc3ncccn3n1)CC2 1819797328 SMVYCXSEMKKNHA-NSHDSACASA-N 477.510 0.724 50 20 JCGD COCc1oncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797617 WIFKNVUNVUZOGP-SNVBAGLBSA-N 471.499 0.816 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)nc1 1825562851 QNDQQZBKGAMGSL-JOCHJYFZSA-N 499.398 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc(OCF)cn1)CC2 1826080727 VHWOAYNCQDHZCQ-NSHDSACASA-N 465.511 0.838 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060490 LTBUUSPDSBYIIB-CVDCTZTESA-N 460.336 0.216 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1827680804 WVVLASRJLNQAOI-VEPFXTNKSA-N 490.561 0.805 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)CCO2 1830422170 FAJMFTSJOHKVKQ-DFIYOIEZSA-N 497.527 0.698 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)OC(C)(C)C)C2)C1 1830544495 ZNVAPLWMZLPYMF-KUHUBIRLSA-N 478.384 0.999 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1831139335 QOJMHCFJXYYLBS-IIBYNOLFSA-N 473.954 0.220 50 20 JCGD CCCNC(=O)CCC(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1833426063 MTNCMKXZPZZJKL-UHFFFAOYSA-N 466.627 0.237 50 20 JCGD Cc1nc(C)c(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)s1 1834157115 KYUFSAAHRKUANB-UHFFFAOYSA-N 470.404 0.939 50 20 JCGD O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834421842 OQAUCLHZJQLIES-UHFFFAOYSA-N 466.185 0.337 50 20 JCGD CN1CCc2cc(C(=O)N3CCC(N4CCC(NC(=O)c5ccc(B(O)O)cc5)CC4)CC3)ccc21 1834798595 OJPKMVSYDLOMCB-UHFFFAOYSA-N 490.413 0.858 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4cn[nH]c4cn3)CC2)CC1)c1cccc(B(O)O)c1 1834801093 KWRZLMMBCLUDPL-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cn4ccccc4n3)CC2)CC1 1835300767 FUWMYWATPPEEOI-UHFFFAOYSA-N 469.590 0.893 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3cn4ccsc4n3)CC2)CC1 1835593756 KXMZUGSRPRCADV-UHFFFAOYSA-N 496.597 0.893 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](Br)CC)CC2)CC1 1835645367 HMUUROCTVAFFSM-DOTOQJQBSA-N 477.400 0.796 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1835759162 IGNGKIWYMUJQTP-MGPUTAFESA-N 475.428 0.240 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)nc2ccccc12 1835930687 UKIPQROECKNDKH-SANMLTNESA-N 489.337 0.607 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1 1835936791 DMGZLWSSTDXJRQ-VWLOTQADSA-N 475.310 0.298 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2 1836623927 AYEFFKPBWOEMGJ-NHCUHLMSSA-N 484.280 0.354 50 20 JCGD Cc1cc(F)c(F)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1 1837459331 CWTHRTZCAXMJPB-HSZRJFAPSA-N 489.479 0.656 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)C[C@H](N)c3cccnc3)C2)C1 1837711251 AFRWDJVZTKMNIC-RXVVDRJESA-N 450.612 0.779 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(O)nn3)C2)C1 1839155276 PVXUXFIGGQGABV-RTBURBONSA-N 461.346 0.808 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(-n3cccn3)cc1)CCO2 1839338433 ZDTPLQGHHOLDQE-XMMPIXPASA-N 484.557 0.315 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ccsc4[nH]3)CCO2)C1 1839521114 JMVCNBHMNQUFJA-QFIPXVFZSA-N 484.538 0.612 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3nscc13)CCO2 1839575660 DSLWKGQUIZXWAS-HSZRJFAPSA-N 481.339 0.360 50 20 JCGD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839911833 BKXXECKSZOGCLN-DSPLJNTKSA-N 456.348 0.263 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C)CN(C(=O)OC(C)(C)C)C3)C2)C1 1840153113 DYPSJUBEUJKQMP-AOMKIAJQSA-N 489.997 0.954 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccc4)no3)C2)C1 1840184951 COSLIXCKWSCTNK-XMMPIXPASA-N 485.541 0.785 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841088849 OZWAUDJEHZYRQA-LJQANCHMSA-N 458.563 0.451 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)c1cccc(N(C)C)c1 21206963 SXTBYLOEXIVIBV-SFHVURJKSA-N 476.555 0.756 50 20 JCGD O=C(CCN1C(=O)COc2ccccc21)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 21894522 IBXUNYXLSDBODC-UHFFFAOYSA-N 488.522 0.284 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN1C(=O)N[C@@](C)(c2ccc(F)cc2)C1=O 23750533 JQTYWERDRKRBQJ-NRFANRHFSA-N 490.517 0.655 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CNc2ccc(C)cc2)cc1OC 104798365 BZYQJAKHFFNJCV-UHFFFAOYSA-N 450.517 0.940 50 20 JCGD Cn1nc(Br)c2c(=O)n(CC(=O)NNC(=O)c3cc(Cl)ccc3O)cnc21 727162646 PZOYKHMBGVSPLB-UHFFFAOYSA-N 455.656 0.713 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)cc1NC(=O)c1ccccn1 728507032 LABZZHMJEBGSDZ-UHFFFAOYSA-N 473.467 0.675 50 20 JCGD NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728889250 BGKCNEGAONQUOY-UHFFFAOYSA-N 483.348 0.564 50 20 JCGD Cc1ncsc1C(=O)NNC(=O)CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21 729453693 QSTCJVBGTRTHFB-UHFFFAOYSA-N 479.540 0.995 50 20 JCGD O=C(NN=C1CCS(=O)(=O)c2ccc(Br)cc21)N[C@@H]1CCS(=O)(=O)C1 729816279 KASHNIXPRQZHKM-SNVBAGLBSA-N 450.336 0.817 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1c(F)ccc(S(=O)(=O)NC2CC2)c1F 729845701 VJCWLYVWSNABGF-UHFFFAOYSA-N 458.468 0.658 50 20 JCGD N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1 731852283 HOWFUPSCVQTLSY-UHFFFAOYSA-N 480.510 0.396 50 20 JCGD NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1 770427526 RCOAOHAHEFGTBI-UHFFFAOYSA-N 462.484 0.017 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc(Cl)cc1)NNC(=O)[C@H]1COc2ccccc2O1 831088970 QNPVUHVSLUAVHO-MRXNPFEDSA-N 483.886 0.149 50 20 JCGD O=C(COC(=O)c1ccc(=O)n(-c2ccccc2)n1)NNC(=O)[C@H]1COc2ccccc2O1 914593339 MEJOUYHBNYWDCP-GOSISDBHSA-N 450.407 0.377 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC2CCN(CCN(C)C)CC2)c1 916382978 UMEWAHGVYJIXTJ-UHFFFAOYSA-N 468.624 0.687 50 20 JCGD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)C(=O)Nc2ccc(C)c(C)c2)c1 916567530 NVXOSLPENYDLJT-UHFFFAOYSA-N 463.468 0.825 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3c[nH]c4ccccc34)n[nH]c2n1 917393670 ROAIKUCAZXNRFH-UHFFFAOYSA-N 454.520 0.839 50 20 JCGD C[C@@H](CN1CCC[C@@H](C)C1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 919914212 CXGDTJLINSCHRZ-SJORKVTESA-N 467.592 0.772 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)CC1 1778114151 AVPZFEPMHGAROG-BBRMVZONSA-N 470.361 0.178 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)[C@@]3(F)CCCCC3(F)F)C2)C1 1778221385 SILLGPILHNOVRE-UXHICEINSA-N 454.254 0.728 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4sccc4[nH]3)C2)C1 1778701262 WBVLHDFTNIXKIH-OAQYLSRUSA-N 454.512 0.985 50 20 JCGD O=C(C[C@H]1CNc2ccccc2O1)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1778934240 VTHCHOREWSNSMN-YADARESESA-N 465.315 0.073 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1(Br)CC1)CCO2 1779037195 SZSYDKOYDKNXJK-QGZVFWFLSA-N 452.309 0.056 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccc(F)cc1 1780909810 OOPQUBKSZBWIKE-RDPSFJRHSA-N 498.515 0.145 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)N(C)C(=O)OC(C)(C)C 1781040753 FAFZEYFUIYFGDT-ZHRRBRCNSA-N 469.583 0.445 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3ccnn3c2)C1 1781346739 UKJQTWGSHJLUCM-HYBUGGRVSA-N 477.525 0.774 50 20 JCGD CCSc1ncccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1783411986 OJHIBFMGGAEYIV-VDGAXYAQSA-N 469.372 0.781 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cnn(C)c3)C2)C1)NC(=O)NCc1ccccc1 1784576812 DKTPDXMQDWZJNK-XMMPIXPASA-N 483.573 0.139 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCCc3cccnc3)C2)C1 1784672440 PWOYKEZKSVQWFK-HSZRJFAPSA-N 452.515 0.547 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CCCO4)C2)C1 1784956258 DCHZTZOBPFVIHT-DEOSSOPVSA-N 450.300 0.449 50 20 JCGD O=C(CCc1ccc(F)nc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785233050 JZKBNYKIVJTNCH-IHPCNDPISA-N 455.295 0.127 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1n[nH]c(C2CC2)c1F 1785764796 FWCSHOPMPHRBTR-XIRDDKMYSA-N 456.283 0.013 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc2nc(Br)nn2c1 1787149623 UDFSHXVMBFIZCN-XUXIUFHCSA-N 486.754 0.685 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnn(C)c3C)C[C@@H]21 1787508714 JMFFXJAFRIFOMX-IZOVEJKUSA-N 455.519 0.456 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4ccccc4n3)C[C@@H]21 1788610376 OBBSWODIMVIDSA-LFRPXUGBSA-N 475.509 0.535 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(C(F)(F)F)ccn1 1788966146 JTILQQWCWLMWFU-FNHZYXHNSA-N 477.248 0.687 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1790666515 MMGXANXGBFZOGF-OLGWUGKESA-N 465.978 0.201 50 20 JCGD CC(=O)NCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21 1790874209 NEXCAXZNLQQSRA-QSFXBCCZSA-N 476.486 0.640 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791288606 LLTXJGQPMWNGFP-IHPCNDPISA-N 498.584 0.853 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCCOC3=O)cc1)C2)[C@@H](O)CCl 1792980726 VHROJCYUNMVHCN-MVJTYMMSSA-N 451.907 0.836 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](O)CCl)CC1 1793118059 RXEDWPXTGSBEBT-YVSFHVDLSA-N 458.987 0.777 50 20 JCGD N#Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)ccc1Br 1795739903 OFKIDNGNEFZWFC-XEMDLRDOSA-N 498.142 0.518 50 20 JCGD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)ccc1[N+](=O)[O-] 1796190583 OBSDUCPZUIPZNR-BCDXTJNWSA-N 453.260 0.849 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnc3s1)C2 1797750965 WWKQMRJPWQDTPD-ZSBFGKGUSA-N 466.523 0.812 50 20 JCGD COCCOCCOCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)Br)C2 1800849200 PPMMDAYJTLQJER-XLMAVXFVSA-N 481.384 0.056 50 20 JCGD CC(C)[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)NC(=O)OC(C)(C)C 1800898424 WQEYEZBOQJSEGQ-WYADAEROSA-N 497.637 0.888 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCN1CCCC1)NC(=O)NCc1ccccc1 1802192318 FBRUMGNBBHJIQI-RUMRUAAYSA-N 486.617 0.408 50 20 JCGD COC(=O)CSCC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803576560 ADGKQMSXACRDOH-MGPUTAFESA-N 486.554 0.306 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1 1805408593 SHTCPGXHGXTFKU-IBGZPJMESA-N 489.378 0.097 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1806340759 LYXRMRPYUUXLJH-VQIMIIECSA-N 460.137 0.866 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807369384 IFQXDJUPPINWJX-WMZHIEFXSA-N 487.325 0.748 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)n1ccccc1=O 1807374388 HEWCAUZBCLMNHV-HCLVMJGWSA-N 474.326 0.504 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CC2(O)CCC2)[C@H]1c1cccnc1 1813636136 XSSGRWKTJLEFHW-OXJNMPFZSA-N 452.515 0.705 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)N1CCN(C)CC1 1817476895 GMFRJAZMWVHFKX-JXFKEZNVSA-N 468.367 0.031 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc2nncn2c1 1819117666 PWSFBKKVLRYXAY-SFHVURJKSA-N 459.275 0.752 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(=O)n1O)CC2 1819793014 HABGQZHOGSFPPT-SNVBAGLBSA-N 469.483 0.080 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)COc1cccnn1)CC2 1819801589 OLMZWSNBIBCLBF-NSHDSACASA-N 468.499 0.236 50 20 JCGD Cc1nccnc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1820872800 JLZFYPVSWRTGBI-LLVKDONJSA-N 452.500 0.780 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc4cccnn4n3)sc2C1 1821167718 CZXDJMULJYMEIL-GFCCVEGCSA-N 456.532 0.785 50 20 JCGD COc1ccnc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1OC 1821794921 SLKSTHXNDHQWKI-AWEZNQCLSA-N 482.327 0.775 50 20 JCGD COc1cnc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1 1827055052 SOFPSVVOMQBWNR-FQEVSTJZSA-N 452.320 0.712 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923754 ABGSYZZINVXRFC-VQTJNVASSA-N 474.562 0.070 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(S(C)(=O)=O)c3)CCO2)C1 1830182708 PRPNZHZPKRWQAX-LIRRHRJNSA-N 489.388 0.944 50 20 JCGD CSCC[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830544137 ODFCUGXJHRMASF-GRDNDAEWSA-N 453.399 0.588 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)COc2cccnn2)CC1 1832193878 JLDZFZZNIZVPRJ-LJQANCHMSA-N 467.530 0.787 50 20 JCGD Cc1nn(C)cc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1833582198 RWTXWEPQZHFHQP-UHFFFAOYSA-N 468.562 0.226 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H](O)Cc3ccccc3)C2)C1 1834825033 RKRCJIKXIMAKDA-YLJYHZDGSA-N 455.349 0.831 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1835836991 ITXQQNPZLUJJAX-OAQYLSRUSA-N 456.660 0.060 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccc(Cl)cc1 1835934332 VRXZIXVAVWTUDN-XDHUDOTRSA-N 486.761 0.894 50 20 JCGD O=C(Cc1ccccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935333 AZTVIVRCMRUSMV-HSZRJFAPSA-N 472.734 0.333 50 20 JCGD Cc1cc(F)c(F)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1835939002 BAGXZQCJCADYIH-HSZRJFAPSA-N 474.269 0.337 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)c(F)cc3F)C2)C1 1835939233 IGBRDMPWPYXGJQ-QFIPXVFZSA-N 494.687 0.682 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1836255411 AXASAZCSLAUYEQ-IFXJQAMLSA-N 474.967 0.316 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836715026 HFPOFCFHHVLSGT-IBGZPJMESA-N 488.006 0.838 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836717345 CBMJTHBPUNRHRP-HZPDHXFCSA-N 463.959 0.428 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cccnc4n3)C2)C1 1837459241 NDZMUABBPQVTGA-XMMPIXPASA-N 491.508 0.012 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1F 1837460641 IHQQGZPBXFZZCZ-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD Cc1nccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1838210663 LOKWWWNFVYTBBL-AOMKIAJQSA-N 497.980 0.987 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc[n+]([O-])cc3)CCO2)C1 1838334051 WHXDZDCQNGJRKV-HTAPYJJXSA-N 498.964 0.522 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(C#N)c1Cl)CCO2 1838599550 LDCITKRZHJJCGY-QFIPXVFZSA-N 477.949 0.655 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/C(=O)NCc3ccco3)C2)C1 1839145577 MPVIBWFKZHXWEY-RAIXIZIVSA-N 453.923 0.926 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839156201 GQOBCXAUGIJDCF-SNRMKQJTSA-N 452.379 0.984 50 20 JCGD O=C([C@@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)CCO2 1839727254 HBJGJFZOQOCENF-PSHVLCQKSA-N 469.941 0.613 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1840034844 YYHDUVNXQGEWNM-XIKOKIGWSA-N 456.293 0.664 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840039279 MYHCBOHERZXVRC-AJAKECSLSA-N 487.981 0.442 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(F)F)no3)C2)C1 1840184038 OOXISNCTNUGGCL-IBGZPJMESA-N 459.450 0.055 50 20 JCGD COc1cc(F)c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1 1840185669 UVXUCSDAUWFRNP-JOCHJYFZSA-N 484.500 0.416 50 20 JCGD Cn1c(=O)n(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)c2ccccc21 1840188437 JKCZUMBRCJYYMP-FQEVSTJZSA-N 471.341 0.600 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1841515316 HWYFKXWQZXXQNG-UHFFFAOYSA-N 475.351 0.115 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CCCC12CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1842881266 HZNLZEXAGZYTBA-CVEARBPZSA-N 451.365 0.789 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)CCN1Cc3ccccc3C1=O)C2 1844264423 RHMIRAYBYOEEQH-UHFFFAOYSA-N 462.510 0.548 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@]1(C)CN(C(=O)OC(C)(C)C)CC[C@H]1O)C2 1846383542 IPSSQTCYYUPIMJ-UZUQRXQVSA-N 495.621 0.571 50 20 JCGD O=C(Cc1cnn(-c2ccccc2)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 29477415 BGQBGJBCEZGLDO-UHFFFAOYSA-N 469.523 0.897 50 20 JCGD C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)NCCC(=O)N1CCN(c2ncccn2)CC1 726710681 NECBOMKGQGCTSK-OAHLLOKOSA-N 459.482 0.452 50 20 JCGD Cc1ccccc1[C@@H](CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)NC(N)=O 728323636 OZOKERSOKGBGJY-CRAIPNDOSA-N 456.455 0.625 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc2c(c1)OCO2)C1CCN(c2ncccn2)CC1 728844682 AJFAMGRVIDORCD-QGZVFWFLSA-N 466.498 0.874 50 20 JCGD COc1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCN(C(C)=O)CC3)c2)cn1 729693414 XMKJPADZXKPIIY-UHFFFAOYSA-N 492.583 0.574 50 20 JCGD NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)s1 745492275 XDPPVYQCGOSGNI-UHFFFAOYSA-N 494.576 0.949 50 20 JCGD O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)CNC(=O)c1ccco1 751204331 GVCAWPPAEYBWAQ-UHFFFAOYSA-N 477.271 0.996 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)c1 751206989 PANXCESFGMZXCR-UHFFFAOYSA-N 476.511 0.460 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)N[C@@]3(CCCC[C@H]3C)C2=O)n1 760205683 YGWRFOSMDQXXIB-NSPYISDASA-N 451.505 0.185 50 20 JCGD CSc1ncc(Cl)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)n1 822714394 FQKDHZURWPPKNW-UHFFFAOYSA-N 471.948 0.948 50 20 JCGD COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)OCC(=O)N2CCNC(=O)C2)cc1OC 914335332 MGNRYLVXIGDOFY-YVLHZVERSA-N 492.492 0.890 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc2nc(O)[nH]c2c1 914711415 YYFCCPRJOZUDAY-UHFFFAOYSA-N 473.511 0.683 50 20 JCGD CCc1ccccc1OCC(=O)NNC(=O)NCc1ccc(C(=O)N2CCNC(=O)C2)cc1 916391590 GAZBGVAQGNNDGU-UHFFFAOYSA-N 453.499 0.730 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cn3cccnc3n1)N(S(C)(=O)=O)CC2 916827742 VSFJAKBVOJCRQU-MRXNPFEDSA-N 488.526 0.457 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1ccccc1NS(=O)(=O)c1ccc2c(c1)OCCO2 920436010 SUYCWGJTGDKXFJ-UHFFFAOYSA-N 474.495 0.642 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2cccc(OCCN3CCOCC3)c2)c1 920838090 JCBVJIHHPUBZKQ-UHFFFAOYSA-N 476.555 0.945 50 20 JCGD CN(C)c1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)c1 921248087 RJEDHQBQXOGKPD-UHFFFAOYSA-N 450.477 0.583 50 20 JCGD COC(=O)C12CCC(C(=O)N3CC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)(CC1)CC2 1778305575 CGEIPLAXUARVSQ-VHYCJAOWSA-N 478.590 0.703 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1778440852 NCXFOWUGBXLKTC-HSZRJFAPSA-N 454.531 0.755 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(-c4ccncc4)[nH]n3)CCO2)C1 1779032700 SJFRGCXOIQQMSX-HSZRJFAPSA-N 476.497 0.228 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cccn(C(F)F)c3=O)C2)C1 1779364296 VSFIPZXBLAEIFG-FQEVSTJZSA-N 455.462 0.060 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](C)n1cncn1)CCO2 1780099077 RGNUJLLIJTUEND-SZNDQCEHSA-N 472.458 0.816 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4sc(C)cn4c3=O)CCO2)C1 1783876466 YAUDPMGOGDBGSW-LIRRHRJNSA-N 454.936 0.762 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccccc3F)C2)C1 1784735951 INHXJFRASWRCAE-QHCPKHFHSA-N 455.490 0.901 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCc4sccc4C3)C[C@@H]21)c1ccc(B(O)O)cc1 1786980163 PKCRUEPUTLWOLK-JBACZVJFSA-N 483.399 0.080 50 20 JCGD NC(=O)c1nccnc1C(=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788142450 XTNWHPNSQPMZCS-UHFFFAOYSA-N 459.271 0.317 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)nc2nccn12 1791294009 XWIFVYXNRWXCNX-BQFCYCMXSA-N 457.535 0.004 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2(c3ccc(NC(=O)CCC(=O)NN(C)C)cc3)CCC2)CC1 1791601486 CKUQYUVMABGBNL-UHFFFAOYSA-N 472.590 0.658 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(=O)OC(C)(C)C 1793589628 ZBGQEJNMFMVAGQ-IHHIPJHASA-N 461.519 0.442 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795737035 ULHOIBXWEAINFR-BDCURPAKSA-N 481.264 0.455 50 20 JCGD CCn1nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c2ccccc21 1795738971 OMSDKRTUGCPPCQ-UPHUGPLXSA-N 462.315 0.253 50 20 JCGD CCOc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Cl)COC)C3)cnc2c1cnn2C 1796074063 AGSYMUNQIIGXNR-RMHZUWNSSA-N 465.938 0.824 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C 1796336631 YYBHUSPWUJDKOF-QEOTZNIISA-N 475.970 0.466 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2 1797864621 MRRNACZXRKICSY-IPVBOJNNSA-N 468.352 0.216 50 20 JCGD COc1ccc(OC)c(CCCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1799342377 NKXAULFFZBKNFZ-NXKWYNOOSA-N 496.369 0.610 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)cn1 1799346436 QOMDJFJPFBZBQN-NEBZKDRISA-N 478.340 0.520 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(O)c(O)c(Cl)c1 1799769517 USLULLWDBUZXFK-DPIQGUFMSA-N 475.889 0.267 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(=O)n1O)C2)NC(=O)NCc1ccccc1 1799864824 PJUKFDJJUVUBKM-REPLKXPHSA-N 482.541 0.684 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1802862923 KRQJLZWKIYRGET-SCWSEQNSSA-N 496.373 0.994 50 20 JCGD CNC(=O)CC(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1803481374 IMCZRZZROPSBDH-HYBUGGRVSA-N 495.584 0.570 50 20 JCGD O=C(CN1C(=O)CNC1=O)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1804090489 HUACPYAHZFMGTC-SUMWQHHRSA-N 452.309 0.424 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(O)n2)[C@@H]1c1cccnc1 1805674682 FZGRTIBDMKHZIH-YWZLYKJASA-N 461.482 0.814 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@@H](CNC(=O)CNC(=N)N)[C@H]1c1cccnc1 1807051710 KLAWIQMHIPPUNJ-YQQAZPJKSA-N 481.985 0.703 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361088 DZGBKGPHBOZVAM-GBXCKJPGSA-N 478.358 0.484 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cncn2-c2ccncc2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369919 YVPCQUFFIUNVSP-HYBUGGRVSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)[C@@H](O)c2ccccc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370721 JWVIJPMTPAQPJR-PUHATCMVSA-N 459.311 0.815 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)ccn1 1809977740 FQHIJCXVCXGKBU-UHFFFAOYSA-N 464.331 0.878 50 20 JCGD CNC(=S)NCCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1810306710 MZNSAVCPMSDWQZ-QXIYLWIPSA-N 498.613 0.705 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc(Cl)nn1 1810680236 CRRGBNMBOIRGTN-OXQOHEQNSA-N 465.706 0.838 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@H]1c1cccnc1 1812866971 VAVVBDBSQMVHIW-MBGYTDRXSA-N 455.353 0.521 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2cnccn2)[C@@H]1c1cccnc1 1813072690 DLGOYWFOBAQJFG-FVCMQDLGSA-N 451.531 0.964 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2c(O)cc(O)cc2O)[C@@H]1c1cccnc1 1813073407 PJPKAPSRLSOARS-IVZQSRNASA-N 471.514 0.891 50 20 JCGD COCCOCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1814307153 KPIHUAFTLKSUQV-CJCQAYSXSA-N 462.532 0.852 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1)c1cccc(B(O)O)c1 1817476461 IGIFWLCAGUYZNY-IBGZPJMESA-N 473.302 0.681 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2nn[nH]c2C(F)(F)F)[nH]n1)c1cccc(B(O)O)c1 1817476802 QWZZBCVQUBFXNB-ZDUSSCGKSA-N 477.212 0.846 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)[C@@H]1SC(=N)NC1=O 1819403081 UNZLDZBHPMUKAQ-JJMVLAAESA-N 499.557 0.517 50 20 JCGD O=C(/C=N/O[C@@H]1CCCCO1)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819452328 KBGXDJPDBNVANF-CJLXMBDASA-N 469.307 0.924 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1819516213 NEBTXEHWUKRIAI-YOEHRIQHSA-N 485.549 0.383 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1820141741 KBNOIMZKWZJWNF-IKAAYWLJSA-N 471.543 0.880 50 20 JCGD C[C@H](O)C(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822519005 ZVSQRZCNLHLRGJ-DZGCQCFKSA-N 460.560 0.782 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3c1OCCC3)CC2 1826089731 MQNHTHJEAXLJIB-LBPRGKRZSA-N 461.548 0.721 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827049024 FYCALJCFCGRBPV-LJQANCHMSA-N 450.366 0.034 50 20 JCGD COc1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)CC2)nn1C 1827052197 CSDNKQSLBCCEOD-HXUWFJFHSA-N 454.336 0.656 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060199 BUTPWCIECKGCCP-DHIUTWEWSA-N 495.389 0.070 50 20 JCGD CC(=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1828792051 JMMSKLDUSHYBDV-RUZDIDTESA-N 493.325 0.021 50 20 JCGD O=C(C1CCN(c2ccccc2)CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830719839 LXQZEHKCBLCKRQ-REWPJTCUSA-N 465.978 0.959 50 20 JCGD O=C(CCCN1C(=O)c2ccccc2C1=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724749 BJUHWWVWJVBWGG-WZONZLPQSA-N 493.944 0.119 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830724796 CJTRRAOHVFSYJQ-MRUHUIDDSA-N 475.970 0.512 50 20 JCGD O=C(c1csc(Br)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830727950 LKXJPMCNCWOASU-ABAIWWIYSA-N 468.757 0.575 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737716 IKUSUKCCWYVFAT-KXBFYZLASA-N 473.935 0.743 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1830836579 ZBGQVBLMWUBPPL-UGKGYDQZSA-N 481.908 0.592 50 20 JCGD Cc1nn[nH]c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549437 ONSOWGJQCWUXFU-XOBRGWDASA-N 486.957 0.315 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCOC3)C2)C1 1832551176 GSMJOSZVORTZPZ-VWKPWSFCSA-N 475.970 0.611 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cnc(O)nc3O)CC2)CC1 1835070403 MRFVAOLQNSKWAK-UHFFFAOYSA-N 451.600 0.925 50 20 JCGD CC(C)(C)c1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1835269564 LBVKPANRYHPYKI-UHFFFAOYSA-N 493.417 0.953 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)Cc3ccccc3)CC2)CC1 1835738232 NPMFUQULCADQSH-HSZRJFAPSA-N 494.596 0.474 50 20 JCGD Cn1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ccc1C(F)(F)F 1835928321 KPAPUEKQUQVHMZ-NRFANRHFSA-N 495.263 0.108 50 20 JCGD Cc1cccc(C)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939538 RSAYBSBNLGEAOL-XMMPIXPASA-N 452.316 0.367 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccccc3C3CC3)C2)C1 1835941474 LDZRAAZHCJHLQF-RUZDIDTESA-N 464.327 0.628 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)CNc3ccc(F)cc3)C2)C1 1837457991 ZWHMQJKDGZXCMJ-QHCPKHFHSA-N 486.504 0.006 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4C=CS[C@@H]43)CC2)CC1 1837920074 IZUOPVUFKCDRLM-NJYVYQBISA-N 456.373 0.854 50 20 JCGD O=C(c1ncccc1C(F)(F)F)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838141075 GPABAUCNXKVFEG-SUMWQHHRSA-N 451.829 0.770 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)C(C)C)C2)C1 1838528269 NMXHRAUTRWCOQD-QHCPKHFHSA-N 492.529 0.930 50 20 JCGD COc1cccc(OC)c1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838882004 GILORDFYRKEAGJ-DEOSSOPVSA-N 499.524 0.086 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1839143707 GFLROBRBMXNGPY-DOWNOZBLSA-N 489.997 0.831 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)[S@@](=O)c1ccccc1 1839674180 ODDKUSWCNAIHPV-AZVZEQOLSA-N 494.614 0.012 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCSCC3)C2)C1 1839961582 BODMKXVAHXFDFF-YJBOKZPZSA-N 464.426 0.665 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1 1839965209 QQLVYGQKAPNDMK-HRAATJIYSA-N 499.406 0.917 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)C(F)(F)F)C2)C1 1839966366 CDQPJFGDYUKTBM-IAQYHMDHSA-N 474.274 0.295 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(=O)OC)cc3[N+](=O)[O-])C2)C1 1840155132 QIANXLUEOXLHSN-IERDGZPVSA-N 499.904 0.705 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4[nH]nc(C(F)(F)F)c4C3)C2)C1 1840155490 DFIUAJWEEXXDQW-UHYGZKCKSA-N 494.898 0.854 50 20 JCGD COc1ccc(F)cc1CC(=O)N1CCOC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184719 CCVKFYDXRHLBJT-HSZRJFAPSA-N 480.537 0.206 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(F)cccc3F)C2)C1 1840184946 COOKKKUZSVDJES-NRFANRHFSA-N 454.474 0.408 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1cccs1 1840378210 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O=C(Cn1[nH]cc2c(=O)ncnc1-2)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 730521575 ZJYRXFSTNSXBNG-UHFFFAOYSA-N 470.453 0.234 50 20 JCGD COc1cc(C(=O)NNC(=O)NCCN2CCN(S(C)(=O)=O)CC2)ccc1OC(C)C 749352156 GRZYYHXRQZVMMG-UHFFFAOYSA-N 457.553 0.004 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](NS(=O)(=O)c2ccc(Cl)cc2)[C@@H](C)O)cc1 772932099 KUHZBTFXHUSEPD-ACJLOTCBSA-N 483.930 0.681 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)ccc1OC 912919620 QQMLQBMJMTXPLZ-HOTGVXAUSA-N 470.592 0.986 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CCN1C[C@@H](C)O[C@H](C)C1 912920158 WOMSDMWQQFYPRD-NUJGCVRESA-N 472.633 0.733 50 20 JCGD COc1cccc(/C=C(/C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)n2nnnc2C)c1 915164997 VPRYLFMTTUKQJV-WQRHYEAKSA-N 456.484 0.853 50 20 JCGD CCNC(=O)NNC(=O)C1CCN(c2ccc(S(=O)(=O)N3CCOCC3)cc2[N+](=O)[O-])CC1 920858733 PYEQEJSXLMWEHW-UHFFFAOYSA-N 484.535 0.182 50 20 JCGD CC1(C)NC(=O)N(CCC(=O)NN/C=C2\C(=O)N(c3ccccn3)C(=O)c3ccccc32)C1=O 920977511 BFHWJISLEJVZEL-SSZFMOIBSA-N 462.466 0.951 50 20 JCGD CCn1c(CCC(=O)N2CC[C@@H](B(O)O)C2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 1261844397 MSEIBINRQCZFQO-OAHLLOKOSA-N 464.353 0.085 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ccc4scnc4c3)C2)C1 1778641869 VZHJPPBZQNLUPC-JOCHJYFZSA-N 451.313 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1 1778664196 UGMXHKMXNNSXDH-JOCHJYFZSA-N 483.916 0.972 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cn3ncccc3n2)C1 1778665346 ZZIGOACWWHZCSQ-WZONZLPQSA-N 478.513 0.169 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCC(F)(F)CC1)CCO2 1779028277 BKMSFJFOHNPLEM-HXUWFJFHSA-N 451.474 0.954 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(Cl)cc3nn[nH]c13)CCO2 1779032131 BOMPPKYOENFVHP-NRFANRHFSA-N 484.904 0.367 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779032439 JXMKOUAZKVXKBW-QHCPKHFHSA-N 453.499 0.841 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(F)cnc3Cl)C2)C1 1779451708 OMFDAROECUASLD-HXUWFJFHSA-N 462.869 0.630 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@]1(C)CCCN1)CCO2)NC(=O)NCc1ccccc1 1780968302 IFKBJMBDUWOJOV-DNQXCXABSA-N 472.590 0.305 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)[C@@H](O)C1 1781115829 WWEVXNAPLFUDGL-HOIFWPIMSA-N 485.654 0.896 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1781504223 KLJQFALZVJKPCD-WSCWJOSJSA-N 474.606 0.791 50 20 JCGD N#Cc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(Cl)c1 1781971287 UBWGNZMRKKVRTF-QFIPXVFZSA-N 468.901 0.967 50 20 JCGD CC(C)(C)OC(=O)N1CCc2nc[nH]c2[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1782849517 HOVOTTDEHPAXMQ-JIGPKXGUSA-N 497.980 0.674 50 20 JCGD CN(C)C(=O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783022576 KEUFHXBFOLLBJS-UZLBHIALSA-N 452.349 0.911 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)CCO2 1783933637 STURCTBXBFROLW-NLFFAJNJSA-N 485.585 0.238 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnn(Cc3ccccc3)c1)CCO2 1783934226 ALGLCIYAZFKLMR-XMMPIXPASA-N 468.558 0.748 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1scnc1C(F)(F)F)CCO2 1783936185 HZAWDGWOBHZARB-KRWDZBQOSA-N 463.482 0.978 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)C(Cl)Cl)C3)C2)[C@@H](O)C1 1783946723 GCYLBCCDSYSMSH-WTOJCKNJSA-N 466.362 0.848 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C[C@@H]21 1785079634 STPIVXZKVMJVAL-PSKKIHNDSA-N 471.982 0.991 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1 1786407255 LKAOHWTVSOHDAO-JKQORVJESA-N 467.364 0.965 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc4c(O)cccc34)[C@H]2C1 1790497317 LYZZWENUHJEHIJ-JBYOLUDKSA-N 490.520 0.846 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CNC(=N)N)C[C@@H]21 1790696344 UPCSFOSDKCDAJU-DCHBYBGLSA-N 489.374 0.819 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=Cc4ccccc4NC(=O)C3)C[C@@H]21 1791290627 DKJNYVASCSXSMB-CUWPLCDZSA-N 483.569 0.765 50 20 JCGD O=C(CN1C(=O)CSC1=S)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Br)C[C@@H]21 1792239760 KHSIZHDYKDHBLO-YVNDNENWSA-N 468.370 0.517 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(F)cc2)CC1 1793789793 GAZPBOGKWKMTSS-YVWYUNDQSA-N 467.501 0.759 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(=O)oc1)C2 1793881142 ROTNUUDTCKEKFE-IVSAIRAKSA-N 469.922 0.975 50 20 JCGD CCC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1794249441 BFASEDLRWCKRSQ-XGUBFFRZSA-N 464.954 0.479 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H]1OCCc3ccccc31)C2)c1ccc(B(O)O)cc1 1795733000 VPMRXGGBUIQRRR-SZGVKKGVSA-N 464.327 0.274 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccoc1C(F)(F)F 1796551298 VJLAKIACXKCGCE-YWVIFJGQSA-N 452.194 0.495 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)C1 1797120420 JBTJONRDPKIOIC-QKGCVVFFSA-N 480.389 0.998 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2c(nc1=O)SCC2 1799072050 IZUIEVQMWMXAAU-OEYIWLLWSA-N 485.404 0.512 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(F)c1Cl 1799575256 VLLSWCSQBJPQBI-KSPBDQMDSA-N 461.881 0.995 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(-c2ccc(O)nn2)cc1 1799839982 FKGJKFHXNFMEIA-BBIADKPPSA-N 488.309 0.046 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C 1800168226 DYUHGWOBIUCGMB-YVSFHVDLSA-N 469.583 0.273 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1 1804948693 DKSGHGFDXUAABT-KKSFZXQISA-N 456.503 0.173 50 20 JCGD O=C(CN1CCCCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1806883421 MARAAQTURIBHTG-NFBKMPQASA-N 450.348 0.567 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359531 JJQDGPRMFAVFMP-DENIHFKCSA-N 468.388 0.130 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1C 1807360195 OYQDTYGKYZBCQS-AUSIDOKSSA-N 461.331 0.366 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375930 QWHDVTCFLVLDST-WIYYLYMNSA-N 470.298 0.438 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)N1CCN(C)CC1 1807878280 OSPXCKWAHOYRCY-XQFWAAQXSA-N 473.622 0.096 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc2n(n1)CCCO2 1809858384 WHOVXIVQQBPPCV-AVRDEDQJSA-N 475.314 0.374 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)CC2)C1 1809978864 WHTCFFOTHLFVMZ-DEOSSOPVSA-N 477.326 0.946 50 20 JCGD Cn1nc2c(c1C(=O)N1CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]1c1cccnc1)CCC2 1810306077 SIFUJPZYDJZCHG-KKSFZXQISA-N 488.552 0.936 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)n1 1813069868 DJSASMRNAPHMID-AVRDEDQJSA-N 471.562 0.617 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3cccnc23)[nH]n1)c1cccc(B(O)O)c1 1817476194 JUTUKJZHEZSENA-SFHVURJKSA-N 459.275 0.752 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)N2CCOCC2)[nH]n1 1818113002 ZBHTZCGEZZEVIG-ZNUZEINGSA-N 486.533 0.186 50 20 JCGD CSCC[C@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1822433555 IIUQCPIPKHDCDU-CVEARBPZSA-N 461.548 0.828 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3ncccn13)CC2 1826086288 PWPNOSUNXXGEBD-LBPRGKRZSA-N 456.532 0.785 50 20 JCGD O=C(C1CC(O)C1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828541047 NGMKWMHTGFIMNO-DBGYWNFCSA-N 479.961 0.809 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)cc1F)CCO2 1830085425 OVWHMMNKQUWACR-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1N(C)C 1830733264 GOBAUXNGMOWISB-UWJYYQICSA-N 455.939 0.431 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1C 1832397901 SNQIWKGDNFGTKR-VWLOTQADSA-N 466.343 0.296 50 20 JCGD CC(=O)c1cc(C(=O)NC2CCN(C3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CC3)CC2)n[nH]1 1834067636 XZCFKZYEQWMXDO-JFLMPSFJSA-N 496.572 0.932 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(N2CCC(NC(=O)C(=O)N(C)C)CC2)CC1 1834634084 KFJKNYMIOCNTNL-UHFFFAOYSA-N 489.529 0.794 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)c3ccco3)CC2)CC1 1834869656 ZEGZRLRAFFCOTE-QGZVFWFLSA-N 454.955 0.835 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@H]3C[C@@H](O)C3)CC2)CC1 1835443787 MSOXPCPIHOWZOL-MBKNUJNYSA-N 458.563 0.463 50 20 JCGD CC(C)N1CCC(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1835737146 OUOYERFRZNXHGW-UHFFFAOYSA-N 499.660 0.991 50 20 JCGD COc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1OC 1836208506 OAFIIUCBTGNHKJ-UHFFFAOYSA-N 496.373 0.278 50 20 JCGD C=CCO[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836868394 SEHPPNISNJMBSI-INIZCTEOSA-N 459.547 0.888 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1837178280 NBCGXCSNZPSXGA-UHFFFAOYSA-N 468.363 0.492 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1F 1837455940 GTDHXKQJMNCIJQ-RUZDIDTESA-N 499.543 0.835 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nn1C 1837919258 VCRGZANOOSPVCE-UHFFFAOYSA-N 468.363 0.588 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920061 IKDORPDEIYMRMD-LJQANCHMSA-N 473.423 0.957 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1839150533 OSXRZFDVXQLUEA-UXHICEINSA-N 473.357 0.504 50 20 JCGD O=C(c1[nH]nc2ncccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198757 ARZBDMDRSSOQAX-GUYCJALGSA-N 456.272 0.718 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839718700 JNUVKKKIMJURBC-KRWDZBQOSA-N 463.274 0.017 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C=CCN3)C2)C1 1839744094 OHYYVJVWNLZONZ-CPURCWLMSA-N 458.465 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1 1839926564 ZOJHOFIMBLGISK-AVAOGFIGSA-N 460.531 0.235 50 20 JCGD O=C([C@@H](O)Cc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839960738 LEHTUFOLLVDYGE-BXWFABGCSA-N 459.312 0.737 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840116014 RHSBLHAEOXMXSF-GSHUGGBRSA-N 492.013 0.839 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ccccc4n3)C2)C1 1840184526 SASWHJGMQSWVBV-QHCPKHFHSA-N 470.530 0.073 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1840241534 KAWBUZGPIYKZKL-QHCPKHFHSA-N 464.538 0.506 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840714187 OJXLFLOGFJGRRH-BVZFJXPGSA-N 477.326 0.377 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)C1 1840959553 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Cc1ccc(C)c(S(=O)(=O)Oc2ccc(C(=O)NNC(=O)[C@@H](C)NS(C)(=O)=O)cc2)c1 729277242 WVAKCBJTKIYQAO-CQSZACIVSA-N 469.541 0.770 50 20 JCGD NS(=O)(=O)N1CCC(C(=O)NNC(=O)[C@@H]2Cc3ccccc3CN2Cc2ccccc2)CC1 747778947 NXGGOBJUSAETNS-NRFANRHFSA-N 471.583 0.676 50 20 JCGD O=C(COC(=O)Cc1csc(N2CCCC2=O)n1)NNC(=O)[C@@H]1COc2ccccc2O1 749985104 LFMJNESSSOECNO-HNNXBMFYSA-N 460.468 0.343 50 20 JCGD COc1ccc(OC)c(CN2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)c1 807134793 GIAKGWYOQGJLCX-UHFFFAOYSA-N 466.502 0.852 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)c1 825777068 QNWCCKUNDRMXBX-UHFFFAOYSA-N 471.333 0.996 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1cccnc1)c(=O)n2Cc1ccccc1 916333371 KONXIWQNIRIEPN-UHFFFAOYSA-N 461.482 0.600 50 20 JCGD Cc1c(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)sc2nc3n(c(=O)c12)CCCCC3 919883816 FQPWXZXELJFIPR-NSHDSACASA-N 453.546 0.624 50 20 JCGD C[C@H]1CCCN(C[C@H](C)NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)C1 919914472 HGWYZUUZCPCOFU-IRXDYDNUSA-N 453.613 0.764 50 20 JCGD 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453.503 0.024 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2)N1C[C@@H]2C[C@H]2C1 1779251845 RYEIAZIQEOCVKF-CDKUKRTFSA-N 470.574 0.153 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cc(Cl)cn1)C2 1779373499 WSYGTYRZNFGLGM-DYESRHJHSA-N 475.937 0.363 50 20 JCGD COc1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)ccc1O 1780443222 GXVLHFZFSWBGRO-ZJSXRUAMSA-N 468.315 0.522 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)CCO2 1781224019 RVVOIVRWEZUJKN-PJSUUKDQSA-N 460.959 0.602 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc(N4CCOCC4)c3)C2)C1 1781735678 RVKSXTFETOZVKV-RUZDIDTESA-N 494.552 0.279 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)nc3sccn13)C2 1782212137 JNFKBBSDLVAKKX-OPAMFIHVSA-N 490.586 0.257 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3cccnn3n1)C2 1782212145 JYIFSSPXLGXIKI-XMSQKQJNSA-N 457.535 0.230 50 20 JCGD 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)n3ccnc3C)[C@H]2C1 1791703541 KGKJXRZYVSXYAM-YLDOMNEYSA-N 469.546 0.866 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(F)(F)C(F)(F)C(=O)O 1793728341 FUSLMJYJAFJNDY-DOLQZWNJSA-N 463.222 0.962 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1 1795732438 FYJXHLSAUGKJME-NHKMSHSESA-N 480.326 0.241 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795740203 DRVWVYIIZRWERU-CCWDJLKJSA-N 473.722 0.331 50 20 JCGD CC(C)(C)OC(=O)NCCOCCOCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796365185 VSWMVWGQOOFZQU-FSDCSDTHSA-N 481.949 0.668 50 20 JCGD C[C@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)NC(=O)OC(C)(C)C 1796831741 AICQPEVFVGNQAH-DQEVTTJGSA-N 459.352 0.922 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](N)c1cccc(Cl)c1)C2 1797750760 SDDCJOQFBQNWIN-FTUNRGFVSA-N 472.933 0.242 50 20 JCGD 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CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1 1809986203 ZDEUIQZUWPHYDZ-VGOFRKELSA-N 453.547 0.917 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCc2ncc[nH]2)[C@H]1c1cccnc1 1810304636 FNBSZKKMOXUXJC-IERDGZPVSA-N 462.514 0.756 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2c(O)cc(O)cc2O)[C@H]1c1cccnc1 1811432625 BNDXBDNWIVEMIN-OYHNWAKOSA-N 471.514 0.891 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1812863461 HOEYAOFJXLDQAV-QANKJYHBSA-N 460.137 0.864 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813415494 FFRKWTXMGGLSCA-HYBUGGRVSA-N 475.358 0.674 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2)c1n[nH]c2c1CS(=O)(=O)C2 1815851275 PBLACAQZDMZTIF-HQJQHLMTSA-N 459.937 0.120 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1CCC(=O)NC1)CC2 1817275936 HPCBVGOXNBTUNW-RQPXNKNVSA-N 471.543 0.715 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnc2[nH]ncc2c1 1818996676 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Cc1noc(C)c1CC(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833728615 ZOEPDTISJAXWDU-UHFFFAOYSA-N 468.363 0.399 50 20 JCGD O=C1Nc2c(C(=O)NC3CCN(C4CCN(C(=O)[C@H](O)CCl)CC4)CC3)cccc2C1=O 1835621038 MJQIEVSCENLKPR-QGZVFWFLSA-N 462.934 0.606 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1835642007 DDWRLSNQIZNBCU-YJYMSZOUSA-N 483.393 0.489 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4ccoc4s3)C2)C1 1835935733 ONVQCXJNYZWEML-JOCHJYFZSA-N 470.312 0.558 50 20 JCGD O=C(CCc1c[nH]c2ccccc12)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836104925 ADEAQSQUUDQZJK-SANMLTNESA-N 491.353 0.551 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1836474990 IVWRIWJMSYBJNC-WMLDXEAASA-N 461.382 0.254 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1 1836967131 ONTSQXIIVMBMLH-AUUYWEPGSA-N 471.352 0.767 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cn(C)c3ncccc13)CCO2 1837190733 DOURRDKGBMMFBE-QHCPKHFHSA-N 472.546 0.016 50 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COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])CCO2)C1 1840887804 DHRVQACSDFCKTH-OXQOHEQNSA-N 473.885 0.987 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)Cc1cncnc1)C2)NC(=O)NCc1ccccc1 1845038579 VKOQCZADOIZEEV-UHFFFAOYSA-N 451.531 0.569 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@H]2C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1846116797 PRDCAKVFGHHIKB-SFHVURJKSA-N 469.347 0.440 50 20 JCGD CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)c1ccc3c(c1)OCCO3)n2C 17822371 QWSFJMXWMGOSGV-UHFFFAOYSA-N 487.538 0.989 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)Cc2ccc(Cl)cc2)c1 24396469 UUOYZTVXJJDLKY-UHFFFAOYSA-N 454.936 0.922 50 20 JCGD CCCCS(=O)(=O)N1CCC(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)CC1 728729121 ISLASMWGIZLKRM-UHFFFAOYSA-N 460.578 0.527 50 20 JCGD O=C(Cc1cccnc1)NNC(=O)CC1(CC(=O)NNC(=O)Cc2cccnc2)CCCC1 729830700 FXGMPYXRFDZSLC-UHFFFAOYSA-N 452.515 0.897 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)CCN2C[C@H](C)O[C@@H](C)C2)cc1 912918687 BMVZVZVQCYIQPR-GJZGRUSLSA-N 454.549 0.204 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc(S(C)(=O)=O)cc3)nc2)CC1 916567781 NGCFVVLUZJDPOK-UHFFFAOYSA-N 482.588 0.248 50 20 JCGD Cn1ncc2c1CCC[C@@H]2NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916604494 INBIXSKGOHVLOL-IBGZPJMESA-N 490.586 0.782 50 20 JCGD NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)c1 916623910 CVPICGWXRNZOIG-UHFFFAOYSA-N 495.583 0.653 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCc2ccc(N3CCC[C@H](C(N)=O)C3)cc2)c2ccccc2c1=O 918119327 ZTQXBISLZHFQEQ-INIZCTEOSA-N 477.525 0.779 50 20 JCGD C[C@H]1CCCN(S(=O)(=O)c2cc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)ccc2Cl)C1 919886833 WLXSLPZQADTNHD-GXTWGEPZSA-N 493.007 0.892 50 20 JCGD Cc1ccc2cc(C(=O)N3CC[C@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)ccc2n1 1777906051 ABVCIXGTFWNFKW-RUZDIDTESA-N 459.311 0.980 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)(C1)C2 1778094994 PSFTZOATZHOFAZ-GSGVZUQMSA-N 499.568 0.978 50 20 JCGD CC(=O)O[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2)C(C)C 1779208363 QPYMSAGLJDQHEK-SELNLUPBSA-N 475.546 0.400 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4ncsc4[nH]3)C2)C1 1779339900 XYWFWRGBGKNUGB-HXUWFJFHSA-N 455.500 0.380 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1COc3ccccc3O1)C2 1779371303 MYDDGKATDGWSPU-DNRQZRRGSA-N 495.536 0.653 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)NC(=O)c2cnccn2)C1 1779474153 WVGUPPASQFXCKT-GYQJYAJYSA-N 467.954 0.363 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1 1780355863 RNFYIIZIHVEBEN-NMWDDECMSA-N 470.534 0.611 50 20 JCGD COC(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1781188680 SWWKPDJBKXVWKW-PDSXEYIOSA-N 491.969 0.263 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781231794 FJUGWURUFDULJS-WOJBJXKFSA-N 485.405 0.749 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)[C@@H]1SC(=N)NC1=O)C2 1782172413 AZJIURDVCIVNSL-IFICMAFDSA-N 460.984 0.557 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)n3ccnn3)C2)C1 1782759786 KLCOQTGNSBWQSI-SPLOXXLWSA-N 472.458 0.816 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)CCO2 1783870703 GFUIDSHVDZZUBJ-AVYPCKFXSA-N 463.959 0.346 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnco3)[C@H]2C1)NC(=O)NCc1ccccc1 1784750858 AWRUULTUSKVTBF-FHWLQOOXSA-N 470.530 0.614 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3COc4ccccc4O3)[C@H]2C1 1785043525 LJVKIDAGKVCFDT-FVCZOJIISA-N 460.531 0.179 50 20 JCGD COc1cccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1786527006 VZYCGCMLVYXEIV-NYVOZVTQSA-N 452.316 0.211 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4c(c3)OCO4)[C@H]2C1 1786596621 PQCRGCDTRPFFQD-XERREHJYSA-N 481.509 0.250 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979684 KRXUEXMOVGTQIQ-MHADKKCISA-N 477.326 0.477 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3cc4n(n3)CCCNC4=O)CCC2)cc1)c1cccc(B(O)O)c1 1788145626 JKMGJEMKUPLRSX-UHFFFAOYSA-N 487.325 0.758 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nc3F)C[C@@H]21 1788611507 HCBBNZKZXWVMAO-UVBJJODRSA-N 476.896 0.780 50 20 JCGD COc1c(Cl)ccnc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1789340887 PXVFYTGOOAMLIL-NUTKFTJISA-N 488.932 0.649 50 20 JCGD CN1CCN(C2(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)CO[Si](C)(C)C)C[C@@H]43)CC2)CC1 1789807849 SGPWTHBFQATTSP-FHWLQOOXSA-N 452.672 0.598 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4ccc(F)cn34)[C@H]2C1 1790474610 UEHMTUOUHNALLL-ZVZYQTTQSA-N 460.510 0.440 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccnc2c(O)cccc12 1790496704 FWAHSUZZRRJXCZ-BUKVSMQUSA-N 475.310 0.527 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)NS(=O)(=O)CC)C[C@@H]21 1790958225 MTPPSVGHIHKMAF-FQKPHLNHSA-N 468.414 0.467 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)nc1F 1792373604 DIPXJGCYSREXPC-ISHQNBSSSA-N 460.441 0.697 50 20 JCGD C[S@](=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1792795037 GWBUWGKIGOHNQM-LMOVZMPUSA-N 483.990 0.772 50 20 JCGD COc1ccc([C@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1792826476 BOMFKSLMQBHSBQ-XCRNZQRYSA-N 452.316 0.382 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cccnc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792975125 KEAAFZUVAMYCQO-APAFKAMOSA-N 496.992 0.707 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796891683 FWVMZVFNQZBRSQ-JRIUASGASA-N 475.502 0.253 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncncc2c1 1797469180 ZKVXSRYTGNDLPU-CWPLJXCYSA-N 461.482 0.145 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc(O)nc(O)c3C1)C2)[C@@H](F)Br 1799344537 NMCBJSXJFXQDJN-MLNQONBDSA-N 473.299 0.273 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(F)c(OC)c1F 1799739070 ZUPKEONMFMUTIT-VTEUUUEMSA-N 490.268 0.179 50 20 JCGD CC(C)(C)OC(=O)N1CCc2nc[nH]c2[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1800322536 CPLNOVVRESLQSL-XIZOUUALSA-N 497.980 0.433 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(-n3c(O)nnc3O)cc2)[C@@H]1c1cccnc1)[C@H](O)CCl 1803140810 IKGUKQYQNGVQET-CGTJXYLNSA-N 486.916 0.993 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1803791236 LQNDOQKLARFRNG-UGKGYDQZSA-N 461.331 0.745 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)CNC(=O)c3cccnc3)C2)CC1 1806872610 PAFCIKUCOQDTJV-UHFFFAOYSA-N 458.563 0.416 50 20 JCGD O=C(CC1CCOCC1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1806933209 KHUJIMOMLSESRX-OFNKIYASSA-N 451.332 0.898 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CC[C@@H]2CCOC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363753 BKVOOZNTKFZBMT-DHJUGAMNSA-N 451.332 0.898 50 20 JCGD COc1nccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1807366452 ZEFQHAPFBKRIOB-LAUBAEHRSA-N 478.289 0.938 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375841 VRQBXUNAIGCEKS-BSIFCXSSSA-N 496.373 0.994 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)N1C[C@@H]2C[C@H]2C1 1810156446 HHCMHFWFLOVZRI-WCJMXFJFSA-N 462.359 0.421 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810324895 YUHQNRAMVZJYSY-BPXKWBHBSA-N 474.330 0.372 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@@H]1CCN(C(=O)c3cccc(B(O)O)c3)[C@H]1c1cccnc1)CCC2 1812224870 UJXMLFLAJHYFTQ-AVRDEDQJSA-N 473.342 0.617 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1812863243 FYKBPHIAHQYABI-WHOFXGATSA-N 463.269 0.596 50 20 JCGD O=C(CN1CCCCC1=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1812973427 DRBNUAMQFWJGDM-WMZHIEFXSA-N 464.331 0.094 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CSc2nc[nH]n2)[C@H]1c1cccnc1 1813348317 SUPNMEZMUQIYLD-RDTXWAMCSA-N 481.542 0.310 50 20 JCGD O=C(COc1ccc(O)cc1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815350562 XYSSKNRBURLEGG-OAHLLOKOSA-N 467.312 0.833 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3c(c1)CCNCC3)CC2)c1cccc(B(O)O)c1 1815360671 WPJPYCJJMYHJRS-SFHVURJKSA-N 491.382 0.446 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCS(C)(=O)=O)[nH]n1 1818114218 NNUAMQMEARBFAV-DXRSZSRVSA-N 477.547 0.971 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN2CCCC2=O)[nH]n1 1819402017 IXLVGZHGRYMXNN-INIZCTEOSA-N 454.491 0.337 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2)c1ccc(-n2c(O)nnc2O)cc1 1821418318 OSMAHKPNBSCDSV-GWCFXTLKSA-N 478.918 0.961 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCNC2=N)CC1 1826870486 CLFGHKRTGXKRID-BWJYWGHISA-N 470.578 0.580 50 20 JCGD O=C(NCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccco1 1827053057 UOCGDEGRSBJEGL-HXUWFJFHSA-N 467.331 0.623 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2cnn3cccnc23)CC1 1828540346 HGIIKIUZCLZNCP-NRFANRHFSA-N 461.331 0.956 50 20 JCGD O=C(Cn1cccn1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829017667 NQLUIOJYADNHMY-XXBNENTESA-N 489.960 0.935 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830738688 RPEOWLXVJHZOSU-ZPGKAZOCSA-N 487.981 0.512 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CS(=O)(=O)N2CCCC2)CC1 1831871027 KYEIMCMCIYFWJN-LJQANCHMSA-N 485.651 0.405 50 20 JCGD Cc1nn(C)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)c1F 1833702285 PQXDDTLBAZJHHH-KZULUSFZSA-N 461.332 0.969 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797866 FSZOGDFNVRAUJT-SFHVURJKSA-N 479.390 0.447 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cccnc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797965 QGWKJSSWCICGMQ-UHFFFAOYSA-N 450.348 0.189 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1834821423 JCRJXQGORNRDIH-SFHVURJKSA-N 452.309 0.584 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CNc3ccccc3C)CCO2)C1 1835861723 GCVPLASGCKVAHH-DYMLFOFBSA-N 496.568 0.997 50 20 JCGD CN[C@H](CC(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1)C(=O)O 1836398177 BROIJASGZXMZPW-BEFAXECRSA-N 451.395 0.857 50 20 JCGD CC(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1836533367 RUWRVJYIWLIMMC-HIFQEXITSA-N 473.578 0.217 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1cnccn1)CCO2 1837610650 WSKNZCBAMBRLPL-AUSJPIAWSA-N 498.378 0.225 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838107095 RJWNXXDAURWEQX-OAHLLOKOSA-N 474.562 0.164 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839668008 UVHOSBWLQOXLNP-ZUEVXXBESA-N 487.326 0.347 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=S)NC)C2)C1 1839965501 ZWVHKQURZUYYCQ-CXAGYDPISA-N 465.414 0.100 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840182423 JCFFYSLDLLZKJJ-HOYKHHGWSA-N 476.574 0.628 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc2c1OCCO2 1840183796 AXHYPSBDCMVBIL-DEOSSOPVSA-N 490.557 0.209 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(O)cn3)CCO2)C1 1840494594 JCZSCJKJFRCUGF-LIRRHRJNSA-N 456.337 0.817 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)OC(C)(C)C)CCO2)C1 1840802957 MWJYJXJXGJANFX-FOIQADDNSA-N 463.959 0.611 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)[C@H](O)C1 1841351077 FMXWMKZWORXXMR-SXGZJXTBSA-N 459.971 0.798 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038278 LQPWCNIUWGAGGQ-UHFFFAOYSA-N 472.590 0.698 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)Cn2ccncc2=O)C1 1845767555 AZEBYDFHOMRNEL-UHFFFAOYSA-N 455.427 0.594 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1cccc(S(=O)(=O)NCc2ccc3c(c2)OCO3)c1 10214409 OHCFRDXTNKGLOQ-OAHLLOKOSA-N 495.535 0.090 50 20 JCGD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12 729281500 DPDRPRWTPGRIPY-QGZVFWFLSA-N 461.486 0.466 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)[C@@H](C)N1CCOCC1 729623454 JMLXBFTZEJYNPU-HZPDHXFCSA-N 453.565 0.524 50 20 JCGD CC1CCC(N2C[C@H](C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)CC2=O)CC1 731322659 MHQHJFHEDXYTER-CUYAVPTFSA-N 492.598 0.896 50 20 JCGD CSC[C@H](C(=O)NNC(=O)CNC(=O)c1cccs1)N1C(=O)[C@H]2CCCC[C@@H]2C1=O 751211813 VLRZMLHDGACFAI-RWMBFGLXSA-N 452.558 0.532 50 20 JCGD Cc1nnnn1/C(=C\c1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 818374966 GIMDBUBAGATGPT-NXIIHZOPSA-N 482.428 0.649 50 20 JCGD O=C(COC(=O)[C@H]1CC(=O)N(c2ccc3c(c2)OCCO3)C1)NNC(=O)c1ccc([N+](=O)[O-])cc1 848978773 SZHPGDDUWAYSQV-AWEZNQCLSA-N 484.421 0.723 50 20 JCGD CSCC[C@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)N1CC[C@@H](B(O)O)C1 864233943 LEWPWUMQUUELML-WBMJQRKESA-N 491.828 0.517 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)cc2)C[C@@H](C)O1 912920151 WHLVAYQARFXGOC-BETUJISGSA-N 477.381 0.374 50 20 JCGD CCOc1ccc(NC(=S)NNC(=O)C2=NN([C@@H]3CCS(=O)(=O)C3)C(=O)CC2)cc1 913444007 SMLJIACGOUSGOX-CYBMUJFWSA-N 453.546 0.568 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCC3)C2=O)c2ccccc2c1=O 915906089 HWYQJRIWWIUDPG-UHFFFAOYSA-N 455.475 0.132 50 20 JCGD O=C(NCCNS(=O)(=O)c1ccccc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 916295202 MQODDCYVVCFKDQ-UHFFFAOYSA-N 495.583 0.394 50 20 JCGD N#Cc1cccnc1NCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916641366 ZIESFHJIAVRNIR-UHFFFAOYSA-N 473.515 0.030 50 20 JCGD COc1cc(OC)cc(C(=O)NNS(=O)(=O)c2ccc(OC)c([C@@]3(C)NC(=O)NC3=O)c2)c1 917722848 JOBGIXGUGNEUGG-HXUWFJFHSA-N 478.483 0.390 50 20 JCGD CNS(=O)(=O)c1ccc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 919779009 MOAGHDDKPKMZMQ-CYBMUJFWSA-N 483.572 0.550 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O)N[C@H]1CCS(=O)(=O)C1 919886947 YAXUGJGGLORLRD-INIZCTEOSA-N 470.507 0.656 50 20 JCGD COCC(=O)N1CCN(C(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CC1 920852714 YFHAHNUZWPPQTB-QGOAFFKASA-N 480.525 0.658 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 921305589 REBIWWUJLJCLCZ-UHFFFAOYSA-N 470.548 0.312 50 20 JCGD O=C(C1=NO[C@H](c2ccccc2)C1)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1778174460 ZZZLFFWHKRMFJI-XUZZJYLKSA-N 463.299 0.328 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779028288 BMUCGRKVQMEEEG-FPTDNZKUSA-N 476.534 0.042 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cn1 1779371073 BGUUNJIEWYBHJU-CJFMBICVSA-N 496.568 0.849 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1779403177 DMFKRCSHGWEJRA-JTOWHCCKSA-N 481.315 0.686 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc2ncsc2[nH]1 1779569853 QOZHDPJYKOVUEC-XMSQKQJNSA-N 468.344 0.746 50 20 JCGD COc1ccc2[nH]cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)c2n1 1780031215 BTSZHICDZYSZHM-CJFMBICVSA-N 492.341 0.693 50 20 JCGD CC(=O)c1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n[nH]1 1780969917 NBMZDIHEEGUTQZ-XMMPIXPASA-N 497.556 0.402 50 20 JCGD O=C(c1nc2c(=O)[nH]c3ccccc3n2n1)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781329985 PEADDRQYDWQLIB-YJYMSZOUSA-N 493.293 0.705 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781333224 FFNFSRGNHDOJOQ-DYVFJYSZSA-N 475.340 0.412 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCNC(=O)c1ccccc1)C2 1782214505 SXQRRZATCBBYPD-CJFMBICVSA-N 487.601 0.693 50 20 JCGD CCOC(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)OCC 1782214669 YHAXUDUCTNZAIU-VGOFRKELSA-N 456.584 0.663 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1783550119 AMIVSSAXVPVJKZ-CALQCPNCSA-N 457.955 0.816 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935465 UQZGQFUPTURWSD-QHCPKHFHSA-N 459.547 0.445 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783936545 OVNJXNHXZPSULI-XMMPIXPASA-N 484.557 0.703 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C[C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)C1 1784146786 DHSUEYKKCYVTBG-HOYKHHGWSA-N 495.621 0.836 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCC(=O)N3C(=O)OC(C)(C)C)C2)C1 1784191240 XAZAGRHRBLLXRM-HJPURHCSSA-N 495.577 0.115 50 20 JCGD O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCNC4=O)C[C@@H]21 1786404443 QBOHMZVYWOGBKU-HUBLWGQQSA-N 454.325 0.005 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786983934 WTPSWCGYRZZJBB-NSTZSLEWSA-N 495.291 0.845 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccc3Cl)C[C@@H]21)c1cccc(B(O)O)c1 1786984320 CRDOKNFSRYXIEF-CUWPLCDZSA-N 456.735 0.856 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C[C@@H]21)c1cccc(B(O)O)c1 1786984744 DXWMSQNDGYAJCM-BPXKWBHBSA-N 484.308 0.970 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn4nc(N5CCOCC5)ccc34)C[C@@H]21)[C@H](F)Cl 1787445588 JZCZWNLBQWMQOL-PWDMQXDWSA-N 480.928 0.694 50 20 JCGD C[C@@H](Cc1ccncc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790576994 UKZPETBVSJUCEO-PWZKMPOXSA-N 451.332 0.234 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)Cn3ccncc3=O)cc2)CCC1 1791044174 MYDJZKWJXGFWLL-UHFFFAOYSA-N 461.482 0.690 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)C[C@H]2C1 1792983779 NLVCSCHAWUCJQC-WHDKQWSOSA-N 471.982 0.823 50 20 JCGD CN(C)CC[C@](Cc1ccccc1)(C(=O)O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792984342 XPHQMOPVCZCOMY-YBZAYSDLSA-N 496.004 0.441 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCOC1=O 1793166484 UDSUSIYGEAJJGF-AHHPBITISA-N 460.437 0.914 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NS(=O)(=O)CC 1793318313 OMCJUCJPVIAWSH-RKQHYHRCSA-N 454.387 0.077 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCNC(=O)C1)C2 1793879205 NDNDNCJQGGKVDF-JBXGNFEISA-N 472.970 0.234 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)c1 1794622682 DSOMIJLJNLYVNH-QDMKHBRRSA-N 472.527 0.049 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795111342 DFPAIXSVOISXEO-FVCICTRLSA-N 474.377 0.614 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)no1)C2)c1cccc(B(O)O)c1 1795740189 BSHFMNKFFHAYIN-OPMZPASUSA-N 461.283 0.538 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796192398 HMMDQWCARLOREO-FCGDIQPGSA-N 459.352 0.922 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3sccc3[nH]1)C2 1797751532 CWDBMICZBZYLCT-KSPBDQMDSA-N 454.512 0.745 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(F)(F)F)ccn1 1798195329 WQKUUMUVNDWERQ-IVWMJMPLSA-N 457.453 0.677 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1799365009 JESHPURUAQCDAA-GFQSEFKGSA-N 454.351 0.655 50 20 JCGD COc1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c(F)c1 1805082332 HFIVWMPZFRQLHZ-HTAPYJJXSA-N 478.289 0.938 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC2(CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)C1 1806758997 VEEJKNJEIDGGCW-GJZGRUSLSA-N 499.996 0.948 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)ccn1 1807362418 LVVPZPDWSIDGMG-NFBKMPQASA-N 487.325 0.748 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807374167 DYUUNOWQVILIIV-YYWHXJBOSA-N 479.371 0.108 50 20 JCGD CCOc1cnc(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cn1 1809969659 ZMYQQMXUMHBFDN-UHFFFAOYSA-N 452.320 0.714 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@H]1c1cccnc1 1813074347 PONCRWAUPSDQBX-KKSFZXQISA-N 482.520 0.956 50 20 JCGD CN(C)CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2 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0.321 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(C)nc4ncccn34)C[C@@H]21 1787509083 RPGUWERDTDGJOJ-OFZLNCEDSA-N 492.540 0.765 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1791103199 POIIANLAPUKXRC-QMHWVQJVSA-N 491.969 0.022 50 20 JCGD COc1cc(F)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791292952 CMZKYDPPQFAXAR-FNHZYXHNSA-N 450.511 0.801 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(N4CCOCC4)c3)C[C@@H]21 1791293720 DRGQVORWTYNWPH-BVSLBCMMSA-N 487.601 0.490 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791810039 XZANFVLJODPCRX-KNTRFNDTSA-N 458.563 0.151 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@](C)(Cl)CCl)C2 1792780681 OGHYEFCGOXJXNY-ABWRSARUSA-N 486.396 0.992 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799342023 DANICGRGAKDBAP-ITGHMWBKSA-N 482.347 0.542 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COc1cccc(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)n1 1807362971 NJFLNQJIAMTTDT-DVECYGJZSA-N 474.326 0.727 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc(O)nc(O)c1 1807994169 QMURBCKICBSFIX-IIBYNOLFSA-N 462.271 0.201 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1 1809530475 CRDBWPPYDMRPFV-JXFKEZNVSA-N 481.513 0.242 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc3c(c2)CNC3=O)[C@@H]1c1cccnc1 1810037270 BKORPBVDSJUQIB-JTSKRJEESA-N 499.531 0.957 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1 1810306127 UQRTXBWVIBXHSI-YHEJKZAPSA-N 488.552 0.928 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CC2(O)CCC2)[C@H]1c1cccnc1 1810309387 QMZIDXAVSSSYDO-UZLBHIALSA-N 452.515 0.705 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1nc(O)n2c1CCCC2 1810589696 JIUPNQTZSPLCEB-GCJKJVERSA-N 489.341 0.633 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1cccnc1 1811614708 ZNUKNWAYDLOMSX-IFXJQAMLSA-N 478.469 0.950 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CCCS2(=O)=O)[C@@H]1c1cccnc1 1812498270 JGHSMVBBBBIBTF-UWVAXJGDSA-N 465.576 0.038 50 20 JCGD CCOC(=O)C1(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)CC1 1813073967 MRXIXSNRLYOYLO-XLIONFOSSA-N 459.547 0.804 50 20 JCGD N[C@H](CC(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)c1cccnc1 1815355012 ZEENWXFCDPJECK-DLBZAZTESA-N 465.344 0.534 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824516889 MMKRLJOZVCHRFE-SFHVURJKSA-N 477.587 0.825 50 20 JCGD CC(=O)NCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2 1825167528 ASWPXAJYMDTGIT-INIZCTEOSA-N 487.586 0.537 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1Cl)CCO2 1829498010 YJWWBICDSLGLGR-QVGKIPNLSA-N 488.932 0.939 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830354151 SDRNOIOBDXVKQD-VUMVONDWSA-N 496.004 0.887 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1831610043 UHAMIZAMSXCIJP-RADWXHQJSA-N 496.402 0.961 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1 1832551304 IEXMRWCKKTWIOZ-JLHGSKIFSA-N 491.029 0.915 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C3(C)COC3)CC2)CC1 1833139988 UQKSHSLTIREHAX-WGOQTCKBSA-N 458.563 0.729 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)c1 1833308247 MBAQAOBIJKKTCJ-SFHVURJKSA-N 472.995 0.270 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)nc1 1833599092 CNYHRKOGIADKQC-YOEHRIQHSA-N 494.339 0.246 50 20 JCGD COc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)ccc1O 1834800939 BMUOZHBBLSYCAV-UHFFFAOYSA-N 481.358 0.580 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cc(O)n1 1835089438 MXSFRRBXFDWEHT-UHFFFAOYSA-N 460.579 0.654 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccn2ccnc12 1835577230 OQAYZVOKXYJZPM-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835714227 ZWBXJALROPPVKQ-HXUWFJFHSA-N 472.590 0.443 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CSc3ncccn3)CC2)CC1 1835736704 DGBBCQYTNABJQJ-UHFFFAOYSA-N 498.613 0.453 50 20 JCGD O=C(C[C@@H]1OCCc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926986 ATGJMBNDIIMDEI-OZXSUGGESA-N 494.353 0.141 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4cccc(Cl)c43)C2)C1 1835939849 KYRRKCDGNIHVAA-CJFMBICVSA-N 498.772 0.820 50 20 JCGD C[C@@](O)(C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)C(F)(F)F 1837017026 CREQVHQWRYVXJJ-HXUWFJFHSA-N 487.479 0.611 50 20 JCGD C/C(=C\c1ccc(C)o1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1837576971 GVHCXJSSTODLGF-VTUIFRMYSA-N 468.315 0.441 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cscn3)C2)C1 1837711811 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O=C1C[C@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)CN1 1839802453 XJTBXKSSTJPBKT-SVMVAKDDSA-N 494.386 0.585 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@](C)(O)CC(=O)O)C2)C1 1839966722 ODOWUJHYZCJYDM-KKXDTOCCSA-N 465.341 0.232 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840187328 SPRCITFXJIDYFS-HXOBKFHXSA-N 499.609 0.119 50 20 JCGD O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1840188362 FYQWRLNCQYAXGO-RTBURBONSA-N 458.298 0.981 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1840370069 DLOQTGMSYAFIDE-UTKZUKDTSA-N 469.970 0.178 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCS(C)(=O)=O)CCO2)C1 1840551072 JLHUYTHLTOJVGR-CZUORRHYSA-N 455.371 0.051 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1 1840758985 JNZHLTSDDJVAQD-QRWLVFNGSA-N 471.894 0.927 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2ncn(-c3cccc(F)c3)n2)C1 1842169336 LTOWQOBUBUVUKL-UHFFFAOYSA-N 464.461 0.536 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)OC)C(C)C)C2 1846364001 QXOJAUKPLCYRLQ-IKGGRYGDSA-N 486.997 0.815 50 20 JCGD O=C(COc1ccccc1Cc1ccccc1)NNC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 25416315 HWTJFNMSAJMCJM-LJQANCHMSA-N 498.561 0.969 50 20 JCGD Cc1nc2c(C#N)cnn2c(C)c1CCC(=O)NNC(=O)c1csc(N2CCOCC2)n1 106037889 BGNVJADPADLEHD-UHFFFAOYSA-N 454.516 0.905 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1 109039672 KQVQAEURJUGIHO-UHFFFAOYSA-N 469.501 0.675 50 20 JCGD CCS(=O)(=O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2OC)c1 727943493 LKQCRRGDQIMJON-UHFFFAOYSA-N 484.556 0.875 50 20 JCGD C[C@@H]1CCCC[C@]12NC(=O)N(CC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cc1)C2=O 728213201 UTGADKASAZYVCH-ZHRRBRCNSA-N 492.602 0.567 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CN(C)C(=O)c3cccs3)cc2)CC1 728215381 YKOGETVXPZQBMI-UHFFFAOYSA-N 451.574 0.900 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)c1 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NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCN(c3ccccn3)CC1)CCO2 1779032666 QILQLVWMVXACOB-RUZDIDTESA-N 493.568 0.440 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779033692 BMUCGRKVQMEEEG-PEBXRYMYSA-N 476.534 0.042 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1779036235 YTQYNFMJPDKSKW-QFIPXVFZSA-N 488.545 0.186 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)N(C)C)CCO2)C1 1780095139 MNAQKPPCJOSXAZ-OAQYLSRUSA-N 477.474 0.235 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccc(F)cc1 1780909806 OOPQUBKSZBWIKE-GBXCKJPGSA-N 498.515 0.145 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccnn1)CCO2)NC(=O)NCc1ccccc1 1780969335 XMOLPIIWACIFCR-HSZRJFAPSA-N 467.530 0.266 50 20 JCGD CN1CCC(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)CC1 1780969877 PUWXDNGYJGUVMJ-VWLOTQADSA-N 486.617 0.504 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCCOC1)CCO2)NC(=O)NCc1ccccc1 1780969978 QHKKVMLYWTYWRE-RDPSFJRHSA-N 473.574 0.589 50 20 JCGD CC[C@H](CC(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)NC(=O)OC(C)(C)C 1781363522 XJYOKLJURLGDSF-UZUQRXQVSA-N 483.610 0.883 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c(O)cc3O)C2)C1 1781472273 QVOIZNROTDPBJG-NRFANRHFSA-N 460.679 0.188 50 20 JCGD C[C@@H]1CCc2c(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)CCC(=O)NN(C)C)C3)n[nH]c21 1782215116 TXKOVGPBHFRUJM-QDOIMOTRSA-N 460.579 0.960 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCN(C(C)=O)CC3)CCO2)C1 1783349838 SSFOXFIXTBGOEE-QFBILLFUSA-N 459.385 0.154 50 20 JCGD O=C(Cc1c(F)cccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1783814511 NSIMDUPBBMTMEJ-XERREHJYSA-N 474.725 0.995 50 20 JCGD O=C(Cc1c(F)cccc1Cl)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1783814814 YDLYFWXZAQYHMP-XERREHJYSA-N 474.725 0.995 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)CCO2)C1 1783874255 FQVZYEJRSVYLPZ-BTYIYWSLSA-N 450.923 0.574 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1 1783880813 GBRQATRDVMKUOM-FOIQADDNSA-N 465.894 0.376 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C[C@H]1OCCc3ccccc31)CCO2 1783933104 CHUGAXXRGAOZSA-YKSBVNFPSA-N 458.559 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1nnc(-c3ccccc3)o1)CCO2 1783934246 BCIUVXFPCXFRDT-QFIPXVFZSA-N 456.503 0.553 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1(NC(=O)OC(C)(C)C)CC1)CCO2 1783940123 RISVKBQKBIHBEX-NRFANRHFSA-N 467.567 0.247 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)[C@H]2C1 1783992253 BKWXMHXWLPCRFQ-YTFOTSKYSA-N 478.384 0.635 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CN(C(=O)OCc4ccccc4)C3)C[C@@H]21)[C@H](O)CCl 1784094933 VVPYTLMOHDIPLI-FFGOWVMKSA-N 479.961 0.834 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(O)cn3)[C@H]2C1)NC(=O)NCc1ccccc1 1786276078 ZEOUJXWXJBTZKH-VCOUNFBDSA-N 496.568 0.727 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)c2n1 1786981146 VAWOFAAKZNIBKT-QSFXBCCZSA-N 478.314 0.158 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/c3ccc(F)cc3F)C[C@@H]21)c1cccc(B(O)O)c1 1786983261 KHRZFOVDFOBZPK-WWJWVQJMSA-N 470.281 0.951 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)Cc3cscn3)[C@H]2C1 1787395840 BCSHZYNEQSHYFB-PGHKEHOFSA-N 487.586 0.127 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cn1 1788609944 FNWDMMRLSBDUOC-SNRMKQJTSA-N 467.530 0.053 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc([N+](=O)[O-])c2c1OCO2 1789287186 KBKWDZUWYJATDM-LVGORTOPSA-N 455.851 0.517 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSc1ccncc1 1793949582 QRBOMIXNWNESDR-HBCWATKFSA-N 456.528 0.076 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(C(F)(F)F)o1 1794773968 YIHRDFLVFCZDOL-XOIINTDNSA-N 466.221 0.804 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccn1C 1794873868 BPMQHTJIGZORJY-ZSBFGKGUSA-N 457.443 0.771 50 20 JCGD COC(=O)C12CCC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)(CC1)CC2 1795734197 ILLHEHJJHGAFBQ-QJSFUDEASA-N 484.358 0.083 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)[nH]n1)C2)c1ccc(B(O)O)cc1 1795735319 ZGHLOYVRILEVEW-OPMZPASUSA-N 460.299 0.274 50 20 JCGD CC[S@](=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798524594 GVCPLRJXUOJEMI-GFEWAZIUSA-N 481.527 0.882 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C#N)c[nH]1)NC(=O)NCc1ccccc1 1798694257 UNWMRFKDNOVBEB-HATOLVCRSA-N 479.541 0.436 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc2c(O)cccc12 1800097431 QHEAOBFSWXYJHV-USGNIVHTSA-N 455.515 0.517 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)C1 1801052522 RGHMFXZMHXEAHW-ZRKYPZEGSA-N 494.358 0.638 50 20 JCGD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cnn1C 1805925287 CBCBSVQXXIRIQF-OXJNMPFZSA-N 462.514 0.755 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1 1807028298 JGPDUDRKMWMSPY-CORIIIEPSA-N 463.269 0.596 50 20 JCGD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc(O)n1 1807360327 AGFVOXLWIXUPBN-XMSQKQJNSA-N 460.299 0.804 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2COc3ccccc3O2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364645 SZVMOVAEXNSLOC-WDJPJFJCSA-N 487.321 0.921 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@@H]1Cc2ccccc2CN1 1808238666 JMTFGPAMWWGWAO-HVCNVCAESA-N 484.365 0.796 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@@H](N)Cc2cccnc2)[C@H]1c1cccnc1 1808366096 YRPICOHHIJCNLO-YUXAGFNASA-N 488.552 0.365 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2ncnn2C)[C@H]1c1cccnc1 1808414018 DMRFNZABSVWLHD-ISOPGZDOSA-N 463.502 0.664 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cc(O)ncn2)[C@H]1c1cccnc1 1810295744 WZCKGKCNDPUVGJ-KUHUBIRLSA-N 462.470 0.209 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC2(CCCN(C(=O)c3cccn4c(O)nnc34)C2)CC1 1810772313 PVSMYZKJRBBVIQ-UHFFFAOYSA-N 457.535 0.653 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc(-n2ccnc2)ccn1 1811581247 AUZMJTONWJBGLW-YKSBVNFPSA-N 496.336 0.976 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)NC[C@@H]2CCN(C(=O)[C@H](F)Cl)[C@H]2c2cccnc2)N1 1812443365 LAPNOLIGRIDFJY-HITLURFISA-N 497.980 0.802 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cn3ncccc3n2)[C@H]1c1cccnc1 1813070637 LBIOKZHMTBJCAL-JTSKRJEESA-N 464.530 0.817 50 20 JCGD CCOC(=O)c1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)ccn1 1815343636 GIJZDCYOAMTHEF-INIZCTEOSA-N 494.338 0.934 50 20 JCGD COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)nn1C 1815343667 ILOPHVWHLSXEMF-ZDUSSCGKSA-N 455.305 0.105 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(-n3cncn3)c1)CC2)c1cccc(B(O)O)c1 1815360100 MJLMCYAXJUHIKL-KRWDZBQOSA-N 488.338 0.943 50 20 JCGD N[C@@H](CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cccnc1 1817405767 PUWBMTNGQQJZCH-ICSRJNTNSA-N 462.319 0.881 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCc1cnc[nH]1)CC2 1819793925 VDRSOCCSUKKYEW-LLVKDONJSA-N 454.516 0.723 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)c3nn[nH]c3C(F)(F)F)sc2C1)c1cccc(B(O)O)c1 1821642935 JIRIRLGJWQGAMD-SNVBAGLBSA-N 480.237 0.499 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C[C@@](C)(O)CC(=O)O)n[nH]1 1822414850 USQVOZBMLWWLKF-JLTOFOAXSA-N 452.512 0.391 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)[C@H](O)N1CCOCC1 1823007262 LLBTTWHCUUGSPF-YKHWKNEFSA-N 451.318 0.396 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3ncnn3c1)CC2 1826088176 UGONEXYKCTWOPE-CYBMUJFWSA-N 456.532 0.785 50 20 JCGD O=C(c1cnn2c1OCCC2)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060191 BUJBVAODUJXNCF-NRFANRHFSA-N 466.347 0.893 50 20 JCGD O=C(c1cc(O)n[nH]1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551471 PNYAOAMMJCLIEA-VGSWGCGISA-N 491.932 0.781 50 20 JCGD O=C(Cn1nccn1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829232090 LAMSOGQWMHUDFY-XMSQKQJNSA-N 490.948 0.330 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)CC1 1829620887 VPYRHYFGGFDYOQ-FQEVSTJZSA-N 489.341 0.316 50 20 JCGD CC(C)COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccn1 1830727727 CPSXELGPSWDWOJ-LAUBAEHRSA-N 455.939 0.786 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1831164131 IAWQMTZEKVGMEK-MBSDFSHPSA-N 478.615 0.997 50 20 JCGD Cc1nccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)n1 1832549012 ASDWGLUKLLQEHZ-HTAPYJJXSA-N 497.980 0.987 50 20 JCGD Cc1ncncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549702 YJRIATHKVZYGBW-HTAPYJJXSA-N 497.980 0.987 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)CSC2=S)CC1 1832898729 XJLVCMIPFJQUBA-SFHVURJKSA-N 489.428 0.460 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CNC(=O)N(C)C)CC2)CC1 1833261730 WSRMEGUQNYYAGT-CQSZACIVSA-N 460.417 0.860 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)n1 1833310689 YLPILBRFGLBZSG-MRXNPFEDSA-N 469.926 0.783 50 20 JCGD O=C(CCBr)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834421801 MIEQYMWPKVOXPS-UHFFFAOYSA-N 466.185 0.337 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C[C@@H]3CCCCO3)CC2)CC1)c1ccc(B(O)O)cc1 1834797507 QSFAXATUVGMCTI-QFIPXVFZSA-N 457.380 0.511 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4cc(Cl)ccc34)C2)C1 1835930453 IRGDPJNWDZDCOJ-XMMPIXPASA-N 497.744 0.885 50 20 JCGD O=C(c1ccoc1I)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836262000 AYSOHBOQASMHPU-MLGOLLRUSA-N 498.701 0.554 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4ncnn4c3)CCO2)C1 1837164481 IGHBJZGICRNNKY-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1837379778 GVZRDTBSPPMEGH-BVGQSLNGSA-N 453.367 0.387 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc3ncsc3[nH]1)CCO2 1837754201 UBHWZZSUUNITII-FQEVSTJZSA-N 464.548 0.067 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(Cl)cn3)CCO2)C1 1837897834 HLYGUXIJWYERTM-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919089 CSAXWDFXDFLHAD-SFHVURJKSA-N 480.374 0.874 50 20 JCGD CN(CC(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1)C(=O)C(=O)O 1838432142 XTVLQTGKXYPMLG-UHFFFAOYSA-N 457.600 0.380 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CCO2 1839384986 UBCHXGCWSQJOEH-AUSJPIAWSA-N 463.959 0.693 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)Cc1ccccc1)CCO2 1839958520 HJRMGHDCVUXLTG-OPNAWAFISA-N 497.552 0.180 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1840035333 NHILAZGYLUTPLJ-CWTRNNRKSA-N 499.387 0.979 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnc(C(F)(F)F)cn3)C2)C1 1840151979 SWEMHCHIEKOIEQ-PXAZEXFGSA-N 466.844 0.819 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccccn4)[nH]n3)C2)C1 1840153157 GBNMYEHNIRZWJI-BTYIYWSLSA-N 463.922 0.796 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3CNc4ccccc4O3)C2)C1 1840184426 LLSIDJYPATUZPP-UUOWRZLLSA-N 489.573 0.079 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)CC1 1840806240 NXPSRQBAIIFEDJ-DYESRHJHSA-N 492.976 0.530 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CCN2C(=O)c3ccccc3C2=O)C1 1841911330 WMVSUZRNEXRRIB-UHFFFAOYSA-N 455.515 0.249 50 20 JCGD Cn1ncc(Br)c1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264240 XRVLGXBRDOOKDQ-UHFFFAOYSA-N 462.308 0.312 50 20 JCGD Cn1c(=O)n(CCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c2ccccc21 14287674 DVDBDLAQULXCOT-UHFFFAOYSA-N 471.539 0.976 50 20 JCGD COCCCNC(=S)N(C)NC(=O)c1cccc(S(=O)(=O)N2CCN(C(C)=O)CC2)c1 726075428 FFGDNPXUNZMNIX-UHFFFAOYSA-N 471.605 0.027 50 20 JCGD COc1ccccc1N1C[C@H](C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)CC1=O 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C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)N1C[C@@H]2C[C@H]2C1 1779372694 XOBYPYKWGFUXAH-CDKUKRTFSA-N 470.574 0.153 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nccnc3C(N)=O)C2)C1 1779872572 CCXBAMZALOJOJE-ZSEKCTLFSA-N 496.952 0.151 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1780712957 GQBLKWJZHIEDGR-NSISKUIASA-N 457.163 0.730 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1 1782408359 UNYLPLKHYKDUGW-CYUILNSLSA-N 478.509 0.759 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1783020101 RJDWXICHIFDLOH-XLIONFOSSA-N 458.964 0.452 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=O)c3cc(C)on3)CCO2)C1 1783349718 RTXYVMUFECVTRO-SCLBCKFNSA-N 457.325 0.716 50 20 JCGD COc1ncc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1783416092 DNDHNZTWWVSWHN-JVPBZIDWSA-N 473.722 0.331 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1 1783940147 SAXYWBPXPSSOMG-JOCHJYFZSA-N 467.567 0.058 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCS3(=O)=O)C[C@@H]21 1783974295 LBZCYPRTJOIQKP-YYFQZIEXSA-N 451.383 0.574 50 20 JCGD CCc1nn(C)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c1Cl 1785707954 XYALXZYFYBDQID-DZKIICNBSA-N 468.986 0.602 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(F)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984714 ZVRLCAKXUICOPM-NDXORKPFSA-N 456.279 0.178 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cc(-c2ccccc2)no1 1788917419 QRDAOCOYMGGIQZ-LEDOBFOHSA-N 475.310 0.929 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)n(C(F)F)n1 1789330332 BPNCWJDLARJJOC-ZVZYQTTQSA-N 462.262 0.174 50 20 JCGD O=C(CCc1cnc2[nH]ccc2c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791141460 ZUYCITXXNMUIDE-BVSLBCMMSA-N 476.342 0.469 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3COc4ccccc4O3)C[C@@H]21 1791287920 DDMAKVYIHHFLJS-FVCZOJIISA-N 460.531 0.179 50 20 JCGD COc1ncc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1792402509 XZCOJTHMTWLONW-DPIQGUFMSA-N 474.905 0.259 50 20 JCGD O=C(Cc1ccc(OC(F)(F)F)cc1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1795372216 AMBDXUXSXMATTP-UPHUGPLXSA-N 492.259 0.711 50 20 JCGD Cc1noc(N)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1795573858 BKPPUAALANOWHP-XEMDLRDOSA-N 485.545 0.115 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1c[nH]c3ccccc13)C2)c1ccc(B(O)O)cc1 1795734850 ZGHQWWINTJQIFJ-NHKMSHSESA-N 461.327 0.684 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(OCC2CC2)cc1F 1799420875 FBSFQOSQEXPHPU-FEJSZKPUSA-N 482.317 0.811 50 20 JCGD COc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)ccc(F)c1F 1799675589 QIBLGRRUBPWMRR-HBCWATKFSA-N 460.242 0.170 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(c2ccccc2)=NN1 1800152284 HPGUVCQCZGTPLN-COIRSVNQSA-N 491.552 0.476 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2C=CS[C@@H]21)NC(=O)NCc1ccccc1 1800253350 UQYWNTZZWIKFJY-PACCEGMYSA-N 485.610 0.797 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](C)Br)n(-c2cccc(=O)n2C)n1 1800757440 ZFDGSNRXQGKMOK-BKEDOTJMSA-N 492.374 0.866 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C)C2 1800757735 USHSXPYXDIZDBA-RBZJEDDUSA-N 490.395 0.995 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1801012778 LFNXKUCTOZNPAZ-NYUBLWNDSA-N 495.418 0.955 50 20 JCGD COc1cc(Cl)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1801808661 UIMDXCAASGXIBR-CWPLJXCYSA-N 458.707 0.545 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)n(C)n1 1804928661 LBLAAOGEZKDEIM-IERDGZPVSA-N 457.535 0.516 50 20 JCGD N=C(N)SCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1807004429 VMFVVNPJVRIZLF-DYVFJYSZSA-N 456.532 0.026 50 20 JCGD Nc1ncc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)s1 1807365310 UIVIFAYHNDUMPR-YJBOKZPZSA-N 451.317 0.434 50 20 JCGD O=C1Cc2cccc(C(=O)N3CC[C@H](CNC(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)c2N1 1807367744 VHZFLOJWYOKMQK-DVECYGJZSA-N 484.321 0.889 50 20 JCGD COCCn1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1808657585 MHCPJTOYRZZDMK-UWJYYQICSA-N 492.540 0.556 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1808681113 PAJCIGJXPLDALH-FJIDUMEYSA-N 484.981 0.963 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc2n(n1)CCCC2 1809865231 PFPLCTYEQXLPEP-WMZHIEFXSA-N 473.342 0.928 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810323697 IAORBHWAFVBLIE-WJPUGNRLSA-N 489.540 0.690 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1 1813072692 DLGOYWFOBAQJFG-ZBVSPGGGSA-N 451.531 0.964 50 20 JCGD Cc1c(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn2[nH]cnc(=O)c12 1813074664 UXPOJWGKIWQZOT-VGOFRKELSA-N 494.556 0.419 50 20 JCGD C=CCNC(=O)/C=C\C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1814437829 FGTZABJLARWIMF-JTGQJZMRSA-N 466.502 0.573 50 20 JCGD COCc1oncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1817798525 BZXSMJPTKSCFOJ-CYBMUJFWSA-N 456.289 0.497 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1 1819403093 UVAXDERKJRWKFT-MRXNPFEDSA-N 490.484 0.776 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)nc4sccn34)sc2C1 1821157168 YQMWRXQMMCYMNZ-LLVKDONJSA-N 489.583 0.811 50 20 JCGD CN(C)CC(=O)N[C@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822518589 QXGKNFQJXCGRQG-INIZCTEOSA-N 473.603 0.963 50 20 JCGD O=C(CNCP(=O)(O)O)N[C@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1 1823004778 VWOKPWFHWNISFV-QUBYGPBYSA-N 459.234 0.470 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052478 KIVOYRNLLZSUAL-NRFANRHFSA-N 451.332 0.612 50 20 JCGD Cc1cc2nnc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)c(C)n2n1 1828148185 CRWAGQPTYXKECT-NRFANRHFSA-N 490.373 0.968 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCCC3)sc2C1 1828401201 GJUDDQGPLADMMA-ZDUSSCGKSA-N 457.560 0.853 50 20 JCGD C[C@@](O)(CC(=O)O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828925932 VZLDHGGEPYKFGM-MBSDFSHPSA-N 475.546 0.534 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1831610047 UHAMIZAMSXCIJP-TVTNDZMWSA-N 496.402 0.961 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832074700 FZNWNHAOCFPGDN-SSKFGXFMSA-N 489.997 0.832 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)C3CC(O)C3)CC2)CC1 1833275258 MSOXPCPIHOWZOL-CVKSISIWSA-N 458.563 0.463 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CC(c4ccccc4)=NN3)CC2)CC1)[C@H](O)CCl 1833312112 KDYMLSQNISBZPW-LEWJYISDSA-N 461.994 0.924 50 20 JCGD O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCCNC4=O)CC2)CC1 1834424100 YCDXDPDNMQUZSN-UHFFFAOYSA-N 495.422 0.987 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C[C@@H]3CCCCO3)CC2)CC1)c1cccc(B(O)O)c1 1834799774 AONHQMFZJYZDGZ-QFIPXVFZSA-N 457.380 0.511 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc4[nH]ncc4c3)CC2)CC1)c1cccc(B(O)O)c1 1834799968 JMAHMWBZKGBBCD-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cc(O)nc(O)n3)CC2)CC1 1835075593 RDAWTNIFBSWMMQ-UHFFFAOYSA-N 451.600 0.925 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(O)nn3)CC2)CC1 1835118391 XLAVRABSZLEBGK-CVKSISIWSA-N 482.545 0.501 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1835642703 VFVCURQRXLFEHJ-TYILLQQXSA-N 466.938 0.219 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738338 XMHMQEKMXLKIHO-INIZCTEOSA-N 473.578 0.671 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2c1 1835930638 RAJPJDLLGKZSIF-RUZDIDTESA-N 493.325 0.240 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccc4occc4c3O)C2)C1 1835939748 ZUQZBBITFNMPNO-XMMPIXPASA-N 480.282 0.202 50 20 JCGD CC[C@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)NS(=O)(=O)CC)CC2)CC1 1836395115 SKEQFYAOYLNBFP-PBHICJAKSA-N 451.033 0.903 50 20 JCGD Cc1cccc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)[nH]c12 1836857146 SMUYPCKWIBUUJT-XMMPIXPASA-N 471.558 0.919 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3c(C)cc(C(N)=O)cc3C)CCO2)C1 1837438464 ZDDMFSFLWSYJFD-VGOFRKELSA-N 467.950 0.726 50 20 JCGD Cc1cc(C#N)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837460108 VLNPEFLWYHWCCZ-XMMPIXPASA-N 478.509 0.249 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460113 VQIQVYNCRHEJDL-DEOSSOPVSA-N 499.572 0.409 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)/C=N/O[C@H]3CCCCO3)CCO2)C1 1837530786 QRWXTLNSCAQQHH-IXOFLNQHSA-N 462.341 0.755 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(-c3ccccc3)no1)CCO2 1837997154 JOSTXNWQVBWGMQ-XMMPIXPASA-N 485.541 0.785 50 20 JCGD Cc1ncc(C(=O)N2CCOC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)[nH]1 1839054351 VGFRTVRJRVEXPX-XMMPIXPASA-N 499.572 0.134 50 20 JCGD CN1CCN(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@](C)(Cl)CCl)CCO3)CC1 1839152052 MAOYGICYBBDXTK-PMACEKPBSA-N 465.422 0.317 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1[N+](=O)[O-] 1839189557 SORSQSHYVQRGNP-PXNSSMCTSA-N 455.895 0.502 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198445 DPSGSNISROSIPR-LXIYXOSZSA-N 498.346 0.019 50 20 JCGD NC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1)c1ccccc1 1839199379 NMUVMLPGCADREF-FRQCXROJSA-N 458.328 0.876 50 20 JCGD CCC(=O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1839830820 JYHRSEQIJPOVNV-NRFANRHFSA-N 463.443 0.569 50 20 JCGD O=C1CCCCN1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840105367 MLONNSJCOKAXKJ-DOTOQJQBSA-N 450.305 0.146 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)cc1F 1840182610 OEYNTKXMLIGRAK-XMMPIXPASA-N 478.565 0.896 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011613 VYWRBJVWPGRMNM-LPHOPBHVSA-N 471.363 0.686 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)C1(C(=O)Nc3ccccc3)CC1)C2 1844263568 RLNBBFBVVLNMTP-UHFFFAOYSA-N 462.510 0.921 50 20 JCGD COCCOCCOCCOCC(=O)N1CCCC12CN(C(=O)[C@@H](C)CBr)C2 1846256031 KOBIUJBSHWWHED-INIZCTEOSA-N 465.385 0.917 50 20 JCGD O=C(CCCN1C(=O)c2ccc(Br)cc2C1=O)NNC(=O)[C@H]1CCS(=O)(=O)C1 9931049 VEYDWPLIHBGHFZ-JTQLQIEISA-N 472.317 0.407 50 20 JCGD Cc1nc(N2CCOCC2)[nH]c(=O)c1CCC(=O)NNC(=O)COc1ccc(Br)cc1 14322583 RBUYWLZJRRXEPB-UHFFFAOYSA-N 494.346 0.836 50 20 JCGD O=C(COc1ccc(F)cc1)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 16069816 KUQBBOFKYGPNJN-UHFFFAOYSA-N 455.439 0.826 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CN2C(=O)COc3ccc(Cl)cc32)cc1 26772669 YFSMYBJFUXAJNB-UHFFFAOYSA-N 480.930 0.842 50 20 JCGD C[C@H](NC(=O)NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(S(=O)(=O)N(C)C)c1 727610841 UTBKWNTYRVHNNL-ZDUSSCGKSA-N 482.588 0.935 50 20 JCGD NS(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)c2cccc(OC(F)F)c2)c1 728544980 QNWIPSLOONNHIK-UHFFFAOYSA-N 470.454 0.847 50 20 JCGD CCS(=O)(=O)N(C)C1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 731358524 ZNRDMWDZNWJDQA-UHFFFAOYSA-N 460.582 0.080 50 20 JCGD O=C(COC(=O)CCC(=O)N1CCC(c2ccccc2)=N1)NNC(=O)[C@H]1COc2ccccc2O1 780134324 AQZITHUZSWAENB-HXUWFJFHSA-N 480.477 0.934 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)C[C@@H](C)O1 912920822 DUABQMIDVXXRGF-BETUJISGSA-N 466.482 0.630 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H]2CCN(CC(F)(F)F)C2)cc1 916577682 AZYUSHQLXPVGAC-CQSZACIVSA-N 465.498 0.830 50 20 JCGD NS(=O)(=O)c1ccc(OCCSCC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1 918550112 GFWAJJJXOHZXRQ-UHFFFAOYSA-N 477.362 0.998 50 20 JCGD O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccccc2)cc1)N[C@@H]1CCS(=O)(=O)C1 919886431 XDLSXRDYPJYLLH-OAHLLOKOSA-N 452.514 0.619 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)C1 919886521 UNYNQZBFITUCPR-IJEWVQPXSA-N 472.589 0.484 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3nc(Cc4ccccc4)no3)nc2)CC1 921124029 DBWZGAKWMWNJQW-UHFFFAOYSA-N 486.558 0.818 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](N)c1ccccn1)C2 1778090971 AIYCSKGVIGBLNS-BVQQQVNGSA-N 481.557 0.729 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2c1 1778502220 IOYTXYOPWRLGQU-DEOSSOPVSA-N 463.299 0.614 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)/C=C\C(=O)NC3CC3)C2)C1 1778826483 IUGAIFBAKWYDGM-FZSWMLOVSA-N 484.981 0.783 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ccoc4c3)CCO2)C1 1779030814 XQZLCHJDZPTHHI-QFIPXVFZSA-N 450.455 0.584 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](COC(C)=O)OC(C)=O)C2)C1 1779076511 NEYONWZWCPLPSZ-RLFYNMQTSA-N 463.325 0.485 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(Cl)cc2nn[nH]c12 1780112683 WAMHQGALOASWPJ-AUSIDOKSSA-N 497.748 0.732 50 20 JCGD CCOC(=O)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)ccn1 1780170696 CGDTXDIXNXTSBX-PXDATVDWSA-N 495.341 0.379 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1782100744 NHOSEBAQAJTCIM-JOCHJYFZSA-N 469.259 0.046 50 20 JCGD CC(C)N[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)C(C)C 1782210921 ZPBTWPDDPABBPL-RZFNWQHOSA-N 453.628 0.896 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783021805 BVQGDXOQLPTLAF-FVJLSDCUSA-N 481.391 0.415 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3CN(C(=O)c4ccccc4OC)C3)CCO2)C1 1783867965 CWJAJRRXXPNVAE-FDDCHVKYSA-N 479.961 0.851 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(N3CCCC3)ccn1)CCO2 1783934159 AOYCHRZYRRWBAY-HSZRJFAPSA-N 458.563 0.498 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c1 1784449017 GHHUTEPTJMNULU-CJFMBICVSA-N 497.600 0.929 50 20 JCGD C=CCCc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c(O)n1 1785773631 VZUULLGIMMOKST-JHVJFLLYSA-N 494.552 0.811 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3sc4nccnc4c3N)[C@H]2C1 1786952505 FZTOWQQFZYRAMP-IHRRRGAJSA-N 475.575 0.240 50 20 JCGD CCc1[nH]nc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1Cl 1787134026 SJBNNOUAEGEBST-PJODQICGSA-N 475.937 0.531 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]3C2)C1 1787449821 YBHPCINCRVRDJU-KXKVQDCLSA-N 463.934 0.728 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2CO[C@@H](CNC(=O)[C@]3(F)CCCCC3(F)F)[C@H]2C1 1788172775 WQSQQGVYWAETKA-QUJKESNLSA-N 468.281 0.877 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21 1788610374 NZKOAEBRRLCECH-IXDGSTSKSA-N 468.514 0.459 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1(c2ccc(NC(=O)[C@@H](O)N3CCOCC3)cc2)CCC1 1789555846 OWWSYMZYTUQECH-JOCHJYFZSA-N 468.514 0.083 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc(O)cc1 1789884804 NDYKRXNJDDHLKX-UYIIBVGGSA-N 452.316 0.469 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)[C@H]2C1 1790176729 DNEFLLCHJHMVCE-HAFSJTIUSA-N 478.384 0.983 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCS3(=O)=O)[C@H]2C1 1790750065 GSLQJUPDZDYYAC-RMEBNNNOSA-N 451.383 0.717 50 20 JCGD O=C(Cc1ccc2c(c1)CCO2)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791003348 UTSWWQLYQISEBL-RRPUWOKSSA-N 464.327 0.137 50 20 JCGD C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1791156441 DGCDQJQUOOXNDK-QZWWFDLISA-N 469.583 0.252 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)[C@H](Cl)COC)[C@H]3C1)C2 1791257513 LBEZSDQXPYQTJY-CWLGOENISA-N 496.992 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncn(-c4cccc(F)c4)n3)C[C@@H]21 1791288563 FMJXICOJUCJODV-SNRMKQJTSA-N 487.536 0.373 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791622798 IPXPGKKCOMVBTE-PDWMJMLSSA-N 468.514 0.141 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792980932 AYBOGBIOPGBHJG-QEOTZNIISA-N 459.971 0.965 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1793865927 JRJCKVNQIRVXKA-KRXQYRFLSA-N 472.546 0.946 50 20 JCGD O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCNC3=O)C2 1795114449 KXMCTQOYWBFCLB-DRXBFXEBSA-N 454.325 0.005 50 20 JCGD COc1ccc2c(c1)CC[C@@H](CC(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)c1cccc(B(O)O)c1)C2 1795739183 QKPHXUGLLZDYMD-WUABMQKPSA-N 492.381 0.773 50 20 JCGD CCn1nc(C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1796132584 QNFMUJZEHMYGST-ZPHZMXASSA-N 455.519 0.549 50 20 JCGD Cc1ccc2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)ccc2c1 1796855541 LLYQGHODSDOYLK-BBIADKPPSA-N 459.311 0.740 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)CCBr)C4)ccc21 1796980788 WCSMYDPSVFTNIK-ZSBFGKGUSA-N 465.348 0.865 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@H]2Sc3ccccc3[C@@H]21 1797762664 AIHROSWFHBXNBW-XQLXGXOBSA-N 479.562 0.776 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csc(C(F)(F)F)n1 1798258328 YRNLBDKNVRGNBF-WDAIWFPHSA-N 484.460 0.677 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)NCCC#N)C2)NC(=O)NCc1ccccc1 1799095051 SCQUILKLZOXPCV-VTYHHJSWSA-N 499.616 0.204 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801012707 WDNULVVJTHNPHW-VTEUUUEMSA-N 463.491 0.185 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnc(Cl)nc1 1802297220 QAHHANZSLKSSGR-VQIMIIECSA-N 465.706 0.838 50 20 JCGD C[C@H](Cn1cccn1)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1804724215 ZXZZTDGIQKTEKH-ZWCUEREDSA-N 455.563 0.993 50 20 JCGD COc1cccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1805207766 GFWGTLZYBNCFJE-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD Cc1c(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cnn1C 1805925290 CBCBSVQXXIRIQF-UZLBHIALSA-N 462.514 0.755 50 20 JCGD Nc1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)s1 1807273357 AWQOJVKESUXIKB-YJBOKZPZSA-N 451.317 0.434 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)C2CCC(O)CC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364338 FDPWVIUTURPJJC-ITYAMSQCSA-N 451.332 0.632 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n(C)n1 1807365079 WREOZZVOMJGJPG-DYESRHJHSA-N 463.303 0.137 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nc(CO)[nH]c3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373840 CKGWZCGOUZBJEF-YADARESESA-N 499.336 0.763 50 20 JCGD Cc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n(C)n1 1810299940 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O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnn3c2OCCC3)[nH]n1)c1ccc(B(O)O)cc1 1817472737 VHADINHLQWPZNF-SFHVURJKSA-N 464.291 0.688 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCC(=O)N2)[nH]n1 1818111902 OICYNBMGJAFLMT-ZKKDUWIDSA-N 454.491 0.814 50 20 JCGD Cn1cc(CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cn1 1822835611 RPTQYYFLISOQQA-KRWDZBQOSA-N 451.491 0.690 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](O)CCl)CC1 1824185169 HGKWPIPKLJUUFH-BMGDILEWSA-N 451.955 0.814 50 20 JCGD Cc1cnn([C@H](C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1 1826744820 OVJTUVRBENNLNI-CZUORRHYSA-N 453.333 0.815 50 20 JCGD C[C@@H](Cn1ccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826824472 CQMIHAYTHYSAQJ-XJKSGUPXSA-N 453.333 0.582 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)Cn2ccccc2=O)CC1 1827098092 YHRCFZLGOHTJKH-HXUWFJFHSA-N 466.542 0.780 50 20 JCGD O=C(C(O)O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1828525308 OSWOXNFNKMIBHY-IFXJQAMLSA-N 488.310 0.440 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830353704 JVFMVYSVECISKO-KDOFPFPSSA-N 453.989 0.036 50 20 JCGD Cc1cc(C)n(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n1 1830535484 OZHWDTYUGPHQAP-AUUYWEPGSA-N 457.369 0.987 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1830544507 ZUEKOEHSLYMKPZ-KUHUBIRLSA-N 471.352 0.767 50 20 JCGD Cn1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc2c1-c1ncccc1OC2 1830723948 VELWZTOCBWIKSJ-HXOBKFHXSA-N 490.944 0.649 50 20 JCGD Cn1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccc1C(F)(F)F 1830727676 AUAPCCMYMBDKRW-GUYCJALGSA-N 453.845 0.714 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCCN1C)CCO2 1830770378 WYIVQSXKFSZPKE-VDGDLTCWSA-N 474.562 0.061 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(Cl)c1 1832535508 NRVLZWZSANGQPJ-PXNSSMCTSA-N 461.342 0.947 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccnc3C(N)=O)CCO2)C1 1833305035 MWTBVEBDVRYREW-ORAYPTAESA-N 469.336 0.282 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(C(C)(C)C)c1)CCO2 1833371133 IREAEKBGEYDZCM-DEOSSOPVSA-N 475.590 0.822 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3nc(C)c(C)[nH]c3=O)CC2)CC1 1833940255 OWYIDZJFPPYNAT-QGZVFWFLSA-N 453.971 0.826 50 20 JCGD Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)s1 1834079005 IDFJDAGKZCPTFR-FQEVSTJZSA-N 453.565 0.203 50 20 JCGD NC(=O)c1nccnc1C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1 1834423117 GKBWXNDLOWVYNV-UHFFFAOYSA-N 467.368 0.546 50 20 JCGD Cc1ncccc1CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797535 VMEQNBNKGOUCFP-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3[nH]nc4ccncc34)CC2)CC1 1835019157 RNGLVTSKEVPWQD-UHFFFAOYSA-N 470.578 0.516 50 20 JCGD COCCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1835186900 ODDRSXSAULGBBB-UHFFFAOYSA-N 477.610 0.088 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(F)F)CCO2)NC(=O)NCc1ccccc1 1835460136 IAHQKVNMIAYJQS-JOCHJYFZSA-N 483.516 0.444 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncnn3C)C2)C1 1838526724 AFXCHLRAYSOIPS-NRFANRHFSA-N 488.457 0.032 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCOC3)C2)C1 1838528233 MDIUFKZVJYJMRY-KSFYIVLOSA-N 477.470 0.627 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1839146053 JCINXNSQZSVBDT-PGRDOPGGSA-N 468.934 0.923 50 20 JCGD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200625 MSDGHGBQUQQQQG-SMDDNHRTSA-N 450.221 0.078 50 20 JCGD O=C(c1cnn2c1OCCC2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839518081 HKCPWVPGNQDRIE-GUYCJALGSA-N 461.288 0.426 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(F)cc3F)CCO2)C1 1839979116 VLQXICYZNVEXDY-QHCPKHFHSA-N 489.479 0.276 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C2)C1 1840155909 JUKWSWZUYSYKOO-JXFKEZNVSA-N 473.885 0.987 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3C[C@@]34C(=O)Nc3ccccc34)C2)C1 1840156050 MPNPXAHDTBGJMK-ODYPEACGSA-N 477.945 0.607 50 20 JCGD CSc1ncccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185879 UYRJQNXZZLEJJM-NRFANRHFSA-N 465.576 0.247 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccn3)C2)C1 1840185998 YBVOLTSEYNAQKW-HXUWFJFHSA-N 453.927 0.178 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1840189493 VDTGYTGPSJKIOJ-CKNLXJGOSA-N 496.388 0.474 50 20 JCGD Cc1cc(Br)cnc1C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1842558594 DRIABRHRTYCLSE-UHFFFAOYSA-N 458.121 0.963 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1 1843012473 ROYIGRGBJSYYNF-UHFFFAOYSA-N 480.326 0.864 50 20 JCGD COc1cc(CC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)ccc1[N+](=O)[O-] 1843014356 ARJBYBPNGDFZQM-UHFFFAOYSA-N 453.260 0.343 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C)C2 1846386228 OXHKDPOWTACJEN-HNNXBMFYSA-N 465.551 0.489 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(CC(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)[C@H](O)CCl)=NO2)C1 1847562343 BZYHBGPFOACNER-GXYOHSSGSA-N 470.954 0.944 50 20 JCGD O=C(COCCOc1ccccc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 46900223 MNMUGGGBUWXQAV-UHFFFAOYSA-N 463.512 0.564 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CCCNC(=O)NNC(=O)CNC(=O)c2ccco2)CC1 726098872 BUTJVDYOGZHLAN-UHFFFAOYSA-N 452.512 0.283 50 20 JCGD CS(=O)(=O)Nc1cc(F)ccc1C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728329913 XUMWRLZRWUSZIU-MRXNPFEDSA-N 467.431 0.341 50 20 JCGD Cn1[nH]c(Br)c2c(=NCCNC(=O)NNC(=O)COc3ccc(C#N)cc3)ncnc1-2 729624961 HNKXXEWUGNGZOF-UHFFFAOYSA-N 488.306 0.192 50 20 JCGD CCOC(=O)c1cccc(S(=O)(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 749151297 IFZLEGPPJKNIEO-UHFFFAOYSA-N 469.541 0.802 50 20 JCGD O=C(COC(=O)[C@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cccs1 771192327 RRSYAYQXVZMGEW-TZMCWYRMSA-N 487.943 0.530 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CN(C)S(C)(=O)=O)c2)c(C)c1 914748483 HPLOEFBAGODRAC-UHFFFAOYSA-N 468.557 0.757 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)c1ccc(C)nc1O)N(S(C)(=O)=O)CC2 916827406 HCKRSURWFNFDLI-INIZCTEOSA-N 478.527 0.823 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)NCc2ccccc2OCC(=O)NC[C@@H]2CCCO2)n1 918217831 LXTNUQJHYINQCG-SFHVURJKSA-N 458.519 0.705 50 20 JCGD C[C@@H](C(=O)N(C)CC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)n1cccn1 918689530 WLHWABNWZAGJRZ-HNNXBMFYSA-N 462.532 0.148 50 20 JCGD CN1C(=C(C#N)C(=O)CCC(=O)NCCC(=O)N[C@@H]2CCS(=O)(=O)C2)N(C)c2ccccc21 919715485 YHTVSFWJQRHSCI-OAHLLOKOSA-N 473.555 0.467 50 20 JCGD CCOc1ccccc1OCC(=O)NNS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2 919954665 QPHGOUPHRNNFIA-UHFFFAOYSA-N 452.441 0.943 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CS(=O)(=O)C3)C1 1777715893 YLLHSSGPCJILCR-ZXYWRSMDSA-N 474.967 0.219 50 20 JCGD CCc1[nH]nc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1Cl 1779029846 AICYSAJWSGWPGD-HXUWFJFHSA-N 461.910 0.381 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1 1779111260 QKRTVWSIADJKCG-QHCPKHFHSA-N 477.481 0.492 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnoc1C1CC1)C2 1779371045 JMTNYMYDPVIUBE-WZONZLPQSA-N 468.514 0.992 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1F 1780110448 HVYZIWJRXWJTIV-XMMPIXPASA-N 484.289 0.440 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780967890 BJEBTWMPKSZWGD-IIBYNOLFSA-N 496.406 0.946 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(N4CCCOC4=O)cc3)C2)C1 1782081450 SMMIKCMVQUONPC-DEOSSOPVSA-N 487.557 0.850 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cccc(F)c34)C2)C1 1782480329 CMNHKXOIZMUEBF-QFIPXVFZSA-N 452.251 0.139 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1782563645 CFYVYEBWDKNEGZ-IFXJQAMLSA-N 454.369 0.946 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)COc3ccc(O)nn3)C2)C1 1782673529 MOGLCDSATRAWKK-LHSJRXKWSA-N 499.952 0.523 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1783321750 ASTGJPBGQFHJTP-HJPURHCSSA-N 453.499 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)Cc1cc([N+](=O)[O-])ccc1F)CCO2 1783933311 HBHSGKJXYMXQET-NRFANRHFSA-N 465.482 0.479 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1CCC3(CC1)OCCO3)CCO2 1783937256 QWCSUAGYKPPKBQ-NRFANRHFSA-N 452.552 0.123 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)cc1 1786700260 UOCWYIZUIHJTAB-OWLYRPNTSA-N 458.964 0.212 50 20 JCGD CCCc1onc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1787652921 NUTGCCRGZKRSII-QRFRQXIXSA-N 455.320 0.522 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3occc3Br)C[C@@H]21 1788610514 XBCCUXRVYUIHLJ-PJODQICGSA-N 492.330 0.948 50 20 JCGD CC(C)N1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CC1 1788611649 OGKQHEUVIYFJPB-YYWHXJBOSA-N 472.590 0.399 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1791249939 UMFFQYCQPHIIDZ-GVRJEKJASA-N 463.959 0.106 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1C[C@@H]1c1ccc(F)cc1 1792808368 MHIORGCUPIYAAI-MPMRWZLSSA-N 452.291 0.512 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3ccc(Br)cn13)C2)[C@H](O)CCl 1792981519 LZEJAZFKXYEEGR-YHYOWMERSA-N 471.739 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COCc1ccccc1 1795424468 XRYLBSLCSIFNST-CUCMZJRUSA-N 467.526 0.927 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)[C@H]2C1 1796370390 IYGGSHUGIHQXJW-ZJZYOEKZSA-N 475.945 0.992 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(NC(=O)C2CC2)cc1 1799440782 ZRHPWJZGHAWEPZ-UPHUGPLXSA-N 492.536 0.551 50 20 JCGD CN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1800351469 GDXTYKSGDUDQCR-AEKWLRTRSA-N 492.976 0.872 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1C(=O)COc3ccc(Cl)cc31)C2 1800973482 ANRKJDXKJCGFIW-OOVWBHHBSA-N 486.352 0.909 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802340023 XSWLXFGACQAPQC-YVSFHVDLSA-N 497.593 0.454 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O 1804528851 PWYFJJXEQXACSK-YVSFHVDLSA-N 486.997 0.958 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CS(C)(=O)=O)[C@@H]1c1cccnc1 1806765926 HIPLGNYUYOEVQU-AMZZFQKZSA-N 474.543 0.266 50 20 JCGD CC(C)(NCCC#N)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807146275 XJLDZXVLARKXGA-CTNGQTDRSA-N 463.347 0.363 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(-n3cncn3)c2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365353 IUEDFHZPLJCLDK-QPPBQGQZSA-N 496.336 0.976 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)[C@H](C)NC=O)[C@@H]1c1cccnc1 1808417419 YSEMWESTXLEVMA-VXUYBBFXSA-N 453.503 0.356 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)ccn1 1808918893 RANFDDVXLWZTCP-OFNKIYASSA-N 487.325 0.748 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCN2CCOCC2)[C@@H]1c1cccnc1 1810302146 GWHPLRGBUAZQDT-XMSQKQJNSA-N 481.557 0.122 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC2(CCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)CC1 1810828193 BQZZAFFFQPTMCM-QHCPKHFHSA-N 461.371 0.926 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccnc2c1OCO2 1811310689 XNYCKHJRWYKCAS-PXNSSMCTSA-N 474.282 0.519 50 20 JCGD O=C1Cc2cccc(C(=O)NC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)c2N1 1812208727 MCYHEEVBKXWKGI-YADARESESA-N 484.321 0.889 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CCl)CC2 1817271283 XLGMEBFEASEZOZ-PWSUYJOCSA-N 450.970 0.080 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc2ncnn2c1 1819395500 QGCBXIKRBVRMIO-OAHLLOKOSA-N 462.300 0.405 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2CCOC2=O)[nH]n1 1819403156 WFEOPXWUFGPSPD-MRXNPFEDSA-N 470.490 0.556 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1821684451 HJFJJXLPMDEZQI-CXAGYDPISA-N 458.280 0.957 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](O)CCl)[nH]n2)N1 1821781149 ZLIBCKIFYUHZNF-MHEUCROKSA-N 498.993 0.182 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H](O)Cc1ccccc1 1822078613 AOPOPJGKDGCKMV-SFTDATJTSA-N 462.315 0.999 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1CCc2nc[nH]c2C1 1822686336 BIYSEGQZJGRZAW-YWZLYKJASA-N 462.319 0.924 50 20 JCGD CC(=O)N/C(C)=C/C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1824472456 PKKVQBAJBHUXDV-OFFHKIPUSA-N 457.516 0.407 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)C[C@H]1NC(=O)NC1=O)CC2 1825441384 UOVLLXKOLSXVPQ-OYNCUSHFSA-N 458.338 0.827 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)c1cccs1)CC2 1826080571 RNNLXHLHGHHLLA-LBPRGKRZSA-N 478.600 0.920 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(O)C(F)(F)F)C2)C1 1830535330 MOCPTEAIFDZSGD-KCPJHIHWSA-N 461.275 0.787 50 20 JCGD O=C(CCN1C(=O)Cc2ccccc2C1=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1830836577 ZBGQVBLMWUBPPL-KNQAVFIVSA-N 481.908 0.592 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1OC 1832094776 MJWFNAPSZAINFH-VGOFRKELSA-N 470.950 0.693 50 20 JCGD O=C(NCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1cccs1 1833032894 AJCVKHUSUQQJKC-WMLDXEAASA-N 478.340 0.625 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)cco3)CC2)CC1 1834343221 YZSANIWCSGBZRD-JVWAILMASA-N 482.541 0.959 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(NC(C)=O)cc3)CCO2)C1 1836666265 CRXHDMPKYGVTSR-KNQAVFIVSA-N 467.950 0.898 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccc1 1837463033 YOIKKPRSEPDTAT-BXKMTCNYSA-N 467.526 0.559 50 20 JCGD O=C(c1cc(=O)n2[nH]cnc2n1)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1837918123 FDLKZIGIZNGQBW-OAHLLOKOSA-N 485.314 0.720 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3nc4ccc(F)cn4n3)CC2)CC1 1837920229 RZVMIFRMXBEZLS-UHFFFAOYSA-N 495.320 0.474 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]cc3[N+](=O)[O-])C2)C1 1839153769 RUFNXSDCSHBTJE-JKSUJKDBSA-N 450.279 0.624 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1[N+](=O)[O-] 1839190465 PEVAQEYZYFGOHZ-QHCPKHFHSA-N 491.545 0.275 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3OCCO4)C2)C1 1840152811 UPFZETWXQFLVRL-IIBYNOLFSA-N 454.907 0.782 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3OCCc4ccccc43)C2)C1 1840182954 XLOQJGXPQRCJIK-BWKNWUBXSA-N 488.585 0.520 50 20 JCGD COc1ncc(Cl)cc1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183256 WHZVDKUKFAQVIY-NRFANRHFSA-N 483.953 0.187 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010625 METFSEMNGCVCTM-UHFFFAOYSA-N 460.299 0.697 50 20 JCGD CO[C@H](C)[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)N(C)C(=O)OC(C)(C)C 1843014495 QKQWRDYKHLGGQY-APWZRJJASA-N 489.378 0.454 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1844349018 XWDLPEPVRQVFAX-SFHVURJKSA-N 468.562 0.464 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O)C2 1846365688 OWDVKBGGMMRJPG-HNNXBMFYSA-N 472.970 0.523 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC12CN(C(=O)CCBr)C2 1847088594 JSHCNTJXFXXWEK-LBPRGKRZSA-N 461.357 0.744 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cnccc2C(=O)NN)CC1 1847303306 PQDQKWQJPJZLJE-IRXDYDNUSA-N 472.546 0.805 50 20 JCGD O=C1C[C@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)CN1Cc1cccs1 1848146416 STNCHIZOKQAOOB-VDGAXYAQSA-N 467.356 0.292 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cnccn1)c(=O)n2Cc1ccccc1 10161537 GNJNDOTYAQIYLS-UHFFFAOYSA-N 476.497 0.315 50 20 JCGD COc1cc(C(=O)NCC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc(OC)c1OC 17195503 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O=C(C(Cl)Cl)N1CCO[C@]2(COCCN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)C2)C1 1840189590 ADXFVWGVWPGCQH-SPEDKVCISA-N 486.396 0.882 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)N2CC3(CCCN3C(=O)[C@H](O)CCl)C2)cc1 1841353993 BPPCFEWJJVNABO-ZWKOTPCHSA-N 469.991 0.951 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C[C@H]2C[C@H]21 1841361479 SHJHGOBIKOTPLI-BHIYHBOVSA-N 469.347 0.581 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)CC2CN(C(=O)OC(C)(C)C)C2)C1 1847026115 JWSNWBLFHIZKJJ-UHFFFAOYSA-N 451.568 0.820 50 20 JCGD O=C(COC(=O)COc1ccc2ccc(=O)oc2c1)NNC(=O)[C@H]1COc2ccccc2O1 10987051 CEWGFVLIOLLDOZ-GOSISDBHSA-N 454.391 0.702 50 20 JCGD CSCC[C@@H](NC(=O)c1ccco1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 14701747 ZDYPMONTFRLIGJ-GFCCVEGCSA-N 453.546 0.885 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1 16785964 OUHYTEVVCLSQCL-CYBMUJFWSA-N 497.517 0.688 50 20 JCGD COC(=O)c1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 25166519 PILORKRMWAPGNO-UHFFFAOYSA-N 475.523 0.888 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)CNC(=O)c1ccco1 725739591 JSDMFJBTSMMTLV-AWEZNQCLSA-N 454.530 0.257 50 20 JCGD C[C@H](NC(=O)c1n[nH]c2ccccc12)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 728204053 RJJQIFQRNFGRNS-AWEZNQCLSA-N 484.538 0.927 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 728513777 XJKWWGAIYDZDPU-INIZCTEOSA-N 493.567 0.437 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1cccc(C#N)c1 728873178 UVYPCUHQMMLKMN-QGZVFWFLSA-N 464.525 0.101 50 20 JCGD O=C(NNS(=O)(=O)C1=Cc2ccc(OC(F)F)cc2CC1)N[C@@H]1CCS(=O)(=O)C1 747691606 ATATVUGHEGONSW-GFCCVEGCSA-N 451.473 0.896 50 20 JCGD CC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1I 749715121 HMUHUCUKGDGNLP-UHFFFAOYSA-N 453.258 0.093 50 20 JCGD C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 750541866 BFBHVFUWWCSIHC-JCGIZDLHSA-N 476.555 0.796 50 20 JCGD COC[C@@H](C)n1c(SCC(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)nnc1-c1ccccc1 751063928 UZGISTQKRAAKJT-HIFRSBDPSA-N 467.573 0.827 50 20 JCGD COc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)cc1OC 751207030 PQLPWORKVLQQAL-UHFFFAOYSA-N 494.526 0.275 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(Cl)c(C(F)(F)F)c1)NNC(=O)CN1CCCC1=O 789856557 IMLPSEGKDQXSSY-UHFFFAOYSA-N 470.857 0.797 50 20 JCGD COCCn1c(C)cc(/C=C(\C#N)C(=O)N2CCN(C(=O)C(=O)N3CCOCC3)CC2)c1C 798120744 YPOJSBLPPIGWHJ-HMMYKYKNSA-N 457.531 0.188 50 20 JCGD Cc1ccc(C)c(S(=O)(=O)NCCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c1 846756323 WWOKILPKHKXLMY-SFHVURJKSA-N 491.522 0.502 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1 912861367 XVXGCPOEPWZGBK-LBPRGKRZSA-N 452.464 0.677 50 20 JCGD COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(NC(C)=O)cc2)cc1OC 913415688 NNPZOPABOMAFBC-UHFFFAOYSA-N 450.473 0.402 50 20 JCGD COc1ccnc(NNC(=O)CCC(=O)N2CCN(S(=O)(=O)c3ccc(Cl)cc3)CC2)n1 914763161 ULGWALPAXHHWAX-UHFFFAOYSA-N 482.950 0.895 50 20 JCGD CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)CC1 916389910 CIPBGCAJKQDRNU-UHFFFAOYSA-N 477.525 0.465 50 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473.408 0.056 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3nnc(-c4ccccc4)o3)CCO2)C1 1779032545 SFCMBCQAAZKZMY-QHCPKHFHSA-N 477.481 0.492 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc3n(n2)CCCO3)C1 1779036642 XMDWWSIDDJFTOJ-VGOFRKELSA-N 462.551 0.166 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1779073546 QEOLXFREEAOQEH-HEHGZKQESA-N 453.261 0.002 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)C1 1779371059 AOKMNBSKOWTHNW-DQRNBUCVSA-N 487.557 0.402 50 20 JCGD CN1CCCn2nc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@@H](F)Br)C4)C3)cc2C1 1781335324 XOOQQCLLHZHLSQ-CRAIPNDOSA-N 458.332 0.853 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CC(=O)NC1=O)C2 1781901675 SSNTZLMMXLMBCP-SNUQEOBHSA-N 459.341 0.226 50 20 JCGD C[C@@]1(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)CC1(F)F 1783142488 CTKSERSCEDBFHP-UIAACRFSSA-N 451.474 0.858 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1783538121 UAELNMKERUKQCM-IQUTYRLHSA-N 478.384 0.875 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1 1783933552 PYAGSQSVDQILJQ-DRSNIGMVSA-N 452.552 0.169 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1 1786981639 APVGUJGYMIOLPO-NYVOZVTQSA-N 451.332 0.340 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C[C@@H]21)[C@H](F)Cl 1787446776 BZKZFKOIAUOSBK-GVARAGBVSA-N 462.869 0.699 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(=O)NCC(C)C)[C@H]2C1 1787527054 MYTDKSIMEYNLKE-QSFXBCCZSA-N 490.513 0.886 50 20 JCGD CC(C)n1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)n1 1788609940 FGXGPRMLNJSRKX-FNHZYXHNSA-N 455.519 0.370 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnncc3C(=O)O)[C@H]2C1 1788890225 SAPCBUDKOHMGPO-HPEDKQMDSA-N 455.309 0.942 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cncc(C(F)(F)F)c1 1789016650 CIISDDGLIHOWML-JVPBZIDWSA-N 477.248 0.687 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=Cc4ccccc4NC(=O)C3)[C@H]2C1 1789158177 MIGOMLDUXMMWPI-CUWPLCDZSA-N 483.569 0.765 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn3C)C[C@@H]21)NC(=O)NCc1ccccc1 1789724931 RSFLINLGOMENFI-ONTIZHBOSA-N 482.585 0.965 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3onc4ccccc34)[C@H]2C1 1790405295 KSDPXDDKQQXJHL-IXDGSTSKSA-N 464.482 0.733 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C[C@@H]21 1791056283 QYIUALOSZYNOKO-TUUVXOQKSA-N 480.425 0.421 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C[C@@H]21 1791057355 SUSUQGUNMOCQLS-DUPGQFARSA-N 474.377 0.862 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21 1792223526 OMZWMKUMKJOPJH-YYFQZIEXSA-N 479.933 0.957 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795116365 BVKYTVRAHOEGBY-ZJOBFFGXSA-N 453.337 0.575 50 20 JCGD COc1ccccc1C(=O)N1CC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)C1 1796361808 UXFFWHFZRVGXBP-DACLVMHWSA-N 453.898 0.891 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=CCCS1)C2)NC(=O)NCc1ccccc1 1799095342 OBBLNZYFZGGPGN-RMFSNUHRSA-N 473.599 0.943 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cc1cnn(C)c1)C2)NC(=O)NCc1ccccc1 1799869730 ZJCAZYHUDNPXKD-WKCHPHFGSA-N 467.574 0.947 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F 1800333403 OGQIFRXHJWKXDE-YNWZIUHOSA-N 476.480 0.612 50 20 JCGD Cc1ncc(Br)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801009472 LCHRYFHZSSFLQM-HBCWATKFSA-N 482.379 0.729 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc[nH]c2C1 1801268414 LGDGSEPQGPKLMM-SJGOPNFYSA-N 467.530 0.238 50 20 JCGD 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CC(=O)NC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810293488 FGMWGVDPQSSWFM-LPHOPBHVSA-N 467.530 0.314 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1)n1ccccc1=O 1810517602 DLIXPNGYEPXNKS-CDMIOBSGSA-N 489.536 0.823 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)Br)[C@@H]1c1cccnc1 1812866065 GOIWIRMXWFZCDG-OEYIWLLWSA-N 457.325 0.935 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nn1C 1813073644 SBBAIQNKUALLKE-HRAATJIYSA-N 457.535 0.516 50 20 JCGD COC(=O)CSCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1815224431 PKCBLKZZSJKYPC-CQSZACIVSA-N 454.553 0.681 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1 1815333903 YUHVFMLJQYTYBA-HTQZYQBOSA-N 466.321 0.883 50 20 JCGD N[C@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)c1cccnc1 1817471113 DTEDMWBCGCGPJQ-UYAOXDASSA-N 462.319 0.881 50 20 JCGD Cc1nnc(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)s1 1817571930 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CCS(C)(=O)=O)sc2C1 1827205557 AMLMAFVLYFENOM-IVWKQIGUSA-N 480.572 0.624 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1828761673 JCFQACPJTFKJMR-VEPFXTNKSA-N 490.561 0.805 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)CCO2 1830351653 AXGBNUBFBSFKGY-LDQAXMLRSA-N 481.977 0.640 50 20 JCGD CCOc1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)cn1 1830534494 AKYKNDBFOHYVPY-KUHUBIRLSA-N 471.352 0.976 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830726897 VSIWHQGDJLETBQ-STXHMFSFSA-N 461.943 0.052 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NO3)C2)C1 1830726959 YGTOBCOMVVSWQB-DBXWQHBBSA-N 451.907 0.236 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737914 KKOKBEHHBZADHG-ZOCZFRKYSA-N 475.970 0.442 50 20 JCGD Cc1nn2cc(CC(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](C)Br)C4)C3)nc2s1 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462.484 0.834 50 20 JCGD CC(C)COC(=O)N1CCC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 726132726 CCESYPYBGUBANG-UHFFFAOYSA-N 496.586 0.973 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)COc2ccccc2O)CC1 730777751 CPTJHMVFQOAKEE-UHFFFAOYSA-N 452.489 0.624 50 20 JCGD COCCCNC(=O)NNC(=O)CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1 745867651 BSQLUTZNYABBFP-FQEVSTJZSA-N 453.499 0.867 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CCCN(S(=O)(=O)c3ccc(F)cc3)C2)n1 762991669 VZOYYBWHNBIFRA-CQSZACIVSA-N 498.558 0.925 50 20 JCGD Cc1nnnn1/C(=C\c1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 818373604 JVJVDVBEESHMIP-NXIIHZOPSA-N 482.428 0.649 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C\c1cnn(C)c1)c(=O)n2Cc1ccccc1 901387791 RFJKAFCAEGAORW-KTKRTIGZSA-N 476.497 0.022 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3nnc(O)c4ccccc34)CC2)c1 919805735 KTVHPMXDWWDYNC-UHFFFAOYSA-N 484.538 0.557 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CCCN3C(=O)CNC3=O)c2)cc1 920193020 TZKNIILAIOOWPH-UHFFFAOYSA-N 489.510 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Cc1cccc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cnccc5C(=O)NN)C4)C3)[nH]c12 1836854457 IAQFWBPAPPMFNU-VWLOTQADSA-N 492.536 0.859 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccs3)C2)C1 1837457963 YTLQKGLONRNMOZ-OAQYLSRUSA-N 459.528 0.059 50 20 JCGD Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c(O)n1 1837921128 CLYJELIGRGIXRU-UHFFFAOYSA-N 467.331 0.701 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838418061 TZTCMWWJCHXBTF-BFUOFWGJSA-N 499.387 1.000 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc(O)c4ccn(C)c34)CCO2)C1 1838439706 IKOOLQCJIDXTKP-HRAATJIYSA-N 466.922 0.603 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN(C)C(=O)C(=O)O)CC2)CC1 1838729140 OXONSLCLQVNVNE-GFCCVEGCSA-N 462.341 0.311 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)n[nH]1 1839054221 MCGJXUUJAIZTGU-XMMPIXPASA-N 499.572 0.134 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(Br)CC1)CCO2 1839207736 YSVXCGUYJWVDQX-IXOWOOARSA-N 496.362 0.504 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c1 1839292824 AQBPPZBCIICIID-JOCHJYFZSA-N 466.510 0.277 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)NCCC#N)C2)C1 1839963843 YEYGRSBQUPEDDB-HNAYVOBHSA-N 459.385 0.898 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840110941 NAIOOUSXSCMGFA-BEFAXECRSA-N 473.935 0.743 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1 1840155166 RONVBLOWCRDPQY-LIRRHRJNSA-N 457.867 0.624 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840188220 XQZPRUKALUWAFC-YRVVQQKDSA-N 496.388 0.617 50 20 JCGD CN(CCCOc1ccc(S(C)(=O)=O)cc1)C(=O)NNC(=O)CNC(=O)c1ccco1 725870917 UYSWWWXMEAJIAK-UHFFFAOYSA-N 452.489 0.555 50 20 JCGD O=C(NCc1ccc2c(c1)CCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 726271985 AZBFNTPPATWTSO-UHFFFAOYSA-N 460.512 0.787 50 20 JCGD COC(=O)CCn1nc(C)c(C=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1C 727057661 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COc1c(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc(F)c1F 1783935496 VEEVUWNXMLFTOB-OAQYLSRUSA-N 454.474 0.790 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1783936333 GHESILLEBWNOIC-HSZRJFAPSA-N 494.614 0.226 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783940146 SAIKPLSGYDCUPE-ZHRRBRCNSA-N 469.583 0.493 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)CCOC1 1784091991 BRQDYOYZNDFNAS-GVZUZGFXSA-N 475.970 0.250 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3COc4ccccc4O3)[C@H]2C1 1785039751 HGKMGCFGWPGHAE-XWIOLROMSA-N 481.509 0.118 50 20 JCGD CC(=O)Nc1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1788188584 QCHZIRDFELLCCO-VJBMBRPKSA-N 479.342 0.161 50 20 JCGD CCOc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1O 1790233436 MPCKUZLEQJCJMC-LRQRDZAKSA-N 468.315 0.378 50 20 JCGD COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1F 1792107092 QKIVRYFRYJWVHH-IXDGSTSKSA-N 471.489 0.740 50 20 JCGD Cn1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n1 1794788520 KBOGQDJYDZXFFM-XRGAULLZSA-N 455.943 0.755 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)n1ccccc1=O)C2 1796441374 DNJJSAZVAVVHSP-NVJZRXKYSA-N 468.514 0.133 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1csc2c1c(=O)n(C)c(=O)n2C 1799064597 RRTQTUVWIAMGNK-LOUJCGABSA-N 482.990 0.448 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc2c[nH]nc12 1799918268 UDOFEPGHCCUXGR-CWPLJXCYSA-N 463.498 0.387 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2 1800754375 NBIFYXGFPARBNX-BONHGPHZSA-N 482.375 0.539 50 20 JCGD C=C1C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)N(C(=O)OC(C)(C)C)C1 1801102053 ZHOMJQDQCVWGQX-QEOTZNIISA-N 457.955 0.741 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1(C)CN(C(=O)OC(C)(C)C)C1 1802221792 BHRBPOMVNXRBJW-UPHUGPLXSA-N 495.621 0.596 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1802246506 ZEQALZZDSVZQSZ-UXDQUXDASA-N 455.515 0.692 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)C(O)O)[C@H]1c1cccnc1 1802923413 OYKFVUYMVJIWEV-RDTXWAMCSA-N 458.427 0.545 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)cc1 1805163607 XWMWLSRVKKBRIN-JOCHJYFZSA-N 466.343 0.953 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1805307399 FYUCWPQTRMOMSC-JXFKEZNVSA-N 457.535 0.516 50 20 JCGD CCOC(CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)OCC 1807363709 BDPQNOAKRFVDBJ-XXBNENTESA-N 469.347 0.870 50 20 JCGD CCN1CCC(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1807363834 FSBJDPBZVJAFTF-JTHBVZDNSA-N 464.375 0.813 50 20 JCGD CCCNC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807363922 GGBWQUSZYYWVOU-XXBNENTESA-N 466.347 0.387 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc3c(c2)CCNCC3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372640 HEZWUIDBCQMCIW-SQJMNOBHSA-N 499.380 0.478 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)N1CCN(C)CC1 1807878279 OSPXCKWAHOYRCY-RFWXGWTQSA-N 473.622 0.096 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cc2cncnc2)[C@@H]1c1cccnc1 1810295694 VRMZQQGDPBLYEV-DYESRHJHSA-N 460.498 0.432 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n(C)n1 1810926309 VHNNCQOIOBQTKW-AVRDEDQJSA-N 461.331 0.691 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CC[C@H](N)C(N)=O)[C@H]1c1cccnc1 1812777383 SAHXKTZDJKRCRH-JKQORVJESA-N 454.369 0.854 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1 1814403353 QOTRMYYJNITMFD-COMDQNFDSA-N 457.516 0.468 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)N2CCCC2)[nH]n1)c1ccc(B(O)O)cc1 1817470546 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C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4c3OCO4)C2)C1 1830543109 KEBFNNHUKDNOBG-BFUOFWGJSA-N 470.320 0.911 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c(Cl)c1 1832535514 NRVLZWZSANGQPJ-YLJYHZDGSA-N 461.342 0.947 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549386 KRMBTPAAAZXIFV-HOIFWPIMSA-N 487.981 0.613 50 20 JCGD O=C(c1cccc(OCC(F)(F)F)n1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833425494 SQFRSWQYAFRPLS-RDTXWAMCSA-N 481.855 0.692 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnsn3)CCO2)C1 1833532284 VUJZTQKSRZLFGR-HXUWFJFHSA-N 491.482 0.755 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cncc(S(C)(=O)=O)c3)CC2)CC1 1833942353 KEEKWZLCAGZSBF-LJQANCHMSA-N 487.022 0.924 50 20 JCGD Cn1ncc2c(C(=O)N3CCC(N4CCC(NC(=O)c5ccc(B(O)O)cc5)CC4)CC3)cccc21 1834798682 XMBHBCSGWQMWQM-UHFFFAOYSA-N 489.385 0.752 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)cn1 1834821400 ICSWCAOYVJWWSK-IBGZPJMESA-N 470.320 0.723 50 20 JCGD O=C(C#CC1(O)CCCCC1)N1CCOC[C@]2(C1)CN(C(=O)CCBr)CCO2 1834823525 ZXLLPWSBJNFQEC-FQEVSTJZSA-N 457.365 0.926 50 20 JCGD CN1CCN(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)CC1 1835402344 BDVKZBJVDXUELP-PMACEKPBSA-N 465.422 0.317 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc2[nH]ccc2n1 1835552543 MXHQGDBJRIVBOY-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CNc3ccccc31)CCO2 1835722626 PHWCFRLDMBPQBR-JPYJTQIMSA-N 459.547 0.025 50 20 JCGD COc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1835921899 OLXGAENKXQGSRL-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(CO)o3)CC2)CC1 1835927649 CLJOWGIVJVDHOH-UHFFFAOYSA-N 470.530 0.269 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1835933558 BWIRJKWBRMNTIA-RCSZBHJWSA-N 490.365 0.558 50 20 JCGD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1836525910 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Cc1nccn1[C@@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922008 ARVAMZCRMSZEAG-KRWDZBQOSA-N 468.363 0.745 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)ncn1)CCO2 1838257433 WKOVBXYMZCZPHP-ODDBZWQPSA-N 489.920 0.334 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncccn3)C2)C1 1838527092 HCTUWYASMGZUSV-JOCHJYFZSA-N 485.453 0.694 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC3(F)F)C2)C1)NC(=O)NCc1ccccc1 1839054160 JEKYMIJTUGYGHL-AVRDEDQJSA-N 495.527 0.444 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C#CC3CC3)C2)C1)NC(=O)NCc1ccccc1 1839054312 SUDPRDZPIBGPBM-RUZDIDTESA-N 483.569 0.202 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839203442 LLQUIAKXTZPFST-YYFZDKIDSA-N 486.338 0.952 50 20 JCGD CN(C)C(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802040 KJVODNGQNKCIQQ-UTKZUKDTSA-N 482.375 0.537 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)ccc3-n3ccnn3)C2)C1 1840154698 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O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)COc1ccccc1[N+](=O)[O-] 15977805 YYPWSLYWGACEKW-UHFFFAOYSA-N 492.510 0.775 50 20 JCGD CC(=O)N1c2ccccc2C[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 726495942 YRZAGNSEKHRAJX-FQEVSTJZSA-N 472.523 0.446 50 20 JCGD C[C@H](CC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NC(=O)C1CCCC1 727098666 OMKWLIWINRMELR-QGZVFWFLSA-N 494.614 0.873 50 20 JCGD Cn1nc(C(=O)NNC(=O)CN2C(=O)COc3ccc([N+](=O)[O-])cc32)c2ccccc2c1=O 728000918 ZNMBBYQNWYBEGZ-UHFFFAOYSA-N 452.383 0.028 50 20 JCGD O=C(CCC(=O)N1CC(=O)Nc2ccccc21)NNC(=O)C1CCN(c2ncccn2)CC1 728845415 KIVKUKDPIDWMIQ-UHFFFAOYSA-N 451.487 0.606 50 20 JCGD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1 746352581 PTEZMSIJGWXEEB-UHFFFAOYSA-N 456.498 0.852 50 20 JCGD Cc1ccc(CCC(=O)NCC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1 749162019 UFMLADVBMQJVAM-UHFFFAOYSA-N 452.920 0.806 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc3nccnc3c1)c(=O)n2Cc1ccccc1 789855229 DDTRAUBDCQNUQA-UHFFFAOYSA-N 498.503 0.832 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CNC(=O)c2ccc(Br)o2)cc1OC 802265201 AYWLGPUKWSSCEN-UHFFFAOYSA-N 484.259 0.794 50 20 JCGD C[C@@]12CCC(=O)N1[C@@H](C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N3CCOCC3)cc1)CS2 863950037 MQILDOYSKXVZIY-DYESRHJHSA-N 496.611 0.242 50 20 JCGD Cc1c(/C=C(\C#N)C(=O)OCC(=O)N(C[C@@H]2CCCO2)[C@H]2CCS(=O)(=O)C2)cc(C#N)n1C 913286747 HHRPRRIVDQONEV-PEDKEWBOSA-N 474.539 0.850 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)COc2ccc(C#N)cc2)o1 915188316 AWHMHUSABVCYIT-INIZCTEOSA-N 490.494 0.707 50 20 JCGD CCOc1ncccc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916400599 NVEOAKPPSCTNFB-UHFFFAOYSA-N 463.516 0.645 50 20 JCGD COCCn1c(C)cc(/C=C(/C#N)C(=O)N2CCN(S(=O)(=O)c3ccc(C(N)=O)o3)CC2)c1C 918567975 HOFZAMHSIRRVHE-AQTBWJFISA-N 489.554 0.883 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)CC2)cc1C 919885668 QASHZJPCBPNGEF-MRXNPFEDSA-N 472.589 0.222 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374670 BNLJNJMRHBJTEH-JXXFODFXSA-N 453.927 0.066 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cccn(C(F)F)c1=O 1779582590 IGZVAAJRABTJQL-WZONZLPQSA-N 489.284 0.365 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc([N+](=O)[O-])c1OC 1782116869 SETKNYXNOKGCIY-HSZRJFAPSA-N 499.285 0.049 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@@H]1O)CCO2 1783874532 ILTQPAZCRYBTMB-DOWNOZBLSA-N 489.997 0.688 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)CCO2)C1 1783880441 INSJXNIYVAEWGF-AVYPCKFXSA-N 463.959 0.346 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCSC(=N)N)[C@H]2C1 1786849090 ORNATYWQKSVPBS-HVEJOWRVSA-N 463.564 0.117 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CCc4sccc4C3)C[C@@H]21)c1cccc(B(O)O)c1 1786983707 UYBPSLOGBWWOKE-JBACZVJFSA-N 483.399 0.080 50 20 JCGD Cc1cncc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788611526 JOKIBWOLHQJJRH-YYWHXJBOSA-N 466.542 0.615 50 20 JCGD C[C@H](C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1)[C@@H]1SC(=N)NC1=O 1788634267 PXBLMMOILMTQDE-UGSOOPFHSA-N 480.355 0.917 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21 1788638576 DRLGSCBNMXJVBM-QZXGQWDYSA-N 463.325 0.244 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21)[C@@H](F)Br 1789922797 TYIDPVQKWMNGMA-YLHIVMMESA-N 487.326 0.663 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3c(C)n[nH]c3C)[C@H]2C1 1789975078 BRDQKGJWMZOPPU-ZCQORZAUSA-N 469.546 0.683 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc2nscc12 1790451481 GOOYOEAGGDCTNU-XERREHJYSA-N 465.340 0.883 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCN1C(=O)c2ccccc2C1=O 1793869056 MXYGLGNUNFIFML-GPVSGQMNSA-N 499.568 0.025 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccnc1 1794870322 IRCFXWRHEIKPPK-YVWYUNDQSA-N 457.443 0.620 50 20 JCGD COc1ccc(OC)c(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1 1795734391 GHJAQRSEALKZSW-NHKMSHSESA-N 482.342 0.220 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)n(-c2ccccc2)n1 1796475171 VCWHZXVGGRZNTC-FEJSZKPUSA-N 468.558 0.757 50 20 JCGD COC(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1799249969 WWUXFPNZYCPNMI-JRBZFYFNSA-N 491.969 0.022 50 20 JCGD CC(=O)N[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1800531705 BMVOFTKGPQWYOV-AONVYAMJSA-N 462.459 0.248 50 20 JCGD COc1cccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1800681613 MNDQRJDRFLBKPD-OOYNOFMQSA-N 450.300 0.292 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC 1800982783 KPUPWVJUXPWAGM-ZHCJQAHYSA-N 457.955 0.746 50 20 JCGD CCCNC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1803439395 KCSLOYIZQQWUOI-WMZHIEFXSA-N 466.347 0.387 50 20 JCGD Cc1nc(O)c(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nc1C 1804874163 OUTSLEVEHDGKGT-UZLBHIALSA-N 490.524 0.826 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1805147425 SQUWKVMJSJMONV-PXNSSMCTSA-N 465.294 0.576 50 20 JCGD CC(C)(NCCC#N)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807144765 ANVCPFNUYJCZTN-CTNGQTDRSA-N 463.347 0.363 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1 1807357413 GJXQVAMWQOIHCW-DNVCBOLYSA-N 469.578 0.984 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1C 1807360436 KOYNXEAWCBRHJQ-DYESRHJHSA-N 463.303 0.137 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cn2cc(Cl)cn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363730 NQWKLTAPCADDKQ-UTKZUKDTSA-N 467.722 0.631 50 20 JCGD N[C@H](CC(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccnc1 1807364221 PIWGWVBCLOXPNS-KIFXHHALSA-N 473.342 0.566 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnc3ncccn23)[C@@H]1c1cccnc1 1810302214 IEXQVIVEYGDWHS-OXQOHEQNSA-N 485.508 0.756 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1n[nH]cc1[N+](=O)[O-] 1810631229 FCHCCCRDGDZUTJ-DNVCBOLYSA-N 464.247 0.026 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc2cccnn2n1 1811267335 OTZGRWDFUQBIIR-GCJKJVERSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnc2snnc2c1 1811338113 AOYSTAHXHNKLRX-OXJNMPFZSA-N 488.338 0.795 50 20 JCGD CN(C)c1ncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)o1 1815355681 YKCQGCNZSGKVEK-ZDUSSCGKSA-N 455.305 0.417 50 20 JCGD Cc1nc2ncccn2c1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1818391828 NJGYQCLKJMMRGW-HNNXBMFYSA-N 476.327 0.714 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccc2nncn2c1 1819175370 OLYZCOHOIBIEEU-OAHLLOKOSA-N 462.300 0.405 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnn2c1OCCC2 1821429636 GPPXSARWCKHTLN-SFHVURJKSA-N 464.291 0.688 50 20 JCGD O=C([C@H]1CCCS1(=O)=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053435 OKIKCBKWQKNEJQ-WOJBJXKFSA-N 462.377 0.177 50 20 JCGD C[C@H](O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551136 KCZYOXUDSPYCNP-HZUJVAHNSA-N 453.923 0.419 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)nn1 1830543473 SPVFDBVZTVYZIT-ACJLOTCBSA-N 457.325 0.586 50 20 JCGD O=C(c1cccnc1OCC1CC1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724842 IQOYFCMPQRQOOM-UTKZUKDTSA-N 453.923 0.540 50 20 JCGD CC(C)[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830737404 HHEPPKOACOLLHV-JKSBSHDWSA-N 492.013 0.982 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C[C@H]2C[C@H]21 1830737674 GOKFUKDRCFAPKR-NZYYMUPHSA-N 487.981 0.440 50 20 JCGD O=C([C@@H](O)CCl)N1CCC([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)CC1 1831189426 ORHWLEZVMLSHTC-RDJZCZTQSA-N 454.911 0.976 50 20 JCGD CNC(=S)NCCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873814 ZETIFRNKYNPNTI-QGZVFWFLSA-N 454.641 0.463 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(Cl)cc1)CCO2 1835062345 ILNWWGURLAZUHB-QFIPXVFZSA-N 466.966 0.712 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc4nonc4c3)CC2)CC1 1835320801 FRXHTQAWUGYOSB-UHFFFAOYSA-N 492.540 0.720 50 20 JCGD CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1836006143 KGNKTVBPDDEJGF-UHFFFAOYSA-N 494.600 0.645 50 20 JCGD CN(CC(=O)NC1CCN(C2CCN(C(=O)C(=O)C3CC3)CC2)CC1)NC(=O)NCc1ccccc1 1836343497 FPXHHIUULOCIFB-UHFFFAOYSA-N 498.628 0.883 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3c(c1)CNC3=O)CCO2 1837150505 QSKOXBSIKUWKCM-JOCHJYFZSA-N 461.591 0.852 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(F)cc3)C2)C1 1837459269 AVEFUEBZTMWZHJ-JOCHJYFZSA-N 457.462 0.208 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)C3Cc4ccccc4C3)C2)C1 1837461986 KIWATKSUMSLBFQ-VWLOTQADSA-N 479.537 0.170 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1cccn1 1838395332 DSJRATXLGWBDFI-MRXNPFEDSA-N 469.546 0.755 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccccc3C(=O)OCCO)CCO2)C1 1838569050 QDEWDVMXYRNNLB-AVRDEDQJSA-N 468.934 0.923 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C2)C1 1839141941 YOVKIAVPTGOLHH-GCKMJXCFSA-N 477.986 0.736 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](F)Br)CCO3)C2)cc1 1839197409 UKRHAMVYGPUCBS-FCEWJHQRSA-N 475.311 0.876 50 20 JCGD O=C1Cc2cccc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)c2N1 1839202314 AILWPWGVGAJXSL-APWZRJJASA-N 470.295 0.942 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4ccc(C#N)cc34)CCO2)C1 1839489168 OSUXEECUAWWNLJ-IERDGZPVSA-N 461.906 0.758 50 20 JCGD NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1839865619 MTCXZILHLAAYRU-DYESRHJHSA-N 482.375 0.715 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)CCO2)C1 1840772202 GIXGYIBHGVTCKY-QRWLVFNGSA-N 492.953 0.553 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1841777709 YTAZTOKQEKWJJC-IBGZPJMESA-N 471.363 0.973 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](C)[C@@H]1SC(=N)NC1=O)C2 1843416039 RVFLYIKTZCDVNG-KVZYJFTKSA-N 459.532 0.126 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(c2)CCN3S(C)(=O)=O)cc1OC 104901614 DJAVQISNXIZBAD-UHFFFAOYSA-N 477.495 0.644 50 20 JCGD O=C(NNS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2)C1CCN(c2ncccn2)CC1 728854165 OFCWKDNJQCGGFF-UHFFFAOYSA-N 464.460 0.382 50 20 JCGD O=C(CN1CCN(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1)Nc1ccc(F)cc1 728959525 NJQNUDFOIBCPKX-UHFFFAOYSA-N 484.536 0.829 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)N1CCOCC1 745996164 PEXNHWAHVAHYFE-CQSZACIVSA-N 495.421 0.922 50 20 JCGD Cn1cc(S(=O)(=O)NCC(=O)NNC(=O)[C@H]2Cc3ccccc3CN2Cc2ccccc2)cn1 747778065 ANFDOQWABLAWKF-OAQYLSRUSA-N 482.566 0.473 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)c2ccc3c(c2)OCO3)c1 749561470 RJCQSIZASGWCDU-KRWDZBQOSA-N 488.522 0.731 50 20 JCGD CCCCn1c(CCC(=O)N2CC[C@@H](B(O)O)C2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 864232276 YUUMNOKPZWRAJK-QGZVFWFLSA-N 492.407 0.865 50 20 JCGD CC(=O)c1cccc(S(=O)(=O)NCC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)c1 913391912 OIZNJDNSSOVVSR-UHFFFAOYSA-N 487.582 0.527 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc3c(c2)SC2=NS(=O)(=O)CCN23)c1 915077262 YBYWJENBLNUSTP-UHFFFAOYSA-N 480.549 0.776 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2ccc(N3CCO[C@@H](C)C3)nc2)cc1 916392743 JTLFRSCZOPSXKZ-KRWDZBQOSA-N 490.586 0.766 50 20 JCGD Cc1nnnn1[C@@H](Cc1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 917270826 CAIDJAPAZMFAHB-QFBILLFUSA-N 484.444 0.435 50 20 JCGD COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 917719307 DEMBWRCOBXYUSD-UHFFFAOYSA-N 458.474 0.477 50 20 JCGD C[C@H](NS(=O)(=O)c1cccs1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 917909156 NKYDFKQINVFREY-NSHDSACASA-N 460.559 0.126 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1OC 919128395 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O=C(Nc1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1)C1CC1 1781466671 NWCXOFKTXZLZOF-VWLOTQADSA-N 477.326 0.472 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2 1783348338 YWWJIAOBQPSMNJ-CKFHNAJUSA-N 478.384 0.875 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783932768 DQQNOGTXTRMRPR-YCRPNKLZSA-N 455.556 0.103 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(Br)cc1O)CCO2 1783935478 UVZIFOWBUGLEHS-HXUWFJFHSA-N 483.363 0.971 50 20 JCGD N=C(N)NCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)Cc3ccccc3)C[C@@H]21 1786808102 ICIDBBJGDPPNDL-NXOAAHMSSA-N 466.380 0.455 50 20 JCGD Nc1nc2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)ccc2s1 1786979838 LJDYDINZWNUPTN-IEZWGBDMSA-N 480.355 0.465 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)nc2ccccn12 1786979878 UZXCOLIYBXQKPD-IHPCNDPISA-N 462.315 0.230 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cc(C)n(C)n3)C[C@@H]21 1787506753 LKJAVPWCOIXRLO-PEMCSMIHSA-N 469.546 0.385 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1 1788609809 LIOPUDJZXRBETQ-YYWHXJBOSA-N 495.536 0.769 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(N(C)C)ccc3[N+](=O)[O-])[C@H]2C1 1789232821 QOYQOISHPLCHGN-QSFXBCCZSA-N 490.561 0.627 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790755012 NAUBZKAHIHPJFJ-LRQRDZAKSA-N 485.277 0.250 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4cccnc4n3)C[C@@H]21 1791291544 XQVOIVQECCAQNU-LNLFQRSKSA-N 454.531 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4c(c3)CCO4)C[C@@H]21 1791293043 GSKFSSZNSDGFLG-ZJOUEHCJSA-N 458.559 0.517 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@]3(O)CCN(C(=O)OC(C)(C)C)C3)[C@H]2C1 1791332522 DTPCXKJQJMOYKQ-JUPXILGHSA-N 489.997 0.592 50 20 JCGD 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C[Si](C)(C)OCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1 1801443325 IMWLEUIQEAACFF-BQJWPVKWSA-N 482.679 0.656 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@]12C(=O)Nc1ccccc12)c1cccc(B(O)O)c1 1801971297 VOWCBZHENDKQMZ-UFZBXBPUSA-N 459.311 0.528 50 20 JCGD Cc1noc(C)c1CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804246441 ZNZGGPWOLCRHLU-WMZHIEFXSA-N 462.315 0.929 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)NC[C@@H]2CCN(C(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)c1 1804884603 LBQASZZRLHZZHT-WBAXXEDZSA-N 466.947 0.799 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(=O)c1ccccc1 1806236255 NOWDGHJZJSMXCZ-IRLDBZIGSA-N 457.295 0.964 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371017 OCJHARFESPPDHY-QPPBQGQZSA-N 496.336 0.976 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2n[nH]c3c2CS(=O)(=O)C3)[C@@H]1c1cccnc1 1807742560 KRGBQUMSNVLCOG-YEWWUXTCSA-N 481.962 0.807 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1 1808278398 KGXFFZUIFQIAKL-WXHUCPAQSA-N 492.496 0.736 50 20 JCGD COc1nccnc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810297859 FKCNTWFCCDWDFE-HNAYVOBHSA-N 476.497 0.512 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnc(N)s2)[C@H]1c1cccnc1 1810303397 RMHPNFHTMLFJKT-DYVFJYSZSA-N 466.527 0.752 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1810549233 ZBSHMVJESOJHCV-WIYYLYMNSA-N 452.628 0.226 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnn3c2CCC3)[C@H]1c1cccnc1 1813072293 FCAIHPROBWACPV-JTSKRJEESA-N 453.547 0.917 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)COc2ccc(O)nn2)[C@H]1c1cccnc1 1813073345 IRYRCTWDTDTISG-ZHRRBRCNSA-N 471.518 0.035 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813408050 UOOLGPRBKXKKPF-XTQVGHSUSA-N 474.326 0.944 50 20 JCGD O=C(CC(F)(F)C(=O)O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815341250 URPVZDGROGVDNT-NSHDSACASA-N 453.232 0.159 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344230 OWVVEBTYAWMHKH-SWLSCSKDSA-N 466.332 0.339 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)N1C[C@@H]2C[C@H]2C1 1817476693 ZIDHPWKJRUDDQX-HSSOGYSNSA-N 451.336 0.736 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401697 OIXMKROLCIHVHY-MLGOLLRUSA-N 477.547 0.395 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc4cccnn4n3)sc2C1 1821164855 WFRXGOWPLGRGJA-NSHDSACASA-N 477.510 0.724 50 20 JCGD CCOC(=O)C1(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)CC1 1824860428 SMXZLQFLONZHMG-AWEZNQCLSA-N 457.317 0.392 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923575 MTLXAXQXCIJICG-KXBFYZLASA-N 458.563 0.833 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2ccncc2=O)CC1 1828924619 VQUFTNKZSRCYJI-IBGZPJMESA-N 467.530 0.175 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc3n(n2)CCNC3=O)CC1 1828925651 OKGALBAZXRCWBR-IBGZPJMESA-N 494.556 0.172 50 20 JCGD CCOc1ccsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1829551650 OKZSHOWQZBTHAI-JOCHJYFZSA-N 474.344 0.210 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CC1)CCO2 1829839695 MRMPZABHWVDKFL-DEOSSOPVSA-N 464.327 0.168 50 20 JCGD COc1ccc2c(CC(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c[nH]c2c1 1830719818 LKFPLKLPRFNLOL-SIKLNZKXSA-N 465.934 0.775 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2n1 1830727822 GXMOREVOQRXDDP-JXFKEZNVSA-N 451.911 0.016 50 20 JCGD O=C1CSc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)ccc2N1 1830728615 WHTBMGCOFHAOME-MGPUTAFESA-N 469.947 0.401 50 20 JCGD O=C(Cc1cc(F)ccc1Cl)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832267837 AKZAOLFOYPEMEN-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCCN(Cc3ccccc3)C1)CCO2 1832302467 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Cc1cc(F)cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835933626 DRDWIWVBRROLTP-XMMPIXPASA-N 470.306 0.127 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cccnc34)C2)C1 1835937478 ZCKUOYBSAFNBLC-VWLOTQADSA-N 475.310 0.298 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1 1836399641 HTRWCUANWOQUFK-BEFAXECRSA-N 467.394 0.859 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1 1836850287 KNEIKMWHAPYVSA-HNAYVOBHSA-N 466.336 0.973 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccn3cncc3c1)CCO2 1837078861 XYAYSLOIIXWGIH-FXZATJRASA-N 493.524 0.538 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)c3ccccc3)C2)C1 1837456633 OZSMUGKGLZVGSU-XXBNENTESA-N 471.489 0.466 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)s1 1837457090 VQLVKZAXMBPDNS-HSZRJFAPSA-N 487.582 0.758 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)no1 1837548037 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C[C@H](CC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1839928538 HOAVDNRFWARPIC-KBMIEXCESA-N 466.343 0.630 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1 1840035543 VKVCROSZICLKEU-AHIWAGSCSA-N 451.314 0.788 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(C(F)(F)F)cn3)C2)C1 1840151981 SWEMHCHIEKOIEQ-SJKOYZFVSA-N 466.844 0.819 50 20 JCGD CC(C)c1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)on1 1840185929 WNLNRHBAARENHB-OAQYLSRUSA-N 451.524 0.241 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012331 DINKMMHLYZYMIB-UHFFFAOYSA-N 455.301 0.884 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2cccc(C(F)(F)F)c2)CC1 15639616 ANXQPJAHOSJALV-CYBMUJFWSA-N 497.517 0.688 50 20 JCGD O=C(NNc1ccc(S(=O)(=O)NC2CC2)cc1)c1sccc1S(=O)(=O)N1CCOCC1 726862328 JOFJOODKJCYHJM-UHFFFAOYSA-N 486.597 0.967 50 20 JCGD Cn1ncc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1C(F)F 727292611 DYGFVLAJKDAYNA-UHFFFAOYSA-N 471.486 0.772 50 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50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)Cc3cncnc3)CCO2)C1 1780095176 IMHSPKBILWOALS-QFIPXVFZSA-N 469.454 0.996 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(OCCCO)cc3)C2)C1 1780126583 NRMQZWLZOVKFBK-QHCPKHFHSA-N 462.547 0.264 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCS(=O)(=O)CC1)C2 1780707561 SKFVSHUDAJWBLQ-ATZDWAIDSA-N 484.446 0.467 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CN3CCCCC3)CCO2)C1)NC(=O)NCc1ccccc1 1780970007 QFVAXBDKWICBBZ-RUZDIDTESA-N 486.617 0.648 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1781229994 MDLJTXOPSSRIPO-AGRHKRQWSA-N 458.346 0.661 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1781232756 XUPKTCWTFGDZOE-RTBURBONSA-N 475.398 0.958 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1 1782213221 FFPXMDMBCUZDMM-VGOFRKELSA-N 452.552 0.383 50 20 JCGD CN[C@@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1)C(=O)O 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Cn1c(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc2c1-c1ncccc1OC2 1843011011 FTFMSKVCMYSXCK-UHFFFAOYSA-N 472.310 0.790 50 20 JCGD COCCOCCOCCOCC(=O)N1CC2(CCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1843417061 RPSYZHQYWRKRHI-XIEYBQDHSA-N 493.561 0.020 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)C1 1847290944 SWXZIUAMIDLKSW-PEKRRXIPSA-N 499.373 0.065 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cc1OC 8630902 POTAYECIWIODID-UHFFFAOYSA-N 499.929 0.982 50 20 JCGD COc1ccc(C(=O)O)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 13359266 CKYAYMFGRSMUIP-UHFFFAOYSA-N 457.486 0.267 50 20 JCGD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)C1 15639460 AINPLPMPVJNRHK-IIAWOOMASA-N 457.574 0.549 50 20 JCGD O=C(NNC(=O)[C@@H]1COc2ccccc2O1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12 18017736 BBBYTEVOPBQAKT-HNNXBMFYSA-N 460.493 0.899 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CN1C(=O)COc2ccc([N+](=O)[O-])cc21 21967370 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464.548 0.861 50 20 JCGD CCCS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)CC1 916384003 ZZDQCVKMNZZXPN-UHFFFAOYSA-N 474.609 0.436 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCOc3cccc(F)c3)nc2)CC1 916635055 YKKFDXLIXZSAEE-UHFFFAOYSA-N 452.512 0.862 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)Nc2ccccc2)cc1)N[C@H]1CCS(=O)(=O)C1 919883819 CYZIQYQGNLIILE-HNNXBMFYSA-N 452.514 0.619 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCc3ccccc3C2)c1)N[C@@H]1CCS(=O)(=O)C1 919885587 MMOWFWHGAZPQJO-GOSISDBHSA-N 492.579 0.565 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN3CCN(C)CC3)C2)C1 1778261775 KXKRLJBQFOVYDW-HSZRJFAPSA-N 489.529 0.211 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3cc(C)on3)C2)C1 1779129921 HPNVYUVHMIARSE-KXMDNYRPSA-N 454.487 0.960 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1COc3ccccc3O1)C2 1779371302 MYDDGKATDGWSPU-BPYKYCOYSA-N 495.536 0.653 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nccnc2C(N)=O)C1 1779937259 YUVJBTVZFZHXOP-VLXJIEOASA-N 468.352 0.734 50 20 JCGD CN1CCCn2nc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)[C@H](O)CCl)C4)cc2C1 1781428563 CXVFJCQWFNKDKX-DBXWQHBBSA-N 453.971 0.446 50 20 JCGD Cc1cn(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@@H](C)Br)C2)c(=O)nc1O 1782001287 CIHCYJLETDQYKZ-PJIJBLCYSA-N 471.352 0.555 50 20 JCGD Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cn1 1785260881 SYEAHNKCKJJTDC-BVSLBCMMSA-N 451.332 0.296 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1 1787449458 PYBXQCGIIZOROF-SBJFKYEJSA-N 451.923 0.776 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCCN1C(=O)c2ccccc2C1=O)c1ccc(B(O)O)cc1 1794126612 RXRCEVZXWQGISW-ACDBMABISA-N 489.337 0.695 50 20 JCGD Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Cl)C3)n(-c2cccc(=O)n2C)n1 1795933627 VWPSNJIYKFWAGS-GGNLRSJOSA-N 451.886 0.617 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C1 1796361426 QEJQIBKFJSGXDJ-AENRVVEGSA-N 475.945 0.994 50 20 JCGD CO[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN)c1ccccc1 1797750427 BZUFJYKYMLWDEX-JSJNYSNDSA-N 453.499 0.276 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3ccccc3O1)C2 1797754480 YUMINLFUHIYJKX-GQSCTRQFSA-N 465.510 0.282 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)cn2[nH]cnc(=O)c12 1798467681 PUVNKYBOJNTFNU-IQOUGMIPSA-N 456.272 0.225 50 20 JCGD CCNC(=S)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798523148 TXDBREMIHFRMQV-HBCWATKFSA-N 493.542 0.207 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1O 1799198596 WNJJQXRECKXHCZ-IATJYDTKSA-N 490.395 0.587 50 20 JCGD C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1799231619 IMJMEEAUMWYYLY-RZFLPCETSA-N 471.982 0.873 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799865678 HWKQKSNPRQNCBP-FJSXSUQBSA-N 482.585 0.829 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359694 BVWFHFIPIBUQMO-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359927 FSDKDKXWZGKNPL-PXNSSMCTSA-N 474.282 0.519 50 20 JCGD COc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1807360972 DGPSWIGTOSCABC-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD CC1CCN(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1807361336 WTZBKVSXIKNVRQ-XUZZJYLKSA-N 464.375 0.813 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372864 JTIVJQYCVULYDO-WZONZLPQSA-N 475.314 0.209 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C1(O)CCC1 1810294271 JBWMFROHFYRJKS-MDYRTPRTSA-N 466.542 0.951 50 20 JCGD Cc1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)c(=O)[nH]c1C 1822410309 FDBNTJYWYJJRKK-OAHLLOKOSA-N 458.523 0.789 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H]2CCNC(=O)C2)n[nH]1 1822482382 VOIMRRQXIGGYSF-BLLLJJGKSA-N 454.491 0.240 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055915 NYXLCLYOGFITSM-VFCOFNOGSA-N 453.348 0.458 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1828128857 YPQKAIYEYSFYQY-DOTOQJQBSA-N 458.349 0.354 50 20 JCGD CNC(=O)CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](Cl)COC)C2)C1 1828578787 ALWKDXDLXNQLMV-FDDCHVKYSA-N 494.976 0.828 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737486 FFZXBBAMDGNXLQ-AVYPCKFXSA-N 463.959 0.346 50 20 JCGD CC1CCN(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)CC1 1831107639 PJKALGPKMWQIEX-SJLPKXTDSA-N 450.349 0.865 50 20 JCGD Cc1c(C(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)cn2[nH]cnc(=O)c12 1831873762 WNINNUCLSMKWAE-LJQANCHMSA-N 485.589 0.937 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1 1832147646 DGEZESAEXOYTBG-GOSISDBHSA-N 457.365 0.510 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)CCO2 1832360454 UKDZZTPPDRNFSP-NRJQMVOHSA-N 471.982 0.488 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CC[C@H](N)C(N)=O)CC2)CC1 1833263156 DHBWFWSFXQVGFR-BBRMVZONSA-N 460.417 0.182 50 20 JCGD O=C(c1cnc(-c2ccccn2)nc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833289770 ZPPVCBBEGPPRSB-UTKZUKDTSA-N 461.906 0.208 50 20 JCGD COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c(F)c1 1834007023 PNFLOIUGOLPGDN-UHFFFAOYSA-N 499.547 0.727 50 20 JCGD Cn1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n1 1834241335 BKWKIOHBZAWUQI-HRAATJIYSA-N 485.969 0.622 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C)CC1)CCO2)NC(=O)NCc1ccccc1 1834625892 VGFVSHQQQNFSTM-XMMPIXPASA-N 473.574 0.589 50 20 JCGD CO[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1834925820 YAPAJVWELCPITM-YKSBVNFPSA-N 483.525 0.143 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cccn2c(O)nnc12 1835044065 KRZDZXKRYQNUBH-MRXNPFEDSA-N 450.927 0.220 50 20 JCGD C[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)c1ccccc1 1835940165 XEYWGVREHNWKCI-UQBPGWFLSA-N 466.343 0.630 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1 1835990723 AIYQEUKSVKDVQG-QFBILLFUSA-N 457.369 0.983 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](F)Cl)CC2)CC1)c1cc(=O)nc2cccnn12 1836097729 GNIFYQWGVGNQRS-GOSISDBHSA-N 450.902 0.809 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccsc3)CCO2)C1 1836099636 KWNSGXQAOCSHRB-OAQYLSRUSA-N 459.528 0.059 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](N)Cc3cccnc3)CCO2)C1 1836505770 CWTKIXMVVDDTMG-SIXWZSSISA-N 455.353 0.191 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4ccccc43)C2)C1 1837460762 JZSXTMJJKILQRS-NBGIEHNGSA-N 479.537 0.485 50 20 JCGD CN(C)CC(=O)N1CCC(OC2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1837689062 WFEBFVWUCCGBRT-UHFFFAOYSA-N 488.633 0.893 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc4nonc4c3)CC2)CC1 1837920352 OIFLMPBYAPQOBZ-UHFFFAOYSA-N 478.314 0.829 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1)n1ccccc1=O 1838393949 DVJFBDZVLNTZMD-KRWDZBQOSA-N 496.568 0.720 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1 1838433817 BJEQJSKWTAFAIG-GUYCJALGSA-N 462.385 0.920 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C=CCN3)C2)C1 1838528177 JWPNGSAQDZBVJW-PGRDOPGGSA-N 474.470 0.118 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1839152180 PZARPZKKHKROME-MOPGFXCFSA-N 472.329 0.741 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1 1839203739 UXLBHXDPYJWIRN-KBXCAEBGSA-N 458.284 0.546 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Cc1ccncc1)CCO2 1839658753 NWXZLEZKPLKIAT-LVXIMFDESA-N 496.568 0.851 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839725401 HGIZEUPCNGRCMF-JGXQXMPLSA-N 494.353 0.549 50 20 JCGD Cc1cc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)ccn1 1840182415 IXLIUBRDXPJWMJ-HSZRJFAPSA-N 461.563 0.152 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CNc4ccccc43)C2)C1 1840184248 XNPVEBHQXXZASP-JPYJTQIMSA-N 459.547 0.025 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)C(=O)CC4)C2)C1 1840185770 XGIROKQWZSJKDS-XMMPIXPASA-N 472.542 0.259 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1ccnc1C)CCO2 1840491838 VPHGJYTVQQNGSY-LVPNSNHYSA-N 485.545 0.343 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)CCO2 1840606381 FAKOUFBMYOZNBN-MRNZGAJFSA-N 487.981 0.467 50 20 JCGD CC(C)(C)OC(=O)N1CCC(F)(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)CC1 1841078676 GEEAMEHZABFMDC-UHFFFAOYSA-N 489.353 0.923 50 20 JCGD Cn1c(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)cc2c[nH]c3nccc-3c21 1844664719 BUUGWMWKLCDBQT-UHFFFAOYSA-N 457.299 0.817 50 20 JCGD Cc1cc(/C=C(\C#N)C(=O)OCC(=O)c2c(N)n(C)c(=O)n(C)c2=O)c(C)n1C[C@H]1CCCO1 11245512 GXAIUGXBOBQRIM-JDZKTDJGSA-N 469.498 0.597 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC[C@@H](CN2CCN(c3ccccn3)CC2)C1 725871673 FCIPGYJPJLKURJ-SFHVURJKSA-N 469.546 0.679 50 20 JCGD O=C(Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O)NNC(=O)c1cnc[nH]1 725880227 ZLSVEHYYGDNCCR-UHFFFAOYSA-N 498.503 0.641 50 20 JCGD CN1CCN(Cc2ccc(CNC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)CC1 728947848 SBFIZBRMTGYYIR-UHFFFAOYSA-N 466.590 0.971 50 20 JCGD COC(=O)c1c(C)oc(C)c1S(=O)(=O)N1CCN(C(=O)NNC(=O)Cc2cccnc2)CC1 728957034 HBURWVBQPPIGGK-UHFFFAOYSA-N 479.515 0.368 50 20 JCGD Cc1noc(C)c1CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 730674324 KEWYGVGMDXCDMA-UHFFFAOYSA-N 479.559 0.818 50 20 JCGD O=C(Cc1ccccc1F)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 731359602 MTRJSIKHONGCJE-UHFFFAOYSA-N 464.523 0.246 50 20 JCGD O=C(CN1C[C@@H](C(=O)N2CCOCC2)Oc2ccccc21)NNC(=O)c1ccc([N+](=O)[O-])cc1 741753531 COKNBFPGKOQNKX-IBGZPJMESA-N 469.454 0.482 50 20 JCGD COc1ccc(Cn2ncc3cc(C(=O)NNC(=O)C(=O)N4CCCC4)cnc32)c(OC)c1 748240603 HPRCTSSXWUOEGU-UHFFFAOYSA-N 452.471 0.880 50 20 JCGD C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)C(=O)N3CCCC3)nnc12 748246530 CFBDBVIEVHTOBO-UHFFFAOYSA-N 455.500 0.092 50 20 JCGD C[C@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)CNC(=O)c3ccco3)ccc2Cl)C[C@H](C)O1 751207433 XIQRPHOAMVFMDT-STQMWFEESA-N 498.945 0.922 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCCN(C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)CC1 807134563 BXICXGJEQDUTLK-UHFFFAOYSA-N 489.518 0.018 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CNc3ccccc3)c2)CC1 849211989 IGIXFRAXVNEDGB-UHFFFAOYSA-N 459.528 0.413 50 20 JCGD CC1(C)CC(NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC(C)(C)N1 915882355 XIEOXKPEXGCMJN-UHFFFAOYSA-N 467.592 0.961 50 20 JCGD COc1cc(C(=O)NNC(=O)NCC2(NS(C)(=O)=O)CCCCC2)cc(OC)c1OC 916253736 JBYWREHUCLWEMB-UHFFFAOYSA-N 458.537 0.909 50 20 JCGD CCCCn1nc(C(=O)NNC(=O)NCc2cccc(S(N)(=O)=O)c2)c2ccccc2c1=O 916625002 ADRJTASJOCPIAX-UHFFFAOYSA-N 472.527 0.988 50 20 JCGD O=C(CCNC(=O)NNC(=O)c1ccc(Br)s1)N[C@H]1CCS(=O)(=O)C1 916636162 PQJYEFKPLKYFIX-QMMMGPOBSA-N 453.340 0.148 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc(Cl)nc3)CC2)cc1 917253612 FRYZMPKJVJOVQS-UHFFFAOYSA-N 451.936 0.811 50 20 JCGD Cc1nccn1CCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 918222643 CTGXULMSEHPZCB-UHFFFAOYSA-N 450.521 0.247 50 20 JCGD Cc1ccc(C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)c(O)c1 918337349 IUUDAXBUZVOHGU-MRXNPFEDSA-N 469.541 0.243 50 20 JCGD O=C(NNC(=O)c1cccc(NC(=O)[C@@H]2Cc3ccccc3O2)c1)N[C@H]1CCS(=O)(=O)C1 919884047 DLRCXMDQQLRRTG-WMZOPIPTSA-N 458.496 0.760 50 20 JCGD N#CCCn1cc(/C=C(\C#N)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(-c2ccccc2)n1 919887329 ZZMRIFMJQDZFLD-FYXHJSOBSA-N 467.511 0.888 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(C)on1)c(=O)n2Cc1ccccc1 920445177 QDVAZCDLJOTWNQ-UHFFFAOYSA-N 451.443 0.186 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnn2ccccc12 1778488301 KUNZDJUGGNNXHR-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD O=C([C@H](O)N1CCOCC1)N1CC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1779095599 JHENHEJSDIXNRY-CBQOVEMMSA-N 496.402 0.473 50 20 JCGD COCCOCCOCCOCC(=O)N1CCO[C@]2(CCN(C(=O)CO[Si](C)(C)C)C2)C1 1779301276 OCAYGVIGGOCFCW-NRFANRHFSA-N 476.643 0.364 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cncc(C(F)(F)F)c3)C2)C1 1779750137 IRKWLDIMXTUMGV-LJQANCHMSA-N 457.453 0.917 50 20 JCGD Cc1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn2[nH]cnc(=O)c12 1780019566 FRZLJVDEYYCIJE-GUYCJALGSA-N 456.272 0.465 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)C#N)CCO2)NC(=O)NCc1ccccc1 1780968862 KCFQNYSDYCHLAL-QHCPKHFHSA-N 456.547 0.712 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1C 1781912819 QDTHNUGXGONQFN-XMMPIXPASA-N 480.525 0.709 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1782781348 VJLMHGWSRRFGJZ-PGRDOPGGSA-N 467.950 0.521 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1783536625 HCYBHKULUVUEAN-SGTLLEGYSA-N 471.377 0.505 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1783616175 RJLCIBPMCNZFFP-YYQBIWNASA-N 490.395 0.970 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783933033 OVAKQSWEKBRXDN-XMMPIXPASA-N 474.558 0.609 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc3sc(N)nc3c1)CCO2 1783933999 RHDAZAMTYJPRMA-NRFANRHFSA-N 460.560 0.695 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1CCc2ccoc2C1 1784233280 VSFPJHIPMXKYRB-RQIDZSJNSA-N 452.316 0.358 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C[C@@H]3c3ccc(F)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786983762 ZMVXOSLWNNADKX-GEFFGTOZSA-N 466.318 0.903 50 20 JCGD CC(C)(C)c1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984325 DJTRCJFQECJBGN-YYWHXJBOSA-N 465.359 0.966 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(F)(F)F)C[C@@H]21)c1cccc(B(O)O)c1 1786984403 DVAHQRXWPUCMEM-FNHZYXHNSA-N 477.248 0.687 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccccc3[N+](=O)[O-])C[C@@H]21)c1cccc(B(O)O)c1 1786986441 AZLKFNNWTAHLLB-QRFRQXIXSA-N 499.354 0.660 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC[C@H]3CCOC3)C[C@@H]21 1787508159 LIVVXWPAXPDNAC-HQBWOOTPSA-N 459.547 0.917 50 20 JCGD N#Cc1cc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)ccc1F 1789907256 PNBKEYDSXBSDGV-XJABCFGWSA-N 465.290 0.213 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Br)[C@H]2C1 1789923526 SAQNWYNIZKGVCJ-HCZIRCDUSA-N 496.374 0.932 50 20 JCGD Cc1ccc(C(=O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1 1791170814 HEVRGPXDEOXCLD-JBACZVJFSA-N 450.300 0.151 50 20 JCGD N#Cc1cccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1792832135 QPYBQWPFGWSDOE-OPMZPASUSA-N 462.510 0.393 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)C2 1792869942 FBVBGAZDMSVZAQ-QCPCCJPKSA-N 483.363 0.613 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Br)C2)[C@@H]1CCc2nc(O)nc(O)c2C1 1794112379 SNOVLSYQGIHDOM-BZROYUPASA-N 473.299 0.273 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1794142790 QVPXZYWENQACKN-MHORFTMASA-N 479.770 0.750 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)c1ccc(N2CCOCC2)cn1 1794441515 MUHHXRHPEWORGL-DLTLXFJOSA-N 471.327 0.812 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(-c2ccccn2)nc1)c1cccc(B(O)O)c1 1794551927 HXTQNICOOATPKZ-ACDBMABISA-N 457.299 0.784 50 20 JCGD O=C(CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)Nc1ccccc1 1795737635 DUEUHQGGAPGONE-NHKMSHSESA-N 479.342 0.379 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1nc(C)cc1C)C2 1796445630 GLXJYDTZTUKBRB-JBUXMVGSSA-N 469.546 0.614 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCc1ccc(O)nn1)C2 1796893557 HDDRPVHLHPIMLY-XTUBRDOVSA-N 453.503 0.887 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCOCC2)cc1)c1ccc(B(O)O)cc1 1796945383 UYEYVRTWNAPFON-UADZTWIMSA-N 463.343 0.769 50 20 JCGD CC#CC[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1 1797876546 IFQZAPZCIGNVJH-CBJLPSGESA-N 460.339 0.767 50 20 JCGD COC(=O)c1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)s1 1801012560 PYGZPAKSSHCJFR-VTEUUUEMSA-N 466.560 0.040 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807368673 WKSQRMQEUHGZMW-XTQVGHSUSA-N 474.326 0.944 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369793 VVWXKRNLZBSCNP-UWJYYQICSA-N 479.277 0.491 50 20 JCGD Cc1nc(N)sc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807371198 QYQMFMCOHPMUDM-SJLPKXTDSA-N 465.344 0.742 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2Cc3ccccc3CN2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374649 HAIOGMXXBGQPND-ICDZXHCJSA-N 484.365 0.796 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374774 JBXDPYVFXDVOQO-LUDFCHSCSA-N 457.361 0.240 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1[nH]nc2ccncc12 1808100952 SMDSCYUMSHVRQA-VGSWGCGISA-N 470.298 0.666 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2ccc3nncn3c2)[C@H]1c1cccnc1 1809906195 HDQRFFITQYJXLA-HRAATJIYSA-N 485.508 0.756 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccc(N4CCOCC4)cn3)CC2)C1 1809975022 OTYFEWMGCCHJQH-UHFFFAOYSA-N 492.385 0.757 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CCc2nc(N)n[nH]2)[C@H]1c1cccnc1 1810149600 ZTFAQABAFWZNQE-IVIIRQTASA-N 492.544 0.555 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1810322449 KIDTZJIDKPCRKK-XWFZLUIHSA-N 474.330 0.372 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(=O)Nc2cccnc2)[C@@H]1c1cccnc1 1810464727 DQEQVGAEYAXKBJ-UTKZUKDTSA-N 467.530 0.494 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)C(=O)c2cccn2C)[C@H]1c1cccnc1 1813478809 IGPRYGONIDEUOV-DYESRHJHSA-N 454.531 0.682 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)C1 1815335643 ITLKWSQCYNANRZ-LZWOXQAQSA-N 471.344 0.638 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3ncccc13)CC2)c1ccc(B(O)O)cc1 1815341335 WREPTWRJUWPOBG-CQSZACIVSA-N 462.300 0.405 50 20 JCGD CN1CCN(CCC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)CC1 1817156637 ZYUUUOQKTOREMV-GOSISDBHSA-N 462.599 0.412 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)n1cnnn1)CC2 1817283077 UDEQSMAMASCGAZ-IJTYQOOWSA-N 470.519 0.437 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)CN3CCN(C)CC3)sc2C1 1818798702 UEXPGVAXFHJKOK-FYDYWCEBSA-N 486.602 0.437 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1820108501 YPENNAOQKBVCPC-SWLSCSKDSA-N 458.349 0.354 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1824524844 QWACXAHUULKZGP-OXQOHEQNSA-N 464.393 0.280 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1824525140 TVIAKRTUOZUNGU-OXJNMPFZSA-N 464.393 0.280 50 20 JCGD COCCOCCOCCOCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2 1825788642 GTAGSPUXMMNPAF-ZFWWWQNUSA-N 479.983 0.351 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H]3CCc4nc[nH]c4C3)sc2C1 1826622720 LHSZYSWKYYSJIE-NEPJUHHUSA-N 480.554 0.896 50 20 JCGD C[C@@H](Oc1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826806271 NPYSTWSTZSRBFQ-CJNGLKHVSA-N 466.328 0.911 50 20 JCGD O=C(O)c1cc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)ncn1 1827055757 DRUWHCYVVJDDMG-HXUWFJFHSA-N 466.303 0.402 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=N)N)CCN2C(=O)OCc2ccccc2)C1 1828972223 ANVSDGJTBPERLT-VGOFRKELSA-N 478.981 0.939 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)[C@@H](O)C1 1829690530 BUKORWHEOQIHOY-GXYOHSSGSA-N 493.960 0.595 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(N)=O)C2)C1 1830543263 OGSNIYVCQAXBRD-VLIAUNLRSA-N 468.348 0.887 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc(C)c1C(=O)O 1830735725 MGFDETLBVRVYQT-IIBYNOLFSA-N 454.907 0.671 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737712 IKUSUKCCWYVFAT-HNAYVOBHSA-N 473.935 0.743 50 20 JCGD O=C(NCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1)c1cccs1 1833033127 OJSVRXRUWLCYQE-QGZVFWFLSA-N 450.344 0.738 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cn1 1833435443 XXSTUCCUURNDLF-YOEHRIQHSA-N 461.288 0.636 50 20 JCGD Cn1ncnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1833840329 NSLNRYFDQRGFBP-XOBRGWDASA-N 486.957 0.017 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1 1835022396 ZMNKRDOXVCBGQF-VNSNFZHPSA-N 485.516 0.959 50 20 JCGD Cc1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835226768 WLXXJBPMMCYSGT-UHFFFAOYSA-N 450.348 0.569 50 20 JCGD CC[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835935720 NWINGYJZSBEDLE-RCZVLFRGSA-N 466.343 0.630 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)CC(=O)N4)CCO2)C1 1836790820 HWVVEYCANVUNKL-HRAATJIYSA-N 451.907 0.505 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)(C)C 1836799078 FGCCTLBQHPSHCO-QFIPXVFZSA-N 487.406 0.529 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1 1836850289 KNEIKMWHAPYVSA-KXBFYZLASA-N 466.336 0.973 50 20 JCGD COc1nccnc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1837291992 AGGAUWNZKJHHGF-UHFFFAOYSA-N 462.551 0.470 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccsc3)C2)C1 1837457930 XBOKUHJOEJMAEJ-JOCHJYFZSA-N 473.555 0.449 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1837882031 DZCDUPYUTAZZKX-DNVCBOLYSA-N 451.395 0.814 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)cn2[nH]cnc(=O)c12 1838468618 KITHEZQKSJDDND-XCLFUZPHSA-N 496.362 0.432 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C2)C1 1839144828 LMMUTVJKZYMSIQ-AUSJPIAWSA-N 463.959 0.346 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)c2n1 1839625615 CFOMPNLBCUZZPJ-UTKZUKDTSA-N 450.923 0.621 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(C(=O)N(C)C)c3)C2)C1 1840155643 BXZPQAROWPXEJW-GCJKJVERSA-N 467.950 0.712 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Cl)COC)CCO2)C1 1840156914 YAKIIRZWQYWMAR-HOIFWPIMSA-N 487.981 0.613 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c1 1840184853 GVGOMWBMHOQCMH-JIBKAZCMSA-N 492.548 0.677 50 20 JCGD COc1ccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1F 1840185429 QEDUUIYQHVDTAP-HSZRJFAPSA-N 480.537 0.206 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cc(F)c1F)CCO2 1840719315 GPZIPKHZJCMKRL-NRFANRHFSA-N 472.464 0.547 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)Cc1cnn(C)c1)C2)NC(=O)NCc1ccccc1 1845039542 ZNLIJBXYMQBINM-UHFFFAOYSA-N 453.547 0.512 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)CN3C(=O)CN(C)C3=O)cc2)cc1 725905437 ZTGZABUHDJEXIT-UHFFFAOYSA-N 489.510 0.541 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(-n2cnnn2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1 743729460 GTLNPTVDPBDOCN-UHFFFAOYSA-N 477.528 0.070 50 20 JCGD COc1c(C)cnc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1C 747985707 CSXHHXVGHKYHPK-UHFFFAOYSA-N 477.543 0.872 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC[C@@H]3CCCO3)cc2)n1 761816861 JGJRFUYARNBLAM-HNNXBMFYSA-N 496.567 0.456 50 20 JCGD C=CCNC(=S)NNC(=O)CCn1c(=O)oc2cc(S(=O)(=O)N3CCCC3)ccc21 768264042 JIJJSTQVACKHNU-UHFFFAOYSA-N 453.546 0.450 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)/C=C\c2ccc(NS(C)(=O)=O)cc2)n1 825436207 HEYWFQNDVICNRP-YVMONPNESA-N 452.514 0.770 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1 873766642 RKBCVINHSUBTHN-UHFFFAOYSA-N 477.499 0.757 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(C)c(NS(C)(=O)=O)c2)cc1 883990592 SIRVZZQGABXNGW-UHFFFAOYSA-N 468.557 0.757 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)CNc3ccc(C)cc3)c2)CC1 913431321 FCLKRTYBYKFJBW-UHFFFAOYSA-N 473.555 0.721 50 20 JCGD O=C(CCCN1C(=O)CNC1=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 914754587 CZJIKVHQIKQYDM-UHFFFAOYSA-N 462.470 0.481 50 20 JCGD COC[C@@H](C)NC(=S)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 916125708 WBMHPFRBBFQGOT-IUODEOHRSA-N 474.605 0.483 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)CC2)cc1 917108615 ONSHDAIGNQFORX-UHFFFAOYSA-N 494.595 0.166 50 20 JCGD COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N2CCN(CC(=O)N(C)C)CC2)c1C 917229348 RADZLOCYQNATEZ-MOSHPQCFSA-N 459.547 0.434 50 20 JCGD Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 917278312 MWLPDWCTOZTVHS-VQIMIIECSA-N 484.444 0.435 50 20 JCGD O=C(NNS(=O)(=O)c1cccc(C(=O)NC2CC2)c1)c1ccc(S(=O)(=O)N2CCCC2)cc1 917721670 CJXHLFMUHMBKFL-UHFFFAOYSA-N 492.579 0.987 50 20 JCGD C[C@@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)CN1CCCCC1 918103442 CKWWOSZWLSYSCL-KRWDZBQOSA-N 453.613 0.766 50 20 JCGD Cc1nccc(CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 918106820 PJUIQXHECBSUTR-UHFFFAOYSA-N 462.532 0.269 50 20 JCGD COc1cc(-c2noc(CCC(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)n2)cc(Cl)c1OC 918146781 MMGNSOCKNRFTPC-SNVBAGLBSA-N 472.907 0.922 50 20 JCGD Cc1nccn1CCCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 918222650 CVWVDJRRIRRSIU-UHFFFAOYSA-N 478.575 0.566 50 20 JCGD O=C(COC(=O)CCn1cnc2sccc2c1=O)NNC(=O)[C@@H]1COc2ccccc2O1 928977409 VKPFYZVGZJWLRO-HNNXBMFYSA-N 458.452 0.379 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)Cc1cccnc1 1338562319 RADAEHWRKRASOJ-MRXNPFEDSA-N 452.920 0.658 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1[C@H]3COC[C@H]31)C2 1778095104 SVHGJVQSHQOSIL-QMZNAZLISA-N 457.531 0.527 50 20 JCGD CC(C)(C)OC(=O)N1CC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)C1 1778758745 OWAURMCRYKBRBO-WHSLLNHNSA-N 459.971 0.967 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1779176940 OKXHJDBUSVTACK-CKFHNAJUSA-N 468.352 0.456 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccnc1CS(C)(=O)=O)CCO2 1779296577 ULQHYJCJHVRNKG-FQEVSTJZSA-N 469.636 0.921 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1 1779374645 AMXYCISQPHEZIK-XKDCRVNJSA-N 469.546 0.579 50 20 JCGD CC(C)(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)[nH]n1 1779727397 PDYJGNIRFDABKM-HYBUGGRVSA-N 468.363 0.828 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780558723 HGEUWEXNXGKJPA-UNIVCBNLSA-N 499.612 0.885 50 20 JCGD O=C1NCCn2nc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@@H](F)Br)C3)cc21 1780771603 NAONYRZXSOTNGT-HBUWYVDXSA-N 472.315 0.445 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n[nH]1 1780968510 MDFPOPZHYLMKIH-QHCPKHFHSA-N 469.546 0.508 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H]2CCCS2(=O)=O)C1 1781661256 SDDUWNVMFNBZAB-ZOMKSWQUSA-N 451.383 0.861 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN2C(=O)C=CC2=O)C1 1782311643 ABKQBOCTBNJRRU-PJIJBLCYSA-N 456.337 0.456 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3C[C@H]4CC[C@@H]3O4)C2)C1)NC(=O)NCc1ccccc1 1783587933 KNAMVUJZMYULMA-NAZDKBRTSA-N 485.585 0.730 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](CC(=O)OC)NC(=O)OC(C)(C)C)CCO2 1783879363 QVPNSDIVAOPXKY-PDSXEYIOSA-N 491.969 0.527 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)/C=C/C(=O)NCc3ccccc3)CCO2)C1 1783933304 ULAATXVWAAYAFF-DRBUTMMVSA-N 471.558 0.062 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1784373492 OEAQMYFXMZPNBV-AYOQOUSVSA-N 460.362 0.523 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1)n1cncn1 1784477196 QZAQYCDYILNEEY-JPYJTQIMSA-N 484.561 0.015 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CCCc3cccnc3)C2)C1 1784672441 PWOYKEZKSVQWFK-QHCPKHFHSA-N 452.515 0.547 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c(O)cc3O)C[C@@H]21)c1cccc(B(O)O)c1 1786984919 YMVRZBHEFRJHFY-RISOHXOYSA-N 474.706 0.338 50 20 JCGD CC[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)N(CC)CC 1788611655 OMOXETCDECSCJU-KNTRFNDTSA-N 460.579 0.399 50 20 JCGD CCC1(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)COC1 1789726828 VYLFBHMJVDEGNP-ACRUOGEOSA-N 487.601 0.739 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(Cl)CCl)C[C@@H]21 1791544064 OOCXKZRPFZRPFA-RAPQVLNZSA-N 474.389 0.673 50 20 JCGD CC(C)(C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)c1ncc(Br)cn1 1792974767 BMJRVYYRGYCONE-XCCSTKFXSA-N 475.771 0.706 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(N2CCOCC2)cn1 1794767879 DYCOWFYVPOFSQJ-BCDXTJNWSA-N 458.563 0.543 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(F)(F)F)ccn1 1798193638 XWXQUZLSVIVQIJ-DPIQGUFMSA-N 478.431 0.616 50 20 JCGD COCCOCCOCCOCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799348505 JRDCJFBPJALSKL-CYGHRXIMSA-N 499.374 0.353 50 20 JCGD CNc1nsnc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1802472709 RBPHIQSTRTZGNG-QAPCUYQASA-N 466.332 0.288 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1804221387 HHUBNYPHBFDUNG-KAOXLYBCSA-N 481.333 0.505 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnsn2)[C@@H]1c1cccnc1 1805001001 WOJXLHUCSVMPMW-DYVFJYSZSA-N 452.500 0.565 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(-n3cnnc3)cc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363662 NHWPQJDQLTZEHN-ZJSXRUAMSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372861 JTIVJQYCVULYDO-FDDCHVKYSA-N 475.314 0.209 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnn3ncccc23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374332 GSLBCQIJDBYNET-GCJKJVERSA-N 470.298 0.438 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(-n3ccnc3)ccn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376609 WOYIVUNWZPWJGD-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD Cn1cc(CCC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1807427956 YHZMVIAPBALUAW-NZQKXSOJSA-N 461.331 0.447 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@@H]1CC[C@H]2CCC(=O)N2C1 1807735019 JCHUBXQJLAUTBN-JXKFMYIUSA-N 490.369 0.482 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cn2ncccc2n1 1809358378 YZJUYJBQDDAVNY-XMSQKQJNSA-N 470.298 0.438 50 20 JCGD CC(C)c1nc(CC(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)no1 1809974980 LTCSJELTDPKLJA-UHFFFAOYSA-N 454.336 0.960 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1 1810298576 JAKAWJIEBSADKM-LIRRHRJNSA-N 490.480 0.202 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1 1810302960 ONIHMOWMVAFQKW-KKSFZXQISA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCn2cncn2)[C@@H]1c1cccnc1 1810305939 QTEKQTVKYFXOHK-OXQOHEQNSA-N 463.502 0.082 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccn(C)c2=O)[C@@H]1c1cccnc1 1813069188 VUWKAMAKZBVAIR-LAUBAEHRSA-N 454.531 0.473 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2nc3ccccn3n2)[C@H]1c1cccnc1 1813070245 FKLXMJWRRSLAMM-UTKZUKDTSA-N 464.530 0.817 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1n[nH]c3c1CCCC3)CC2)c1ccc(B(O)O)cc1 1815340065 DGHJTNJHWLWCRO-AWEZNQCLSA-N 465.344 0.964 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CC(c3ccccc3)=NN1)CC2)c1ccc(B(O)O)cc1 1815348284 KKIDNVKGVRDJAT-FXAWDEMLSA-N 489.366 0.815 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc(-n3ccnc3)ccn1)CC2)c1cccc(B(O)O)c1 1815361055 UNSAYSRYKQBWCZ-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(C)(C)C 1817473837 BXPCXKWAARCNGS-UYAOXDASSA-N 469.351 0.946 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc([N+](=O)[O-])[nH]1 1820363224 FMFYYHIDDUALOW-INIZCTEOSA-N 452.236 0.946 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1 1820691393 KKGUFRACWTUJNZ-KGLIPLIRSA-N 466.951 0.907 50 20 JCGD Cc1c(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cn2[nH]cnc(=O)c12 1821222559 YWILRHRJRPWTQA-AWEZNQCLSA-N 492.326 0.007 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)C#CC(=O)O)sc2C1)NC(=O)NCc1ccccc1 1825669415 DXOUNKASDMHJRW-HNNXBMFYSA-N 484.538 0.489 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059162 HDQSDCHNJJFESM-OAQYLSRUSA-N 491.419 0.025 50 20 JCGD O=C(c1ncon1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829164857 GKVWIYZYFCAOKA-IIBYNOLFSA-N 477.905 0.735 50 20 JCGD Cc1c(Cl)cccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830134642 JZCSXBSFLFFIMY-QHCPKHFHSA-N 472.734 0.712 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)c3ccccn3)C2)C1 1830538208 YEWZZIYLKDMCLN-ALKREAHSSA-N 455.353 0.569 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1830538921 VNHIXJFQQXWZOZ-RIFZZMRRSA-N 469.380 0.439 50 20 JCGD O=C(c1cnc2c(Cl)cccn12)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830722870 IAMLOJPJAGYNJP-HNAYVOBHSA-N 457.314 0.657 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830732082 UHTZDVNNHRXNCE-FSTVOOFJSA-N 489.997 0.546 50 20 JCGD COc1ccc(COCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1830738003 KZIQCMQTMSRJQV-NQIIRXRSSA-N 456.923 0.268 50 20 JCGD O=C(Cc1ccc(Cl)s1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832603050 MGHQXPUWRVMUTD-NRFANRHFSA-N 478.763 0.394 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)Cc3cnc4ccccn34)CC2)CC1 1833294421 UVFYRWZUIVCLBO-UHFFFAOYSA-N 483.617 0.821 50 20 JCGD Cn1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c2cccnc21 1834798671 WPLPJPYFJYXTRJ-UHFFFAOYSA-N 489.385 0.752 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1)c1cccc(B(O)O)c1 1834801218 UOLINHHDNRSIHR-UHFFFAOYSA-N 466.185 0.337 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1834823444 VJZAXKZDJNJDLH-WOJBJXKFSA-N 482.331 0.963 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCOc3ccccc3)CCO2)C1 1834829445 KLBPTMXJUXTCHH-XMMPIXPASA-N 483.525 0.224 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccncc1F 1835251969 MIUBFPMQHDVRFS-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835932203 TWIJCMGMRSPYHJ-BVZFJXPGSA-N 484.333 0.454 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@]3(F)CCCC=C3F)C2)C1 1835933999 KVQQLLSRQXWCOB-YADHBBJMSA-N 464.274 0.182 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)ccc3F)C2)C1 1835934340 WDWYEBMHHZCKFL-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c(C)n1 1836059242 YDXGZYLGLUSSTN-UHFFFAOYSA-N 464.375 0.877 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836955693 XUAXNGBUCIHJES-UHFFFAOYSA-N 468.363 0.643 50 20 JCGD Cn1cnc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1837547360 HEHXKGPHLTURHU-UHFFFAOYSA-N 455.519 0.345 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccn3)C2)C1 1838527472 VPCHFDRNHLNBQU-QFIPXVFZSA-N 485.453 0.694 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnoc3)C2)C1 1838528329 RDWMFQUGJDNQDZ-OAQYLSRUSA-N 474.426 0.892 50 20 JCGD CCOc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)Br)C3)C2)nn1 1838832040 CVSNVVPNIDGANJ-SCLBCKFNSA-N 457.325 0.729 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1 1839200264 FIIWELJHGQLOFD-KSSFIOAISA-N 474.283 0.629 50 20 JCGD N#Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)ccc1Br 1839400982 LBIDAWGSIYJZOX-VQIMIIECSA-N 486.750 0.990 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839463836 DQXMDXTXTUYRMB-RUZDIDTESA-N 482.342 0.376 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3c4c(nn3C)CCC4)CCO2)C1 1839583906 CQCCZEBEZPPUCO-DJJJIMSYSA-N 455.353 0.762 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839790934 KRPSAFWYVPQHFW-QHCPKHFHSA-N 496.992 0.721 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840032638 FYYPTEZXUVVAOQ-YJYMSZOUSA-N 466.336 0.891 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1840033856 SMQIJGVIRGXMQX-MPBGBICISA-N 480.315 0.675 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(F)c1 1840074142 MZNHSHFIPNAYJD-DSCGJTOLSA-N 498.316 0.298 50 20 JCGD CCOc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)cnc2c1cnn2C 1840151550 FRZIBENRMSVQRV-JTSKRJEESA-N 495.964 0.691 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1 1840153051 BJIYMKWIBBBKGY-HNAYVOBHSA-N 472.329 0.707 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4scnc4c3)C2)C1 1840184381 JDGOPYZHCQAWHU-JOCHJYFZSA-N 475.571 0.739 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)CC1 1840806241 NXPSRQBAIIFEDJ-LAUBAEHRSA-N 492.976 0.530 50 20 JCGD Cn1c(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)cc2c1-c1ncccc1OC2 1843134978 MVZDPYKBGWDHOD-UHFFFAOYSA-N 472.310 0.790 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc(O)nc(O)n2)C1 1843358199 PTYIWYFUPACQAU-UHFFFAOYSA-N 457.399 0.852 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1847148330 ZMKWUBZTFWTKJG-UHFFFAOYSA-N 467.482 0.368 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccccc1C(F)(F)F)NNC(=O)c1ccccc1 8851603 GQONEFUPJWMHAG-UHFFFAOYSA-N 459.402 0.988 50 20 JCGD O=C(COC(=O)C1CCN(C2=NS(=O)(=O)c3ccccc32)CC1)NNC(=O)c1cccs1 12178897 DEBOWFQOLQQPJP-UHFFFAOYSA-N 476.536 0.913 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)CCc2c(C)[nH]c(=O)[nH]c2=O)c2ccccc2c1=O 26791235 KRNMYIPLADYAKL-UHFFFAOYSA-N 454.487 0.666 50 20 JCGD Cc1noc(CCCNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 727604347 WORDCXXIGKNZHY-UHFFFAOYSA-N 480.547 0.295 50 20 JCGD COCCCNC(=O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2C[C@@H](C)C[C@@H](C)C2)cc1 728262299 CIVLFICJFJBQTN-GASCZTMLSA-N 462.594 0.882 50 20 JCGD O=C(C[C@H]1SC(N2CCCC2)=NC1=O)Nc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1 748246549 CHUVCIUGIWMUDW-MRXNPFEDSA-N 486.554 0.492 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc(S(=O)(=O)NC(C)C)cc2)n1 760964277 UVIKCAMJDLLDLS-UHFFFAOYSA-N 454.530 0.685 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)N(C)CC(=O)OCC(=O)NNC(=O)c2ccccc2)cc1 849119956 FEDFBUZDUBSFEN-UHFFFAOYSA-N 462.484 0.270 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(N2CCOC2=O)c1 915802551 OOWPNNDTHJBVAN-UHFFFAOYSA-N 474.495 0.739 50 20 JCGD COc1cc(C(=O)NNS(=O)(=O)c2ccc(C(=O)NCC(=O)O)cc2)cc(OC)c1OC 916108499 FDLNSPHZQPAJJM-UHFFFAOYSA-N 467.456 0.150 50 20 JCGD Cc1ccccc1NC(=O)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 916517207 YCHJVDXPNKBCFO-UHFFFAOYSA-N 461.548 0.878 50 20 JCGD N#Cc1ccc(NCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)nc1 916520695 LEWZRBODSUBNLC-UHFFFAOYSA-N 473.515 0.030 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2c(C)nn([C@H]3CCS(=O)(=O)C3)c2C)cc1 917026954 XEYOJWUQDIDXRJ-KRWDZBQOSA-N 481.600 0.939 50 20 JCGD CN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1 919883097 ATKSCASSADNHIX-OAHLLOKOSA-N 466.541 0.643 50 20 JCGD O=C(NNC(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CCCC1)N[C@@H]1CCS(=O)(=O)C1 919884984 IUNFDQUSWDRRRQ-CYBMUJFWSA-N 463.965 0.944 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccc3c(c2)OCO3)c1 920824724 BFBRTRXUBVBTGG-UHFFFAOYSA-N 460.468 0.600 50 20 JCGD COc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)nn1C 1778092736 NMWNZOYOVOIKTQ-TUWUPGADSA-N 485.545 0.690 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1 1778314613 ZXNMGJKEEBFCPP-XMMPIXPASA-N 487.362 0.067 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)[C@H](O)C1 1778360508 GFPHVYWTMUNUBE-DJDZNOHASA-N 489.997 0.424 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1O 1779028928 LBQWKGGUGPVVFG-HSZRJFAPSA-N 469.498 0.086 50 20 JCGD CCCc1onc(C)c1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779030487 RBQNGWJSOJYIMG-JOCHJYFZSA-N 456.503 0.691 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccc(O)cc1 1779036555 AROFENQJFVQMIS-IQMFZBJNSA-N 453.499 0.638 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3N1)CCO2 1779036728 DGFSBDYBHAAALQ-CVDCTZTESA-N 450.499 0.165 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1779316820 FFTYWGAUDYMXSX-XQBPLPMBSA-N 496.402 0.974 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1779955099 ZWKWNVVZOVQIQV-FDCKDHBTSA-N 497.537 0.334 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1780938769 HYTNZPUTKFZPPW-HSZRJFAPSA-N 482.733 0.582 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1781054391 LXOHNGVMYKGMOF-CSGQYRHSSA-N 484.557 0.351 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334646 QHAMWVVOKLFKDC-QFBILLFUSA-N 455.328 0.904 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1 1782602182 RRLCGMQIBIITPG-XFXZDEKRSA-N 491.552 0.717 50 20 JCGD Cc1cc2nnc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@@H](C)Br)C4)C3)c(C)n2n1 1783534051 DGNKWSXCTGTTRH-XIKOKIGWSA-N 451.325 0.968 50 20 JCGD C=CCCc1ccc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(O)n1 1783936583 PQSODJWQNGPUNF-HSZRJFAPSA-N 459.547 0.722 50 20 JCGD CCC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21 1784619141 XYEXPYRDBZPKLU-GMZLATJGSA-N 458.968 0.839 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1785099504 BUYQTOMXEFLUMT-QHCPKHFHSA-N 466.498 0.401 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785539853 QWNKLVGZCZVKCQ-ZBEGNZNMSA-N 464.407 0.708 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)c[nH]3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979979 WFKXTFQSEWOTJP-OWQGQXMQSA-N 465.237 0.620 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c(Cl)cccc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786981915 PMVHAROSHIPSHX-FNHZYXHNSA-N 482.733 0.803 50 20 JCGD COc1cscc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1787716294 DWEGTDDPTOOGER-NUTKFTJISA-N 459.528 0.662 50 20 JCGD Cc1c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)nc2ccccn12 1787855978 IRKRODJGHMMXEE-SNRMKQJTSA-N 477.525 0.548 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21 1788572635 METXSRDIVUHFGG-VMEFQUBLSA-N 459.547 0.673 50 20 JCGD Cc1n[nH]cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1789316084 OWZXUZIRPBGGRH-JBACZVJFSA-N 483.573 0.658 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccccc3O)[C@H]2C1 1790899465 OGLVBCVEGWELJD-QSFXBCCZSA-N 453.499 0.227 50 20 JCGD Cc1ccc(C)c(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1790928902 FACWEPLRPOYQFC-VJBMBRPKSA-N 450.344 0.819 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790946963 XFEMJPQNDVDCCC-DBXVSBKESA-N 452.316 0.427 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)Nc3ccc(F)cc3)C[C@@H]21 1791290609 AZLWGNQOAVBMJE-SNRMKQJTSA-N 477.537 0.507 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(N3CCN(C)CC3)CC1)C2 1792873601 FLPMJFUUDOBDNS-NXOAAHMSSA-N 457.413 0.387 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccc(C(F)(F)F)cn3n1)C2)[C@H](O)CCl 1792977160 SSHLXCNCAPAFAA-IQOUGMIPSA-N 461.828 0.551 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](O)CCl)C1 1792983829 QHEUSJHZAOKNND-TXPCXHQGSA-N 471.982 0.823 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCCNC(=O)C2)n1 1794506755 NPGNUUUTTWGCNK-FAQVEIGNSA-N 489.649 0.463 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1csc(Br)n1)C2)c1ccc(B(O)O)cc1 1795734317 MNAVJYDWXOELEF-JJLQDPRZSA-N 480.149 0.102 50 20 JCGD Cc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)n(-c2cccc(=O)n2C)n1 1796388584 IFNVNELNWSEKTD-ACDBMABISA-N 489.341 0.125 50 20 JCGD CC(C)(C)OC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1796448236 IWMKAAKYRLRAQL-ZHCJQAHYSA-N 492.013 0.884 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(-c2ccccc2)nc1 1798365472 QTHMLOHDCBCBRT-RUMRUAAYSA-N 471.322 0.945 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1799060354 JMELHJRPCJEHRY-CSHUHZATSA-N 450.923 0.711 50 20 JCGD Cc1cn(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)C3)c(=O)nc1O 1801971941 IYGROYOIGZMVPK-QDQGZUORSA-N 499.474 0.732 50 20 JCGD CNc1nsnc1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1802482465 SNFGHUXCZPXMNQ-SUMWQHHRSA-N 481.542 0.607 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(C)(C)C 1803387085 ZOFWYCDUKYFTBR-IOMROCGXSA-N 495.584 0.951 50 20 JCGD CCC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803432804 AIIXKMSNZLSBTB-AKCHCHLHSA-N 467.530 0.314 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCNC(=O)c1ccccc1 1804062495 MDVMMXZGNMNKEQ-BCDXTJNWSA-N 464.526 0.757 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CSc2ncccn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362246 FRJXQHWJFPIJTE-RXVVDRJESA-N 477.355 0.663 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1807369385 IFQXDJUPPINWJX-XXBNENTESA-N 487.325 0.748 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CNC(=O)c2ccco2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371391 TWAPPMRGVMQDOR-XMSQKQJNSA-N 476.298 0.104 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809979793 AXRMNBDIIZDJTP-SFHVURJKSA-N 478.358 0.425 50 20 JCGD CN1N=C(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CCC1=O 1810295779 XUVRKWUMMBYCNK-FOIQADDNSA-N 478.513 0.008 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810300584 ZHWAVYNSCQEYAY-KXBFYZLASA-N 478.513 0.456 50 20 JCGD COC(=O)[C@@H]1CC[C@@H](C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)C1 1817470523 UHSSYNANSKNYCM-GPMSIDNRSA-N 468.319 0.985 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817471664 VECSPENCYNCBLQ-GOSISDBHSA-N 452.324 0.677 50 20 JCGD O=C(/C=C/C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)NCc1ccco1 1817476209 LGQUUMXSTPTYIY-SQUSKLHYSA-N 491.313 0.861 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)Cc2cccnc2)n[nH]1 1818072703 RJCNNGRRKPXSBE-HKUYNNGSSA-N 477.529 0.679 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](O)N3CCOCC3)sc2C1 1819891294 OLCYQZAYAQVLMD-OHUAYANFSA-N 461.382 0.879 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc(=O)nc2cccnn12 1820145804 NQXJWPZRNUEZLT-KRWDZBQOSA-N 487.285 0.112 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cc(=O)nc3cccnn23)n[nH]1 1820147662 WKGVYYVENBQPIA-HNNXBMFYSA-N 481.517 0.492 50 20 JCGD COCc1oncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826086371 SZLGQEXDMCQLOL-LLVKDONJSA-N 450.521 0.876 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)c2nc[nH]c2[N+](=O)[O-])CC1 1827646562 UXEVGAIRBWRTKI-KRWDZBQOSA-N 455.280 0.545 50 20 JCGD O=C(c1cnc(O)[nH]1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551508 QFIHWPANZNIWJC-HTAPYJJXSA-N 491.932 0.781 50 20 JCGD C[C@@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1)N1CCN(C)CC1 1828924587 SRINBKCPKGBVQH-PGRDOPGGSA-N 485.633 0.554 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)C2)C1 1830539770 IQHOJUYFRMCRAS-QRXRQMIZSA-N 458.397 0.814 50 20 JCGD COC(C)(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2)C1 1832549794 SDQNHVNRUWITLR-BTYIYWSLSA-N 477.986 1.000 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)C1 1833307499 VREPGLATRPDMFI-ZWKOTPCHSA-N 479.622 0.520 50 20 JCGD O=C(CCBr)NC1CCN(C2CCN(C(=O)CCN3C(=O)C=CC3=O)CC2)CC1 1834422476 OLXLUYILSKGUOH-UHFFFAOYSA-N 469.380 0.658 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3cccc([N+](=O)[O-])c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798030 NSXREVNDXKMNCQ-UHFFFAOYSA-N 494.357 0.703 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccn4nccc4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798581 NCKIIPIMNPNBMC-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)/C=C/c3ccco3)CC2)CC1)c1cccc(B(O)O)c1 1834800184 YGCZBEDHLXTZTN-VOTSOKGWSA-N 451.332 0.858 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc4nccn4c3)CC2)CC1 1835413931 ULHYHGPUKFALID-UHFFFAOYSA-N 469.590 0.893 50 20 JCGD O=C(CCc1c[nH]c2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928019 ANGIJAJAQVXEDE-SANMLTNESA-N 491.353 0.551 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459525 HULUZIUKGNQJOX-CRICUBBOSA-N 499.543 0.773 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1837711306 CQVQXXJXYBMYQH-HXUWFJFHSA-N 453.568 0.317 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838393990 HLOAIQILGUYCKR-MRXNPFEDSA-N 484.561 0.225 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4cccnn4n3)CCO2)C1 1838430079 RGEOWBZKIUEVEC-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cc(F)c1)CCO2 1839002455 ZEVXYMHHWQSBGZ-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839139537 KNTOMRVASIJWNB-LJQANCHMSA-N 484.377 0.788 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3occc3c1O)CCO2 1839566531 YGUZIOWBTHHZEC-QHCPKHFHSA-N 474.514 0.581 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1c[nH]c3c(Cl)cccc13)CCO2 1839589401 NKGBMJBSYVKZIA-XMMPIXPASA-N 497.744 0.885 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1839682019 IJAIBADEBRBJDJ-SUMWQHHRSA-N 451.314 0.789 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839951356 RVZSMFVFCLNLEP-BXKMTCNYSA-N 483.525 0.223 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1840155882 FWNNIWADZHGPSS-ZTMHYXLHSA-N 470.906 0.527 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc4c(O)cccc34)C2)C1 1840184761 AHTILPISDAFPII-DEOSSOPVSA-N 485.541 0.383 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1841583010 ZIENJDXPIKZUQE-CYBMUJFWSA-N 482.515 0.665 50 20 JCGD O=C(NC1(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CC1)OCc1ccccc1 1843011642 ZKWZTXZKLUEFBW-UHFFFAOYSA-N 477.326 0.642 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014494 QIXBSUZQYKIAIP-OAHLLOKOSA-N 453.279 0.141 50 20 JCGD O=C(NC1(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1)OCc1ccccc1 1843927881 NYYIFANCMQEKHY-UHFFFAOYSA-N 477.326 0.642 50 20 JCGD COc1ccc(CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c([N+](=O)[O-])c1 1845259781 GRNFIDQDDQOSDG-UHFFFAOYSA-N 453.260 0.343 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)COCCOCCOCc2ccccc2)C1 1846258199 YYHGNTWBIQAQNL-UHFFFAOYSA-N 496.369 0.433 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2 1846386385 GQTSWLPEYQRKLG-UHFFFAOYSA-N 453.499 0.306 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cccc(B(O)O)c3)cc2)CC1 1847241651 AOVWVPCNFNCTRN-GOTSBHOMSA-N 462.359 0.247 50 20 JCGD Cc1cccc(O[C@@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)c1C 18103678 PMPIQDGKBLPDKP-INIZCTEOSA-N 464.544 0.891 50 20 JCGD CSCC[C@@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)NNC(=O)N(C)C 746003354 HOBXGFVITMNOHQ-CQSZACIVSA-N 480.012 0.744 50 20 JCGD COc1ccc(CCN2C[C@H](C(=O)NNC(=O)CNC(=O)c3ccco3)CC2=O)cc1OC 751207074 QTTHPSZEICLDGI-OAHLLOKOSA-N 458.471 0.265 50 20 JCGD O=C(NNC(=O)[C@]12CCC(=O)N1CCS2)c1cccc(S(=O)(=O)N2CCCCC2)c1 811882571 MDZSTGSESSVBTP-LJQANCHMSA-N 452.558 0.688 50 20 JCGD COc1cccc(NCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC)c(OC)c2)c1 825797250 SPEGLSYQSRHSQU-UHFFFAOYSA-N 452.489 0.250 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)CNS(=O)(=O)c1cnn(C)c1 915638497 XHXKKHWPRNTJPZ-JTQLQIEISA-N 460.310 0.076 50 20 JCGD O=C(NCCc1nnc2n1CCCCC2)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916235224 DOICCRZHNSHKKA-UHFFFAOYSA-N 475.575 0.976 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)c3cc(OC)c(OC)c(OC)c3)cc2S1(=O)=O 916743983 NGCXWBHBCCYNRD-UHFFFAOYSA-N 493.494 0.578 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(N)(=O)=O)ccc2Br)cc1 916830742 SRGHFHPTFJBDEW-UHFFFAOYSA-N 455.290 0.805 50 20 JCGD CCS(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1 918550532 VNMXYBRVOQQDOE-KRWDZBQOSA-N 486.616 0.684 50 20 JCGD CC(=O)N1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)Oc2ccccc21 919345167 PVPICFONGLNMDV-HXUWFJFHSA-N 488.522 0.283 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)cc1 919834077 KGEHMLYBQVWXCZ-UHFFFAOYSA-N 450.517 0.448 50 20 JCGD C[C@@H](NC(=O)c1ccc(Br)s1)C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919887082 XKEBBDDFPXMGQD-SFYZADRCSA-N 453.340 0.146 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc(Cl)n1 1779032645 PVAIWEDCGQGJQM-NRFANRHFSA-N 474.905 0.499 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)C#CC3(O)CCCCC3)C2)C1 1779062364 AZYRYULKPJGTJQ-PSQINSSGSA-N 469.542 0.649 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3cncn3c2)C1 1779140015 MFCPMHQVXHSOEA-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD COc1cnc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c(F)c1 1779371273 ZFUWVUATQDAQLR-WZONZLPQSA-N 486.504 0.669 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(F)nc1F)C2 1779371956 YMYFTHMNVUAEIB-OPAMFIHVSA-N 474.468 0.800 50 20 JCGD COc1ccccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1780301862 RFMMLKTZTSUVRX-ZJSXRUAMSA-N 452.316 0.816 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1)[C@@H]1SC(=N)NC1=O 1780773102 CQNHDTVQTMILDH-APLJZOTDSA-N 479.372 0.993 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968634 OQBLVWVTXFXDMG-NLFFAJNJSA-N 487.601 0.736 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781480393 DTXIYLQXAKSVDC-YBGOQADZSA-N 465.359 0.768 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)Br)C2 1782468683 CJMJWXVYTDUJPV-QIYDDFJZSA-N 484.395 0.754 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Br)C2)C1 1783535105 YBBULRLCHZBMDA-MASFLOABSA-N 454.325 0.734 50 20 JCGD COCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1786636104 QHIMEKXMJOOHAD-UFYCRDLUSA-N 461.563 0.349 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C[C@@H]21)c1cccc(B(O)O)c1 1786983062 MDBWGBKGFPVYRS-HMNCIZAVSA-N 477.326 0.477 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786985286 ZFZWLQLJWCANSQ-BVSLBCMMSA-N 480.326 0.450 50 20 JCGD CCCc1onc(C)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1787652377 BOALOTUTGGTXEO-QRFRQXIXSA-N 455.320 0.522 50 20 JCGD Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(-n2nccn2)c1 1789292438 FWAMHZCWXZPTRZ-CUWPLCDZSA-N 483.573 0.542 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1789874769 ZHKYWMULRLVMKZ-FHWLQOOXSA-N 473.574 0.595 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CCc3ncccc3-4)C[C@@H]21 1791290949 SWUWKROKGVPWTC-QSFXBCCZSA-N 495.584 0.537 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)n(C(F)F)n1 1797752790 HNOROEXDEZSIRR-DRXBFXEBSA-N 463.445 0.102 50 20 JCGD CSCC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798523090 RKWLDWNDZPOHDZ-CSHUHZATSA-N 481.527 0.837 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NC(=O)c1ccc(F)cc1 1799050707 TXPVRKJYTOSUAS-CNGORYIKSA-N 455.914 0.787 50 20 JCGD C[C@H](CC(N)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799865566 CFJLGAXNGQKVFR-OQIJWPOYSA-N 458.563 0.482 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nn(C)c(C)c1Br)C2 1800979014 NVMAZUJUUCGQKC-GFQSEFKGSA-N 463.760 0.948 50 20 JCGD C[C@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2)[S@@](=O)c1ccccc1 1801275778 NVXFSHMNJPPSTN-ADBFTHKZSA-N 454.357 0.815 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1801381087 KVNQCQDSFKWXFE-GCAMRICFSA-N 492.580 0.572 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1 1807362155 ZTUUMUMLCWJLBG-OYDLWJJNSA-N 489.337 0.823 50 20 JCGD Cn1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1=O 1807363864 FZJUVIYLQPQJBT-GHTZIAJQSA-N 460.299 0.094 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1 1807373380 AKZISDNKVOGFQV-RXVVDRJESA-N 476.346 0.741 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H](F)Br)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374515 ZTMIYMKWIFCLGU-USXIJHARSA-N 464.100 0.772 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375282 RUYVODPKDQNGJO-AZUAARDMSA-N 467.331 0.670 50 20 JCGD O=C1NC(=O)[C@H](CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Br)[C@H]2c2cccnc2)N1 1808650871 GRJWPIVPDPSYSH-WVWOOGAGSA-N 456.272 0.376 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cc2n(n1)CCCC2 1809865875 SQZWPXPZFKLZAE-XXBNENTESA-N 473.342 0.928 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)CCn2cncn2)[C@@H]1c1cccnc1 1813319557 WDXQPHMVNQBVOP-DXGXISDISA-N 477.529 0.903 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348859 ZFEOMTGAPAGRCN-QGZVFWFLSA-N 491.375 0.118 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnc(OCF)cn2)[nH]n1)c1cccc(B(O)O)c1 1817473135 HUEWUXUAHCBLGH-QGZVFWFLSA-N 468.254 0.805 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CCN2CCOC2=O)[nH]n1)c1cccc(B(O)O)c1 1817476137 HGJDABRSZFVRBQ-KRWDZBQOSA-N 455.280 0.238 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cnc2[nH]ncc2c1 1818996675 BFRZEUVEYJNROK-GOSISDBHSA-N 459.275 0.981 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)[nH]n1 1819403730 CCNRIPJQTMYKHV-GOSISDBHSA-N 488.512 1.000 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)[nH]n1 1822414672 XSVKLPIXCWDAHF-WMZOPIPTSA-N 456.551 0.740 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cn3cccnc3n2)CC1 1828561730 ILKYCAIBHKJFIE-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnc(O)nc2O)CC1 1828926137 AFCNAXCTFKKXOZ-KRWDZBQOSA-N 469.502 0.433 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)CCl)CC1 1829023831 BJXSQRTUCSQBQI-JCGIZDLHSA-N 451.955 0.814 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1830358672 QMYOJQAGXWQFOH-JLCFBVMHSA-N 482.965 0.714 50 20 JCGD CN(CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H](F)Br)CC1)C(=O)C(=O)O 1830382899 MYAHUJBBTLZZCN-TZMCWYRMSA-N 450.305 0.840 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)CCO2 1830422176 FAJMFTSJOHKVKQ-RLSLOFABSA-N 497.527 0.698 50 20 JCGD CCC[C@H](NC(=O)c1ccccc1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830720358 XWPHKEWJWBMWJA-YDHSSHFGSA-N 481.977 0.641 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830737669 GOKFUKDRCFAPKR-IZZLDSCCSA-N 487.981 0.440 50 20 JCGD O=C(CCc1cccs1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1833154836 UZEOLNAOZFEYKT-JOCHJYFZSA-N 458.345 0.131 50 20 JCGD CN[C@H](CC(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1)C(=O)O 1833263675 QPUIDZMMZHXSIM-XJKSGUPXSA-N 461.401 0.652 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)CCO2)C1 1833726238 XBZPVISEMWLWIY-SBUREZEXSA-N 493.992 0.495 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1834821640 RSSOHSALCMRSHI-IBGZPJMESA-N 470.320 0.708 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1 1834826733 UUMHIUOIDMLFMJ-IFXJQAMLSA-N 455.353 0.756 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cc4cccn4cn3)CC2)CC1 1835424354 WLRCNRFOCLCQBC-UHFFFAOYSA-N 469.590 0.893 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccn2cncc2c1 1835605188 ZUVDQYKBQJQFGN-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc2c(c1)CNC2=O 1835627469 NVYQVJHXAQZDRV-UHFFFAOYSA-N 490.369 0.109 50 20 JCGD O=C(c1ccc2ccoc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835932168 RDMYPCYFTAJNHN-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939717 FPGLEIRVMACABK-DPYYHXFJSA-N 494.353 0.549 50 20 JCGD Cc1nc2ccncc2cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1836837823 VVZMCWXAFTZFTA-VWLOTQADSA-N 490.325 0.002 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cn[nH]c3cn1)CCO2 1837194529 MCGYYAHRVXPKQH-GOSISDBHSA-N 452.309 0.813 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)COC(=O)C(F)(F)F)CCO2)C1 1837319031 IBVBERCAWXVRME-GJZGRUSLSA-N 465.252 0.785 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n(C)n1 1837919097 DQROASQCPRHOLK-UHFFFAOYSA-N 468.363 0.588 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838395388 LCNRFNSFQKFZKL-NRFANRHFSA-N 488.589 0.602 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838418320 XMNGPKRTQIEOTE-YJYMSZOUSA-N 470.935 0.080 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)no3)C2)C1 1838528163 IYUFMNWCWXOLCC-OAQYLSRUSA-N 490.425 0.598 50 20 JCGD O=C(c1c(O)cc(O)cc1O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201533 AGVDEQXHKPEXLH-YOEHRIQHSA-N 463.256 0.564 50 20 JCGD CC(C)=NO[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839224780 OPANTHOPIPDBNM-KTUMRIBQSA-N 476.534 0.378 50 20 JCGD CN1CCCn2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)cc2C1 1839622474 HBXCAQRFDKKITF-LPHOPBHVSA-N 488.358 0.479 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnn3CCOC)C2)C1 1839964196 JTVCHMQWNIOKRB-KXBFYZLASA-N 473.368 0.773 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(=O)nc4sccn34)C2)C1 1840154441 XCQHVDSLSXYVSX-BFUOFWGJSA-N 470.935 0.080 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccsc3)C2)C1 1840184019 NSMRMNRKQGMNJQ-OAQYLSRUSA-N 452.577 0.510 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1ccnc1C)CCO2 1840491835 VPHGJYTVQQNGSY-ATHJKFOESA-N 485.545 0.343 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1OC(F)F)CCO2 1840744484 HSLHZNJAAWTSJQ-QHCPKHFHSA-N 490.268 0.352 50 20 JCGD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013033 AGBDUWDQCCHCBV-UHFFFAOYSA-N 462.271 0.747 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2cc(=O)nc3sccn23)C1 1844624562 PHJDGBAIXXGOCW-ZMOGYAJESA-N 467.511 0.707 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCCC12CN(C(=O)Cn1ccncc1=O)C2 1844693178 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CNc1snc(C)c1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 793230065 DRILCUGHAZGGNH-UHFFFAOYSA-N 467.573 0.908 50 20 JCGD Cc1cc(C)c(C)c(S(=O)(=O)NCC(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1C 912852173 NATVUHHHNCEEDQ-UHFFFAOYSA-N 481.600 0.953 50 20 JCGD O=C(Cc1nc2ncccn2n1)NNC(=O)c1ccccc1NS(=O)(=O)c1cccs1 917937310 DHDMIVPIWCIGEX-UHFFFAOYSA-N 457.497 0.990 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1csc([N+](=O)[O-])c1)c(=O)n2Cc1ccccc1 918016866 MGSASTXRJNGDKN-UHFFFAOYSA-N 497.493 0.859 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O 920424780 GTXQQKVTMMTSOD-OAHLLOKOSA-N 489.506 0.859 50 20 JCGD COCc1nc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cs1 920839966 CWHVRGXHOAVXAY-UHFFFAOYSA-N 468.557 0.704 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](F)Cl)C2)CC1 1778025883 IKKODLHIBCKPIW-RVKKMQEKSA-N 453.964 0.706 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1 1778238114 QBHOAEOMSWHQNR-UUOWRZLLSA-N 487.362 0.067 50 20 JCGD COc1cccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1779029593 ZIERNPWXWIMBNO-QHCPKHFHSA-N 468.514 0.165 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2 1779029739 XVQFDVMZEATASY-SOAGJPPSSA-N 467.448 0.861 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)cn1 1779373190 LZDDWPCUFLIMJM-NTKDMRAZSA-N 496.524 0.308 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CCS(C)(=O)=O)CCO2)C1 1780098971 MLOUAAYCBKSNSA-HXUWFJFHSA-N 483.499 0.398 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccn(-c4ccccc4)n3)C2)C1 1780343610 LABBNWQOZKQVMC-QHCPKHFHSA-N 454.531 0.689 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2)NC(=O)NCc1ccccc1 1780969803 PZKBQOUHTPXUOW-LJQANCHMSA-N 473.908 0.994 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2)NC(=O)NCc1ccccc1 1780969854 KIDMRXQAMBRADA-YLJYHZDGSA-N 455.918 0.697 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cccn2nccc12 1781293274 AMVXJIKPHHJHHV-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1 1781772569 CBPRYXPYYIYDBY-NRFANRHFSA-N 472.433 0.490 50 20 JCGD CCNC(=S)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1782638863 HWMDKQIKGLGCJA-XOBRGWDASA-N 492.042 0.432 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1782868003 XFMUFTZKZSMLLJ-NHTFKITNSA-N 476.480 0.853 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](N)CN)CCO2 1782869717 IECGEYIZSBBVSG-WVAMOMGXSA-N 462.348 0.472 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(-c3ccncc3)[nH]n1)CCO2 1783934252 BHADUIUCKOPFEG-JOCHJYFZSA-N 455.519 0.288 50 20 JCGD Cc1onc(-c2ccncn2)c1C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935739 WFAIJYLWIDJRGQ-QFIPXVFZSA-N 471.518 0.257 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnnn3C)[C@H]2C1 1785466911 KREUARNLYULZEG-AXHNFQJDSA-N 472.458 0.556 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3cccc(B(O)O)c3)CCC2)cc1 1786336083 RIOVOWPMWDJMAB-OAHLLOKOSA-N 473.360 0.442 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)C1 1786978720 NDEYCSIQWRHIQZ-AINOVGTFSA-N 486.374 0.329 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CSc3ccccc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979375 BENZKEMXXLDTQA-YYWHXJBOSA-N 454.357 0.752 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786982141 PBSAKSBJJOHBSL-AAEGSUEWSA-N 461.327 0.901 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)C1CCN(c2ccccn2)CC1 1789719689 JGRBHARUGDYSPO-PMVMPFDFSA-N 492.385 0.271 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)CC1=O 1793869875 DGMIKJJOLWRQSX-PKRADWSKSA-N 463.962 0.846 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(C2CCCC2)C1)c1ccc(B(O)O)cc1 1794027892 JFCCIUUMOBBVIW-FRTACKCFSA-N 453.348 0.409 50 20 JCGD COc1cc(F)cc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c1 1795740622 DVSKIKYYEYSVBR-CFJSZHGOSA-N 468.290 0.431 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)CC1 1796189612 HXGDYTQVGPOKFR-REPLKXPHSA-N 471.363 0.923 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnoc1)NC(=O)NCc1ccccc1 1796526834 GBYTWFZOXWDUCF-OPVJXMOQSA-N 456.503 0.224 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]cc1[N+](=O)[O-] 1798007874 SXNURUQLQWEUND-OPDFLTKYSA-N 486.913 0.653 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(-c3ccccn3)nc1)C2 1801009462 KHQZMELMQSUDKN-UPHUGPLXSA-N 467.530 0.115 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C[C@H]2C[C@H]21 1802136567 LIMYQJQRYQAVIX-ZUHGMRDBSA-N 457.955 0.574 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(C(=O)OC(C)(C)C)CC1 1802228902 CSFKVWPQNOTQGN-RMFSNUHRSA-N 495.621 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCn1c(=O)oc3ccccc31)C2 1802332435 CMUXDVUNFMJYOD-BJWYYQGGSA-N 457.531 0.996 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1)[C@H](O)CCl 1803147470 GITVXCPBFYTZDR-WOSRLPQWSA-N 456.977 0.547 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1CCN(C(=O)CNC(=N)N)[C@@H]1c1cccnc1 1804240302 XVALLRFNMVGIRZ-YQQAZPJKSA-N 481.985 0.703 50 20 JCGD COc1ncc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cc1F 1804960345 NDVOGALGPUYIBU-UWJYYQICSA-N 478.289 0.938 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1)[C@H]1SC(=N)NC1=O 1808398943 HDWXHUCKIPAITD-JECZMYCTSA-N 489.602 0.263 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc2cn[nH]c2cn1 1810085409 MRGXRPAUDKYHPZ-HTAPYJJXSA-N 470.298 0.666 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)on1 1810295605 UJHUFWBHEXXVNE-IIBYNOLFSA-N 463.498 0.939 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1810538841 ABZDQHJXBXQJFC-NQIIRXRSSA-N 482.679 0.669 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cccn(C(F)F)c1=O 1810604034 WBGCMBLVSDTDIA-YLJYHZDGSA-N 496.279 0.952 50 20 JCGD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nn1 1811206586 ZDNZVTGXTVTBSD-UTKZUKDTSA-N 461.287 0.193 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1C 1811636776 ZXJKTZNHYJOBLY-HRAATJIYSA-N 457.535 0.516 50 20 JCGD C[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@@H]1c1cccnc1 1812857936 BAGXDCCHFPTRHI-RBDMOPTHSA-N 468.558 0.814 50 20 JCGD O=C(CCN1CCCCC1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1814068774 NJSORRXABZYWEB-QGZVFWFLSA-N 456.377 0.925 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1 1814877876 NBGAIMFGTSURIV-OAGGEKHMSA-N 451.915 0.472 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2nc(O)n3c2CCCC3)[nH]n1)c1ccc(B(O)O)cc1 1817472155 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O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 1837921543 LGYMWQJXSLHSSQ-UHFFFAOYSA-N 497.313 0.906 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)C(=O)OC(C)(C)C)C2)C1 1840151668 KBLSWBFVSQXXMF-YWZLYKJASA-N 463.959 0.564 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)C1 1840182383 HYBYIRFHTPLMLI-XLNZFTOWSA-N 496.605 0.185 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CCN1C(=O)OC(C)(C)C 1840961730 PNZBCIAGZVMZTP-DOWNOZBLSA-N 489.997 0.688 50 20 JCGD Cc1nc(CC(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)no1 1842029770 ZFCDMEXWSLFDFS-UHFFFAOYSA-N 455.519 0.470 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCCC12CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1844383416 CTJDYULTGAHJEV-LSDHHAIUSA-N 460.959 0.473 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@H]1CCNC(=O)C1)C2)NC(=O)NCc1ccccc1 1845039459 QRHYMJDRZVFRHP-SFHVURJKSA-N 456.547 0.062 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)C[C@@H]1C=CCC1)c(=O)n2Cc1ccccc1 10161652 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O=C(NC[C@H]1CCN(C(=O)c2cnc3ncccn23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362261 LBUVOKHOGOFOOZ-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)Cn2cncn2)[C@H]1c1cccnc1 1807595046 DMEQQTFSVQBZAD-TYXIVBLQSA-N 463.502 0.513 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1 1809234813 CJSPKYKHKPKZOM-QFBILLFUSA-N 465.518 0.212 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1 1810303842 ZBVWQBPVJZDAET-HRAATJIYSA-N 474.525 0.856 50 20 JCGD Cn1ccc(=O)cc1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1811363880 OOZNVRRKJZHKPY-XMSQKQJNSA-N 460.299 0.094 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1cccn1 1813425081 FTJDMBVMNKZKBV-OXFYSEKESA-N 462.514 0.857 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3nonc3c1)CC2)c1ccc(B(O)O)cc1 1815340372 KWFVBCLHMWFYKE-CQSZACIVSA-N 463.284 0.899 50 20 JCGD O=C1COc2ccc(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)c3cccc(B(O)O)c3)CC4)cc2N1 1819146429 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O=C(COC1CCCCC1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833217321 VRMUMLYGOVAGOC-UHFFFAOYSA-N 471.407 0.901 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(F)(F)F)CCO2 1834115268 PNJVXJLRTIZXHO-FQEVSTJZSA-N 487.479 0.543 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834800419 GTBVQCPEPVCLDN-XMMPIXPASA-N 495.385 0.294 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cc1 1834820241 RTEONTRTXHYJLL-UYAOXDASSA-N 471.348 0.970 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835712889 JFZKKZCLQZWUIF-OAQYLSRUSA-N 457.380 0.125 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccnc4c3OCO4)CC2)CC1 1835737984 PKDNMVOMGIJTEK-UHFFFAOYSA-N 495.540 0.308 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)N3CCOCC3)CC2)CC1 1835763163 DWJPQNFXLLTXCC-NRFANRHFSA-N 456.660 0.060 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1 1835928163 GRGQDKWZRXXALN-RUZDIDTESA-N 475.310 0.298 50 20 JCGD CCc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc(C)n1 1835928318 KKHXNWLVZMJARU-XMMPIXPASA-N 467.331 0.016 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)ccc1F 1835931903 GDWTYVCWXKXQDE-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD Cc1ccc(C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)c(O)n1 1836151276 BTTJAMMRMXHMNH-UHFFFAOYSA-N 460.579 0.654 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4sccn4c3)C2)C1 1837457501 FWNQHBHZSAAFDG-QFIPXVFZSA-N 484.538 0.383 50 20 JCGD CSCC[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920813 HTHBARJTQJSAML-HXUWFJFHSA-N 464.393 0.093 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)[nH]n1 1837991923 OAISQLDUPBCUNX-QHCPKHFHSA-N 485.545 0.090 50 20 JCGD C[C@@H]1C[C@]1(C)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839091394 FCEPFSWQQCHPTL-NGXZDTIWSA-N 487.601 0.835 50 20 JCGD Cn1ncc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1Cl 1839200331 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CC(C)(C)OC(=O)N1CC2(CC[C@@H](C(=O)N3CCCC34CN(C(=O)[C@@H](O)CCl)C4)O2)C1 1841079556 LXAMKDLOTKWXIN-GJZGRUSLSA-N 457.955 0.958 50 20 JCGD O=C([C@H]1Cc2[nH]nc(C(F)(F)F)c2C1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012208 ONOUPWDQFNHVCL-CYBMUJFWSA-N 462.237 0.340 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@](F)(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012514 VVCSVODCSDZMEH-DEOSSOPVSA-N 489.353 0.923 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@]2(C)CCN(C(=O)OC(C)(C)C)C[C@@H]2O)C1 1843984050 VGPVIAVTNLRLAJ-SBUREZEXSA-N 495.621 0.571 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1ccc(N3C(=O)C=CC3=O)cc1)C2 1844265449 DIKKHXFQIJLCQN-UHFFFAOYSA-N 474.477 0.245 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc(Br)c(O)c2)C1 1845375637 AFGVLGKZQKEVOX-UHFFFAOYSA-N 459.105 0.965 50 20 JCGD CC[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H]2CSCN2C(=O)[C@@H]2CCC(=O)N2)C1 1845874174 CVCZZNYXDOBZJM-HZSPNIEDSA-N 487.420 0.543 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CNC(=O)OC(C)(C)C 1847511469 QEDXEFRKHPAUNG-JWFNSIOCSA-N 476.534 0.208 50 20 JCGD Cc1ccc([C@H](CN2CCOCC2)NC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1 28799766 VZOPBPHYOUJVKU-FQEVSTJZSA-N 450.503 0.988 50 20 JCGD Cc1cc(C)cc(OCC(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)c1 726710804 SSBSAJCPIWPACU-UHFFFAOYSA-N 455.519 0.542 50 20 JCGD O=C1Cc2cc(S(=O)(=O)NNC(=O)c3csc(N4CCOCC4)n3)c(Cl)cc2N1 726877446 LAYWBDXDWFGZMO-UHFFFAOYSA-N 457.921 0.751 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)CCCCCn1c(S)nc2ccccc2c1=O 729274826 FEKYVUOXSDTJFJ-GFCCVEGCSA-N 455.562 0.331 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H]2CCCN(S(=O)(=O)Cc3ccccc3)C2)n1 730615702 RGPHXRPXCOWHHY-KRWDZBQOSA-N 494.595 0.927 50 20 JCGD O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc(S(=O)(=O)NCC(F)(F)F)cc1 730815091 ZSWGKWOACUKMJD-UHFFFAOYSA-N 483.446 0.621 50 20 JCGD Cn1c(CC(=O)NNC(=O)NCCN2CCN(C(=O)OC(C)(C)C)CC2)nc2ccccc21 744896086 HMUGZVRASBXQKR-UHFFFAOYSA-N 459.551 0.999 50 20 JCGD CC(C)[C@@H](NS(=O)(=O)c1ccc2c(c1)OCCCO2)C(=O)NNC(=O)N1CCOCC1 745991646 AUISBWQWMOZXES-QGZVFWFLSA-N 456.521 0.224 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)nc1 748465115 KFVXZVVHEKKSKB-UHFFFAOYSA-N 490.590 0.528 50 20 JCGD CC[C@@H](C)C(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 751044317 VGBUQPGDPMQTDP-AEFFLSMTSA-N 480.587 0.753 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCn2nnc3ccccc3c2=O)cc1OC 753837183 NZAXZHXHOZZPAI-UHFFFAOYSA-N 455.427 0.203 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@H](NS(=O)(=O)c2ccc(C)c(C)c2)[C@H](C)O)n1 760139307 QKWTYTINESMRAT-IFXJQAMLSA-N 498.583 0.029 50 20 JCGD C[C@H](NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)c1cccc(S(N)(=O)=O)c1 916197476 UKMKTRMTKLWPDE-AWEZNQCLSA-N 497.603 0.052 50 20 JCGD O=C(NCCNS(=O)(=O)Cc1ccccc1)NNC(=O)c1csc(N2CCOCC2)n1 916516493 CXOYQYDWSMFOAV-UHFFFAOYSA-N 468.561 0.043 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@H]1CC(=O)N(C2CCCC2)C1 916549957 FDESGTHDSDCOAD-SFHVURJKSA-N 492.598 0.579 50 20 JCGD CCn1cnnc1CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 916580785 WHIVUTRZHLQEFY-UHFFFAOYSA-N 457.516 0.921 50 20 JCGD O=C(NNS(=O)(=O)c1cc(Br)ccc1[N+](=O)[O-])c1ccc(-n2cnnn2)cc1 917727621 MXKPTEAEGAUTQB-UHFFFAOYSA-N 468.249 0.956 50 20 JCGD COCCN1C(=O)c2ccc(C(=O)NNC(=O)COc3ccc(C#N)cc3)cc2S1(=O)=O 917908373 JSVGNZLVKFMYSZ-UHFFFAOYSA-N 458.452 0.189 50 20 JCGD O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)CN1CCCc2ccccc21 920340483 QHMJDOYXUBDCEJ-UHFFFAOYSA-N 461.500 0.863 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@](C)(O)C(F)(F)F)C2 1778091786 QPKQCNPPXJSFDL-QMRINQTFSA-N 487.479 0.948 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ncccc1Br)CCO2 1779032662 QGYQTRVXRSTPPV-FQEVSTJZSA-N 489.330 0.600 50 20 JCGD O=C(/C=C/C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)NCc1ccco1 1779208047 DUGMZPDJYPRVPK-CMDLKFMISA-N 458.284 0.972 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccccc2C(N)=O)C1 1780992206 ANTRQKORHJDZEH-WZONZLPQSA-N 459.547 0.286 50 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C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C[C@@H]21 1791057147 DZUCGHJOMFZBGJ-YTFOTSKYSA-N 478.384 0.635 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Br)c3)C[C@@H]21 1791290835 ABGHRDITBBPEJT-JYJNAYRXSA-N 482.379 0.810 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(Cl)c1 1792017432 PJKDGUNLIVVQRX-ZRCAFCQKSA-N 472.734 0.936 50 20 JCGD CCOC(=O)[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793117935 LFNHSOIUVJDZAH-AICCOOGYSA-N 461.943 0.681 50 20 JCGD Cc1ccc(C)c(OCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1793812815 MNNHLATZYMGOJZ-BBIADKPPSA-N 452.316 0.265 50 20 JCGD COc1cncc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)c1 1794052943 GMAZCJLEKGWTMJ-ZMQIZJGTSA-N 482.541 0.746 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)c(F)c1)C2)c1cccc(B(O)O)c1 1795737852 ZXQLHPFZCSNRRZ-SIUYQDCVSA-N 470.281 0.652 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C)nn1-c1cccc(=O)n1C 1795934725 ZOERKIREHUCDDN-UIVXKWKOSA-N 477.949 0.336 50 20 JCGD COc1ncc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797748044 DQEPKZMSBXJDPP-DPIQGUFMSA-N 474.905 0.259 50 20 JCGD COc1ccc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1799023112 YYROLQABSIZLAB-VTEUUUEMSA-N 452.939 0.925 50 20 JCGD COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)n1 1799095168 XIKAUGYJSDWDKI-BBIADKPPSA-N 496.568 0.640 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)[C@@H](O)C1 1799199054 VBASALZSFUYWEH-PFFSRIRZSA-N 490.395 0.589 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(O)n[nH]1)C2)NC(=O)NCc1ccccc1 1799871483 JLYIPPDSQFULMF-BJWYYQGGSA-N 455.519 0.713 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2)c1cnc2c(c1)CCNCC2 1800243920 HMEJKGYVZGKNMQ-HGKCTWBKSA-N 451.365 0.758 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)C2 1800970993 NQRZXOHHZJGCKN-QEOTZNIISA-N 475.970 0.466 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)[C@@H]1C[C@H](O)CN1C(=O)OCc1ccccc1 1802025029 INGOJVCIEZDFRC-QSMSVPEVSA-N 483.924 0.882 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C(=O)C1 1802188274 SWKGGFVNAASHER-DLTLXFJOSA-N 476.933 0.190 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1c(=O)n(C)c3ccccc31)C2 1802336593 NXPCIQOJDRTNGO-BJWYYQGGSA-N 456.547 0.351 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802337629 ZJROENAQWIRXSL-FZDIXFNVSA-N 461.538 0.955 50 20 JCGD C[C@H](CBr)C(=O)NC[C@H]1CCN(C(=O)CN2CCNC2=N)[C@H]1c1cccnc1 1803009522 WTGSDBGFAJKYMO-UNEWFSDZSA-N 451.369 0.958 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@@H](CNC(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1804190749 RNISPZDLTODOGV-CRFBAAHOSA-N 456.330 0.876 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)ccn1 1807362558 VYBBBCKNFIKXKF-DENIHFKCSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2c(n1)OCCO2 1808189108 VOCPVVCLGFHMRM-AVRDEDQJSA-N 488.309 0.561 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccc1-n1nccn1 1811469717 JJLYTFPDRJPFEV-YKSBVNFPSA-N 496.336 0.976 50 20 JCGD CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1 1811627547 NNSHXDRQPIEGDS-HTAPYJJXSA-N 469.546 0.963 50 20 JCGD Cc1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c(=O)[nH]c1C 1815336748 BPIKAMFCKMOFIL-CQSZACIVSA-N 467.316 0.063 50 20 JCGD O=C(Cc1ccc(O)cn1)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361572 KKIQARWHCYEUAO-HNNXBMFYSA-N 452.301 0.392 50 20 JCGD Cn1c(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)cccc1=O 1816315177 GKOQEVZCJDBYPO-MRXNPFEDSA-N 464.486 0.727 50 20 JCGD COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)CS(=O)(=O)N3CCCC3)sc2C1 1817277171 ZWWYNPXYLZIIGW-RYUDHWBXSA-N 464.997 0.735 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472802 YLOPGUQOKSICMP-IBGZPJMESA-N 461.287 0.808 50 20 JCGD O=C(CC(F)(F)C(=O)O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1818024265 AESRSRNTZQQHHX-AWEZNQCLSA-N 450.207 0.505 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800339 NFRATXTVTMJLQK-WDEREUQCSA-N 476.515 0.929 50 20 JCGD COC(=O)C12CC(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC4)(C1)C2 1825558834 NLAYVITWMGPUNK-UWVKGYLDSA-N 463.560 0.771 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826886155 IHDHBPMXQNIEGH-BBRMVZONSA-N 466.328 0.911 50 20 JCGD Cn1cccc1C(=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1826999197 QNAGFVFQZKUKBB-NSHDSACASA-N 467.511 0.589 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1827692736 YRCBYDUSEBKADB-MGPUTAFESA-N 458.563 0.785 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829051235 SFWMZILWAXCRKC-UWJYYQICSA-N 453.352 0.528 50 20 JCGD O=C(COCCO)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Cl)C2)C1 1829227641 JWSKRGFJJGTLEN-WIYYLYMNSA-N 471.913 0.982 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)c1ccc(F)cc1 1830733483 NFSJKGTXIYEDKH-UEXGIBASSA-N 471.913 0.059 50 20 JCGD C[C@@H]1[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CCN1C(=O)OC(C)(C)C 1830738972 WQARMSBSVKZKOC-DBHNTLKXSA-N 489.997 0.688 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)CBr)CC2)CC1 1833264827 LXBWMMHUEYDPGX-CABCVRRESA-N 495.484 0.917 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)CC2)CC1)[C@@H](O)CCl 1833308644 ZHMQFBFOEKSCAP-JXFKEZNVSA-N 469.026 0.949 50 20 JCGD O=C(c1ncn(-c2cccc(F)c2)n1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833352045 KWSKIUIMTQHDNC-UZLBHIALSA-N 467.885 0.076 50 20 JCGD CCOc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)cn1 1833430057 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C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1838404349 NRSKZIDKXJDLIR-ICSRJNTNSA-N 466.406 0.872 50 20 JCGD NC(=O)c1nccnc1C(=O)N1CCC(OC2CCN(C(=O)[C@H](F)Br)CC2)CC1 1838508279 HTLNGXWVPAJIOL-HNNXBMFYSA-N 472.315 0.878 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528178 KBGIABDKPXAKGU-DYESRHJHSA-N 499.904 0.844 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CC4)CCO2)C1 1839609549 ABXKMIZWLAKPCY-VGOFRKELSA-N 465.934 0.895 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CCc1ccc(O)nn1)CCO2 1839649924 RYEUHPJSDWAKCH-GOSISDBHSA-N 457.325 0.356 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C(=O)OC)(C1)C3)CCO2 1840007311 YOPFWMOUPAMNIJ-XHNVJUCFSA-N 473.364 0.960 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C2)C1 1840184784 BHQDTGZMKDQZRY-OAQYLSRUSA-N 481.481 0.177 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)[C@@H](O)C1 1840189495 VDTGYTGPSJKIOJ-PJSUUKDQSA-N 496.388 0.474 50 20 JCGD COc1cc(F)ccc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1840640815 PVXXXYCUWBTCPJ-QHCPKHFHSA-N 487.488 0.217 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3c1CCCC3)CCO2 1840720627 BSTBABAQUMDEJA-SANMLTNESA-N 478.354 0.629 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)CC1 1841094114 PYVRZYRCGQNFHJ-UHFFFAOYSA-N 457.336 0.488 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014404 GWPALRFAORURMW-UHFFFAOYSA-N 460.299 0.866 50 20 JCGD CC[S@](=O)CCC(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038998 SJNBHCRVFOHPJZ-YTTGMZPUSA-N 463.604 0.695 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN1CCSCC1)NC(=O)NCc1ccccc1 1847247949 YTKMHLXGMGERDZ-PMACEKPBSA-N 474.631 0.583 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847568686 IJFWFHVSIYTIMY-QPSCCSFWSA-N 475.974 0.130 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](NS(=O)(=O)c2ccc(C)c(C)c2)[C@H](C)O)cc1 9084218 DMXPDTMQHZDKLY-JXFKEZNVSA-N 477.539 0.644 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2cc3c(s2)CCC3)c1 15720405 FBLYNOBZRXEHKF-UHFFFAOYSA-N 452.558 0.890 50 20 JCGD O=C(NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1)[C@H]1COc2ccccc2O1 16185037 KGXRPNCYTISTIH-GOSISDBHSA-N 478.552 0.865 50 20 JCGD CCCn1nc(C(=O)NNC(=O)Cn2c(=O)n(CC)c(=O)c3ccccc32)c2ccccc2c1=O 17163643 KXQZGBMLPYNVRE-UHFFFAOYSA-N 476.493 0.764 50 20 JCGD O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 725907559 LOJUINVTCHPHGH-KRWDZBQOSA-N 497.620 0.846 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCC(=O)N3CCc4ccccc4C3)nc2)CC1 726714739 HVPHJWGDIKRZOE-UHFFFAOYSA-N 487.586 0.229 50 20 JCGD C[C@@H](COCC(F)(F)F)NC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 743341554 NMWZKVVLBYVCBL-LBPRGKRZSA-N 454.475 0.611 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(OC(F)(F)F)cc1)NNC(=O)C(=O)N1CCCC1 748247516 QQYSHZYDZPVRJM-UHFFFAOYSA-N 452.411 0.023 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)ccc1[N+](=O)[O-] 751044521 YORXIBREQXAPEH-UHFFFAOYSA-N 464.456 0.699 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1 751209667 UEUPZGYGCPIKGJ-AWEZNQCLSA-N 450.542 0.726 50 20 JCGD CCn1c(O)nc2cc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCCC4)c3)ccc2c1=O 916743737 QWCBNRPIEHFFQS-UHFFFAOYSA-N 485.522 0.981 50 20 JCGD O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1n[nH]c2c1CCCC2 1317764762 GDONKQUVLCNXJM-UHFFFAOYSA-N 456.322 0.791 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccnn1-c1ccccc1)CCO2 1779030181 HXACKHJTBYKPTC-XMMPIXPASA-N 475.509 0.628 50 20 JCGD Cn1ncc2cc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)ccc21 1779031775 FTLHITNKTQDSGN-HSZRJFAPSA-N 463.498 0.329 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CS[C@H]3CCCCO3)CCO2)C1 1779032776 YIGKUANCJRDDRZ-GHTZIAJQSA-N 463.560 0.388 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc(OCCCO)cc2)C1 1780066199 ODNKRAIAWXXJDJ-PXDATVDWSA-N 490.601 0.948 50 20 JCGD O=C(O)c1cnncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780774827 NTRZFKIJCYBESJ-IIYDPXPESA-N 459.272 0.993 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CCc3cn[nH]c3)CCO2)C1)NC(=O)NCc1ccccc1 1780969519 MPYCFILLZUGBOK-DEOSSOPVSA-N 483.573 0.518 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781333606 IKLGKIJZKLFOTK-RDJZCZTQSA-N 455.321 0.577 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(Br)cc3O)C2)C1 1781528316 VDQKQNHCXJWZDS-HXUWFJFHSA-N 483.363 0.971 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1782213623 ZVSMUYGSUZZIAW-SRCQZFHVSA-N 451.337 0.564 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Cc1cccc(F)c1)NC(C)=O)CCO2 1783882939 AEQRCWBJJBEOMU-JQVVWYNYSA-N 469.941 0.957 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Br)C[C@@H]21 1784444226 IKVOOULERSDONK-DGTMBMJNSA-N 454.387 0.077 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3ccc4c(c3)CCCO4)C2)C1 1784956259 DCHZTZOBPFVIHT-XMMPIXPASA-N 450.300 0.449 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4c3OCCO4)C[C@@H]21)c1cccc(B(O)O)c1 1786982750 AKPKLHQDQADCQJ-LRQRDZAKSA-N 466.299 0.045 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786984994 HMAWAXJKOQMNBQ-HARLFGEKSA-N 466.343 0.899 50 20 JCGD C=C(Oc1ccccc1O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1787502531 BRDHWCSGWGSZIX-ZWOKBUDYSA-N 460.531 0.637 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4nccn4c3)[C@H]2C1 1788056921 ZBJLJLQZUKGDBO-SNRMKQJTSA-N 463.498 0.240 50 20 JCGD CCN1CCC(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)CC1 1788611443 YAIKBEGZOKOZRI-VDGAXYAQSA-N 458.563 0.010 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c(F)ccc(O)c3F)[C@H]2C1 1790212448 KCALGECXTOQYSI-YLVFBTJISA-N 475.452 0.576 50 20 JCGD COc1cccc2[nH]cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)c12 1790423174 KZHPWCHLUXQKKA-BPXKWBHBSA-N 477.326 0.763 50 20 JCGD CC1(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CN(C(=O)OC(C)(C)C)C1 1792983072 BMICFVFAUMHXAV-IVSAIRAKSA-N 459.971 0.823 50 20 JCGD COc1ccc2c(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)c[nH]c2c1 1793029081 UDMODFPJZLSVAE-MRSFGVLCSA-N 477.326 0.302 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793880390 YCUYRTWQEBDFHG-JBXGNFEISA-N 472.970 0.399 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccs1)NC(=O)NCc1ccccc1 1794897322 XSONZWVXZWNRBQ-IZZQQSIFSA-N 472.571 0.693 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnoc1C1CC1)C2 1796441312 XICMVBNUAACSTR-YFXMYTFBSA-N 454.487 0.889 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1796443880 PIQSQBJCYXAMET-SIMNAORKSA-N 458.288 0.401 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(C(F)(F)F)c[nH]1 1796545219 GPQGKHOWXZEMGK-FVCICTRLSA-N 451.210 0.230 50 20 JCGD COCCOCCOCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796893770 RCEFVZFCTPJSJU-PNFLAOTCSA-N 477.562 0.828 50 20 JCGD Cn1c(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc2ccccc21 1797748731 YQDWYSUJFMORAA-GPVSGQMNSA-N 476.537 0.623 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCCC3)c(F)c1)C2 1797752944 NKVVFILOOVWWNK-FAQVEIGNSA-N 496.543 0.941 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799871456 HBAPRNYWYZFJLW-RDGPPVDQSA-N 473.578 0.418 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc2c(F)c(F)ccc2c1 1800065067 DJIDYNJQDRYDKP-UPHUGPLXSA-N 481.264 0.710 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1800737072 ZVLOGFMBSODBNV-ADMHOZKXSA-N 457.955 0.289 50 20 JCGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2)n1cnnn1 1801439083 QKPJWCDSMQLYMW-DVFMFOFASA-N 457.441 0.709 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)ccn1 1807362436 LVVPZPDWSIDGMG-OFNKIYASSA-N 487.325 0.748 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1 1807878509 PODZLMVJFJSXQF-LMCOJAPRSA-N 451.999 0.977 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@H](C)N2CCN(C)CC2)[C@H]1c1cccnc1 1807878510 PODZLMVJFJSXQF-OJAHFUOMSA-N 451.999 0.977 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1nc2ccccn2n1 1807934546 MNSBZZTTZVUAAE-WIYYLYMNSA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2nc[nH]c2[N+](=O)[O-])[C@@H]1c1cccnc1 1808372393 MQUMSUZDBCDMPS-DYVFJYSZSA-N 479.457 0.345 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC2(CCN(C(=O)c3ccc4c(n3)OCCO4)CC2)C1 1809978614 ZDTUWFVZMWQVOQ-UHFFFAOYSA-N 465.315 0.691 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnn3cccnc23)[C@@H]1c1cccnc1 1810303495 TZFBIWAOYGQXAB-OXJNMPFZSA-N 485.508 0.756 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1812865840 YDOOWXNDRRQMTC-LESCRADOSA-N 487.420 0.601 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnc3ncccn23)[C@H]1c1cccnc1 1813069884 DPDBONCRKFNPDP-UWJYYQICSA-N 464.530 0.817 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1 1813070317 HVCDTLWLQHBGRY-HRAATJIYSA-N 472.506 0.265 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)c1ccc(-n2cnnc2)cc1 1814702461 KNGAYKUXZMBRSQ-QGZVFWFLSA-N 488.338 0.943 50 20 JCGD CC(=O)c1cc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)n[nH]1 1817470560 DQMQAVMEDJTAPB-GOSISDBHSA-N 450.264 0.635 50 20 JCGD Cn1cc(CCC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)cn1 1817471501 PVVPMHATXCGYJU-IBGZPJMESA-N 450.308 0.762 50 20 JCGD COc1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)cn1 1817473188 KSKLGFCBLXTSDF-KRWDZBQOSA-N 450.264 0.508 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](N)Cc2cscn2)n[nH]1 1817978527 QDMDTEZDEBZLLV-RDJZCZTQSA-N 483.558 0.741 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1819715136 UAEULQQHJDRSDG-ZBEGNZNMSA-N 458.544 0.941 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1)n1ccnn1 1821721443 PGNXFIAHJXURLL-WBMJQRKESA-N 452.479 0.567 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1)n1cncn1 1822768495 XKKKTBPLKHRDJW-WBMJQRKESA-N 452.479 0.567 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCc3ccc(O)nn3)sc2C1 1824485691 RTQGHCOXPJJAML-LBPRGKRZSA-N 482.526 0.496 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)C(F)(F)C(F)(F)C(=O)O)CC1 1824867905 VQNPNWARMPEXSW-INIZCTEOSA-N 488.243 0.955 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)C[C@H]2C[C@H]21 1830737652 GOKFUKDRCFAPKR-DBPMHTNYSA-N 487.981 0.440 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1831694781 UHWOGUQEYIBZBK-RTBURBONSA-N 452.379 0.841 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831871439 SHOVMNKZPKFJBW-AEFFLSMTSA-N 458.625 0.660 50 20 JCGD Cc1cc(C)n(CC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1833838664 HLOMPENUFIXHTM-UHFFFAOYSA-N 461.611 0.445 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccn1C)CCO2)NC(=O)NCc1ccccc1 1833910381 IDMZWQZMXZZGBN-VWLOTQADSA-N 498.584 0.441 50 20 JCGD Cn1nccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1834232501 IJBBYEUWGAEAOU-YCRPNKLZSA-N 485.969 0.622 50 20 JCGD Cc1noc(N)c1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834700604 DOXMSTMETZVWKE-UHFFFAOYSA-N 470.534 0.063 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)c3ccccc3)CCO2)C1 1834703577 DJUVQWJGBNEQCX-MSIOFZDNSA-N 481.509 0.460 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C[C@H]3CCCCO3)CC2)CC1)c1cccc(B(O)O)c1 1834799772 AONHQMFZJYZDGZ-JOCHJYFZSA-N 457.380 0.511 50 20 JCGD Cc1cccnc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737197 VVJAUIGZQTYVJA-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4ccccc4C3)C2)C1 1835932108 OCLXYUSURYUOFG-ATIYNZHBSA-N 478.354 0.242 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1836670953 MVSTVGWAULRDIY-CYBMUJFWSA-N 484.328 0.741 50 20 JCGD O=C(c1ccc2nncn2c1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837019901 OZYYNPNBXVSAIA-RHSMWYFYSA-N 456.272 0.490 50 20 JCGD C=CCC(CC=C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456352 KZGDBXKOWWEESS-HSZRJFAPSA-N 457.531 0.524 50 20 JCGD Cc1ccc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837457893 UXZOTULTRXVVKL-XMMPIXPASA-N 467.526 0.306 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837461164 PXMOYRBYRHJIED-DEOSSOPVSA-N 496.524 0.027 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CS[C@H]1CCCCO1)CCO2 1837510152 CYAUWLDMCZEXMF-LEWJYISDSA-N 472.608 0.076 50 20 JCGD CCn1nccc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837541138 NKLCHXHPPXPJDR-UHFFFAOYSA-N 469.546 0.828 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528082 DLMYELKQTNHDOC-QMHKHESXSA-N 492.529 0.930 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccccc3Cl)CCO2)C1 1838867645 MMZGWMHOVHOAGN-QFIPXVFZSA-N 473.917 0.722 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)COCCNC(=O)OC(C)(C)C)CCO2)C1 1839139336 APEQEWSUBZKFRJ-HRAATJIYSA-N 493.985 0.238 50 20 JCGD O=C1Cc2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)ccc2N1 1839200420 HSCHHDLIFWJRPF-QFBILLFUSA-N 470.295 0.942 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839651426 DHUMJTRQRWSMKT-SCLBCKFNSA-N 457.325 0.355 50 20 JCGD O=C(Cc1ccc([N+](=O)[O-])cc1F)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839787305 MSMHQRWCNJGCER-VQIMIIECSA-N 459.858 0.333 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc4c(c3)CCC4)C2)C1 1840182938 WYWNZVUNEWCPPY-RUZDIDTESA-N 472.586 0.547 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccccc3OC(F)F)C2)C1 1840186575 AYMAZAWENPCELB-JOCHJYFZSA-N 484.500 0.731 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CCCn3cccc3)CCO2)C1 1840460877 QZSAKESTYFBHFU-BMBTXRBNSA-N 484.557 0.859 50 20 JCGD CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1843322212 AMNXEJSBXNQESA-SFHVURJKSA-N 491.419 0.830 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)CCC(=O)NN(C)C)C2 1843385063 WAIYJFCMVSXEOU-HNNXBMFYSA-N 455.556 0.103 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2 1843415001 AGPOUTBCLHZUDQ-MMDHUZEPSA-N 476.534 0.209 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CCO1)C2 1846386525 VYDGGCQDIFLAMI-MRXNPFEDSA-N 467.567 0.199 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)cc1OC 14800401 RMQVZYWPMIFWRS-MRXNPFEDSA-N 499.567 0.247 50 20 JCGD CCc1ccc(C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)cc1 14893212 SSPHUKNDRZPSFN-GOSISDBHSA-N 467.569 0.792 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCCC(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)cc1 17194487 CUYSTBBQGFZNPQ-UHFFFAOYSA-N 457.468 0.255 50 20 JCGD O=C(NNC(=O)c1cn(-c2ccccc2)nn1)c1cccc(S(=O)(=O)N2CCOCC2)c1 36830460 RMGDADDBZPTUJC-UHFFFAOYSA-N 456.484 0.363 50 20 JCGD CCS(=O)(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CC1 728213024 AYBMRWGBZDXWGI-UHFFFAOYSA-N 473.621 0.128 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)C3=NN(c4ccccc4)[C@H](C(N)=O)C3)cc2)CC1 728214556 RQAVARLLSMEAJC-FQEVSTJZSA-N 485.570 0.186 50 20 JCGD CS(=O)(=O)c1ccc(Cl)c(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728854306 QCIYSTZWPLQXHJ-UHFFFAOYSA-N 473.964 0.760 50 20 JCGD CC(C)(C)OC(=O)NCCCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 729054348 RWNBAACQAWTLBT-UHFFFAOYSA-N 485.563 0.566 50 20 JCGD O=C(NNC(=O)N1CCOCC1)c1cc(S(=O)(=O)NC[C@H]2CCCO2)ccc1Br 745992543 DBQSDMXXIHUSFN-GFCCVEGCSA-N 491.364 0.593 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)NC1CCN(CC(F)F)CC1 747309191 CHTMOUMEZFWFKR-UHFFFAOYSA-N 475.518 0.381 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Nc1cc(C)on1)c(=O)n2Cc1ccccc1 754582419 XFQZTCQLGDJAEL-UHFFFAOYSA-N 466.458 0.577 50 20 JCGD Nc1nc(Cl)c(C=NNC(=O)Cc2csc(N3CCOCC3)n2)c(N2CCOCC2)n1 874095825 ZOXKILWTCKMFAO-UHFFFAOYSA-N 466.955 0.535 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@H](NC(C)=O)C(C)C)N(S(C)(=O)=O)CC2 913161451 MVUWVEAPUBZAET-OXJNMPFZSA-N 484.575 0.261 50 20 JCGD O=C(COC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1)NNC(=O)[C@@H]1COc2ccccc2O1 914821027 XIOUASABCAEJAD-SGTLLEGYSA-N 475.404 0.848 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)c3ccc(F)cc3Br)cnc2n(C)c1=O 918341581 PVJKENXZRNXKBC-UHFFFAOYSA-N 450.224 0.609 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCO3)C2)C1 1778275475 KQGHHTKEBOUGPG-XQBPLPMBSA-N 451.951 0.317 50 20 JCGD C[C@H]1CCc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)n[nH]c21 1778602490 URZQAOKVMFDPEJ-OFJJYEOVSA-N 466.347 0.581 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1C[C@]1(F)Cl)C2 1779374685 CENWJOBVRTVJRP-KQEPKPNTSA-N 453.902 0.737 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(-c4cccs4)on3)C2)C1 1779565431 LFKHSHRJCCANII-QFIPXVFZSA-N 467.312 0.840 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnn1C)C2)NC(=O)NCc1ccccc1 1780558682 CQSRRXOUPKDBFD-PXDATVDWSA-N 497.600 0.894 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1781230571 VULGKAFERHAQHJ-MOPGFXCFSA-N 458.346 0.696 50 20 JCGD N#Cc1cc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1F 1781301031 MBOCJZYONBCLDV-HSZRJFAPSA-N 466.473 0.382 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1 1783662732 DJULAZCIVROTRS-GOSISDBHSA-N 451.358 0.671 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2 1783664490 GJKLMBYCRRCQRZ-UPQSEYGOSA-N 493.561 0.020 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccnc3CS(C)(=O)=O)CCO2)C1 1783872814 HQKNBWOFTLKFLH-HNAYVOBHSA-N 459.952 0.324 50 20 JCGD C[C@@H]1[C@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CCN1C(=O)OC(C)(C)C 1783939858 MNZRCWHFFNDTGS-QZTZHPFYSA-N 495.621 0.835 50 20 JCGD CC(C)(C)OC(=O)CCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1784136086 CXQJVBJZZNNOJA-SNRMKQJTSA-N 489.573 0.790 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(CCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1785538407 NHWJXSMHFZLZPQ-OAHLLOKOSA-N 450.380 0.462 50 20 JCGD COc1ccc([C@@H]2C[C@@H]2C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)cc1 1786978705 MRANQTOKSVAULQ-NHKCCNDQSA-N 478.354 0.772 50 20 JCGD COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)c1 1787508881 ZSXQFROXMCWORS-MDUUWBQSSA-N 468.514 0.818 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4cn[nH]c4cn3)[C@H]2C1 1788465935 MOIDXQVDFAHHHY-VWKLLQQASA-N 478.513 0.685 50 20 JCGD CC(C)c1nc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)no1 1791288102 XWZFGKDOHASKIG-JYJNAYRXSA-N 450.540 0.088 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4c(Cl)cccn34)C[C@@H]21 1791289322 SRRJVQWYDYGHQJ-MPGHIAIKSA-N 476.965 0.954 50 20 JCGD COc1cccc(OC)c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791291114 ZRERKZCEUUFMST-BXWFABGCSA-N 462.547 0.670 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC1(c2ccc(NC(=O)CCC(=O)NN(C)C)cc2)CCC1 1791603398 VTOMKLWOSAAXCU-HXUWFJFHSA-N 483.573 0.964 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C[C@H]1O 1792451326 IAAVIOFWXCOSDI-UCIFAOBLSA-N 489.997 0.448 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1[C@@H]2CCC[C@H]1c1ccccc1N2 1795498802 LKQMYQVFASMCCY-IBWAHOODSA-N 489.381 0.948 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)C(F)(F)C(F)(F)C(=O)O)C2 1798439545 HTODIKSNLGVRRL-ILWJIGKKSA-N 461.372 0.292 50 20 JCGD CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cn2c(nc1=O)SCC2 1799072007 FZYCIAUHTUHKTI-JYYAWHABSA-N 454.980 0.889 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cc[nH]n1 1800287633 BXSRNIGYYZGXDC-VTEUUUEMSA-N 457.443 0.689 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1O 1800827378 TYJJPCPQDGVVMV-REPLKXPHSA-N 451.288 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccccn3)CC1)C2 1801012637 SVYDGLOYSIQHIC-BBIADKPPSA-N 472.590 0.261 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)c1ccc(B(O)O)cc1 1801382105 UCUMKLCEIHYVOO-HTUFRPJOSA-N 477.370 0.254 50 20 JCGD Cc1nc(O)c(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc1C 1804878362 KNFUUQQNBKOQBF-NQIIRXRSSA-N 475.314 0.507 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1 1805034386 PSXOAYMYARBCMG-IIBYNOLFSA-N 473.509 0.870 50 20 JCGD COc1ncccc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1805599542 FIMGACCOYUVPML-WIYYLYMNSA-N 460.299 0.798 50 20 JCGD CC(C)(NCCC#N)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1807148096 VAOONIICXWJNFD-YLJYHZDGSA-N 478.557 0.682 50 20 JCGD Cn1ncc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)c1Cl 1807373845 DAODVGPFWXYGKR-APWZRJJASA-N 467.722 0.782 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1 1810181253 CDOKLSLCJINDRR-SUMWQHHRSA-N 494.430 0.505 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1 1810300140 XDSPPBBGJPUSHV-QRWLVFNGSA-N 477.481 0.113 50 20 JCGD Cc1cnc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1810300365 XQYNYKIMFIXKJC-OXQOHEQNSA-N 460.498 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@H]1c1cccnc1 1810305606 MZBQXHAFHKXWOE-ZRWHEIHHSA-N 464.526 0.967 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccnc2c1OCO2 1811310632 VTEBHIJJSUKDQX-FXAWDEMLSA-N 474.282 0.519 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@@H]1CCN(C(=O)c3cnccc3C(=O)NN)[C@H]1c1cccnc1)CCC2 1812225605 JUIOJLFDDADNCV-KKSFZXQISA-N 488.552 0.936 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1814218090 BOHBDZUHCLJGSG-CUSZFKRNSA-N 497.980 0.456 50 20 JCGD COCCOCCOCCOCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1 1814877565 DPRDFQHIPQFYLH-IAGOWNOFSA-N 476.958 0.698 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](N)c3ccccn3)sc2C1 1815016523 PSCXLQLTFDVCCN-PIGZYNQJSA-N 466.527 0.462 50 20 JCGD CC(C)n1nc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1C(=O)O 1815355575 WKDGUWKWDAXVQF-CQSZACIVSA-N 497.342 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1nnc3ccccc31)CC2 1819792875 DEVCQSPHHRMBCF-GFCCVEGCSA-N 491.537 0.812 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1CCCC1)CC2 1819801286 HTUQDUNKHSOEMP-ZDUSSCGKSA-N 457.560 0.853 50 20 JCGD Cn1ncc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c1Cl 1821005433 AJIGVBGJAACIAM-GFCCVEGCSA-N 459.724 0.749 50 20 JCGD CSCC[C@@H](O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1822433558 IIUQCPIPKHDCDU-HZPDHXFCSA-N 461.548 0.828 50 20 JCGD O=C(c1n[nH]c2c1CCc1ncccc1-2)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830730736 DDLVXZRAAPKQJH-JTSKRJEESA-N 475.933 0.240 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)NS(=O)(=O)CC)C2)C1 1831640952 TXKYJKJLIIRMPN-VKJFTORMSA-N 453.989 0.178 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cn[nH]c3)CCO2)C1 1832934380 GJXQQLDSAYRDSQ-HTAPYJJXSA-N 499.996 0.931 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c(F)ccnc1Cl)CCO2 1833256840 JFEATKZAUBHJEN-FQEVSTJZSA-N 471.917 0.317 50 20 JCGD O=C(c1ccc(Br)nc1F)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833256940 XAKLDRHECZCGJK-YVEFUNNKSA-N 480.718 0.653 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1 1833451311 VCHJJWNWIBZVDN-UONOGXRCSA-N 481.457 0.669 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1833489509 XWRMKJPMXJCRQI-XIKOKIGWSA-N 471.308 0.276 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)CC3CCOCC3)CC2)CC1 1834631737 RXIOIPYKQCGFBZ-UHFFFAOYSA-N 451.612 0.748 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797565 ZROXXRFKTUWACW-GOSISDBHSA-N 467.379 0.084 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CSc3ccccc3)CCO2)C1 1835092150 HXBBPGACXZNFAT-HSZRJFAPSA-N 485.566 0.547 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)n3cncn3)CC2)CC1 1835118048 LLQSINLDSAPGTG-TXMABLNQSA-N 483.577 0.545 50 20 JCGD C[C@H](CN)C(=O)N1CCC(N2CCC(NC(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1836343841 JLXWRTFATXIIFW-LJQANCHMSA-N 487.649 0.499 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4[nH]ncc4c3)CCO2)C1 1836815055 JBRDWJWLKWBOKN-KPZWWZAWSA-N 452.309 0.811 50 20 JCGD Cc1cc(C)nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837457813 SLTMUEVQHXHLTL-HSZRJFAPSA-N 468.514 0.081 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)(Cl)Cl)C2)C1 1837460332 BPVIKHRFAVTMGI-INIZCTEOSA-N 480.736 0.125 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc4cn[nH]c4cn3)CC2)CC1 1837921306 WWROOFOYTXYNNG-UHFFFAOYSA-N 477.330 0.564 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)cc1F)CCO2 1839005871 REFGWAQWUKQREW-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C#N)CC3)C2)C1)NC(=O)NCc1ccccc1 1839054112 HGBUSGPNCVNEQV-DEOSSOPVSA-N 484.557 0.093 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839106114 BGDGZSJIUCURGK-XLIONFOSSA-N 487.439 0.254 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3ccoc13)CCO2 1839586696 RAKUGFHJQVLDRQ-DEOSSOPVSA-N 464.283 0.496 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cccnc4nc3O)C2)C1 1840155141 QWDJTXLDBKMUKH-IIBYNOLFSA-N 464.906 0.659 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3csc4c3CCCO4)C2)C1 1840183985 MUHXWGDFJWKFPL-QFIPXVFZSA-N 480.587 0.516 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncccc3C(F)(F)F)C2)C1 1840185787 SQYDTBDLXNPRBT-FQEVSTJZSA-N 487.479 0.543 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC12CN(C(=O)COc1ccc(O)nn1)C2 1841925284 HVEXPQMIVKUKBK-ZDUSSCGKSA-N 469.926 0.897 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)CCc2c(C)nc(N3CCOCC3)[nH]c2=O)cc1 14369122 XJXCZXJZGQDUOX-MRXNPFEDSA-N 473.530 0.861 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)c1cc(S(=O)(=O)N2CCCC2)ccc1Br 16786087 BROGKXCBZINKSE-NSHDSACASA-N 494.389 0.429 50 20 JCGD CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)CC1 728065463 SBLDWJKGGZNVHY-UHFFFAOYSA-N 465.620 0.844 50 20 JCGD COc1ccc(CN2C[C@@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)cc1 728846201 NAYYUNJCSVJUQH-SFHVURJKSA-N 452.515 0.898 50 20 JCGD O=C(CN1CCC[C@H](NS(=O)(=O)c2cccc(F)c2)C1)NNC(=O)c1cccc([N+](=O)[O-])c1 729481872 HDTZOCKMWOUCQD-INIZCTEOSA-N 479.490 0.938 50 20 JCGD CC[C@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1cccc(S(N)(=O)=O)c1 729612813 JBENNCZCPHUIJD-INIZCTEOSA-N 458.500 0.676 50 20 JCGD CC(=NNC(=O)[C@H](C)CN1C[C@H](C)O[C@H](C)C1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 729816577 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnncc3C(=O)O)C2)C1 1779525158 HVDIKZQCSNLSMB-JOCHJYFZSA-N 499.436 0.766 50 20 JCGD Cc1cnoc1C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779935838 AIRSMSCZZCNCBL-QHCPKHFHSA-N 470.530 0.773 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780095891 YZIVPJBEQOHDLD-OAQYLSRUSA-N 495.510 0.870 50 20 JCGD COCCOCCOCCOCCC(=O)N1CC[C@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2 1781382994 FKOQZFFBXAYEOG-QFIPXVFZSA-N 490.670 0.754 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1783663891 PPWOWFVKMACCKR-VQIMIIECSA-N 465.385 0.917 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1=CCN(C(=O)OC(C)(C)C)C1)CCO2 1783933235 FIEIRQDTIKAGGK-QHCPKHFHSA-N 479.578 0.366 50 20 JCGD O=C(CN1CCc2sccc2C1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785099860 HYUUXZWDOAHYIX-JBACZVJFSA-N 483.399 0.080 50 20 JCGD COc1cncc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1785267022 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450.923 0.070 50 20 JCGD CNc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)cc1 1788610625 MWERTFUBHCAUDX-YSSFQJQWSA-N 452.515 0.634 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4cccn4)nc3)C[C@@H]21 1788611308 TYNCNERORSVBGN-VDGAXYAQSA-N 490.524 0.173 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c(=O)cn3)[C@H]2C1 1789294104 WWVOCFMTKORPDF-YXWQFLTLSA-N 483.953 0.495 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccnc3C)[C@H]2C1 1790649439 KJEPUFMDZHGIKL-ZPSROVLTSA-N 455.519 0.305 50 20 JCGD N#Cc1ccccc1OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1792146998 HJSQIZZRHJQMHP-LRQRDZAKSA-N 478.509 0.229 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CC(=O)N(c2cccc(OC)c2)C1 1792428622 FTMIJFBAQWTQOO-UWSBPGRWSA-N 479.961 0.892 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1793594628 CRCIYBCUOYLHJD-HNJRGHQBSA-N 487.362 0.039 50 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O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)[C@@H](F)Br)N1 1800161527 IWIMDAABWRCMBC-WBWNACRCSA-N 491.383 0.495 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1800283871 HEJBLEAURZRIPE-RDBQEKCUSA-N 461.244 0.037 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2 1800978138 LUORTZOXBOCNSG-ZWUHOBOKSA-N 474.905 0.028 50 20 JCGD CCn1nccc1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1805915701 DIGZWSRKLRURMY-OXQOHEQNSA-N 462.514 0.930 50 20 JCGD COc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1807363763 FPDKLDHJZYRGMR-GCJKJVERSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@@H]2Cc3ccccc3CN2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365517 XMIDOEKLFMNYDQ-HVCNVCAESA-N 484.365 0.796 50 20 JCGD COc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1 1807373910 DOZHOQMSIABTRB-UTKZUKDTSA-N 461.287 0.193 50 20 JCGD Cc1cc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)nn1C 1810295145 RBOZZXKGRJUZQH-JTSKRJEESA-N 476.541 0.684 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCc2ccc(O)nn2)[C@H]1c1cccnc1 1812327066 QRKMARFGXWSNDK-KSFYIVLOSA-N 490.524 0.528 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813070090 GCFHRKUJWMUVQS-XMSQKQJNSA-N 471.562 0.617 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc3ncccn3n2)[C@H]1c1cccnc1 1813070949 ONRHEVUTOPABOS-JTSKRJEESA-N 464.530 0.817 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]cnc4n3)sc2C1 1815333496 NTBVCVZZVOMSHI-DTWKUNHWSA-N 451.896 0.354 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1nccc3nc[nH]c13)CC2)c1ccc(B(O)O)cc1 1815340307 ITKAVBVLKSAERB-ZDUSSCGKSA-N 462.300 0.634 50 20 JCGD Cc1nnc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)s1 1815354647 OTUWQIAYHVAFEL-CYBMUJFWSA-N 457.346 0.451 50 20 JCGD Cn1nc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)c2c1CCC2 1817476649 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CN1CC(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCN3C(=O)OCc2ccccc2)C1 1828551887 XDPMIQPUKTXXPE-AUSIDOKSSA-N 478.977 0.600 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@@]2(C1)CN(C(=O)C1CC1)CCN2C(=O)OCc1ccccc1 1829443141 BMUOEDQYHCMFRG-AREMUKBSSA-N 491.353 0.842 50 20 JCGD CN(CC(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2cnnn2)CC1)NC(=O)NCc1ccccc1 1830166516 ZRUUSISXNFBIIY-NRFANRHFSA-N 497.604 0.639 50 20 JCGD O=C(c1cc(=O)c2ccccc2o1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830307032 UWPMHAVEHPCWBX-KKSFZXQISA-N 450.875 0.463 50 20 JCGD CC[C@@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1830513345 CIPOOUWIAZZUEF-BXTJHSDWSA-N 463.959 0.346 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830538718 NTEPQZUMYNXWHO-YXRQIMCMSA-N 498.378 0.608 50 20 JCGD O=C(c1cc2ccc(Cl)cc2nn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830727763 DFTNCUXMCXQHJY-PXNSSMCTSA-N 469.325 0.953 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cc2NC1=O 1830732876 WYCKQCLNWLOGQZ-CQURBHOASA-N 467.906 0.076 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832078573 IRUCDPMAQRBEDJ-HOIFWPIMSA-N 489.997 0.832 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1 1832147647 DGEZESAEXOYTBG-SFHVURJKSA-N 457.365 0.510 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3csnn3)C2)C1 1832549030 BXLQPXBOMUMXCS-DJJJIMSYSA-N 489.982 0.740 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835940919 DROYGBPHXMRQSR-HOYKHHGWSA-N 452.316 0.240 50 20 JCGD COc1ccnc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1OC 1836208501 NWJYDSCLQDGDEW-UHFFFAOYSA-N 496.373 0.278 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CS(=O)(=O)N3CCCC3)CCO2)C1 1836515993 YTTPHGKZVKLPRK-QFBILLFUSA-N 466.000 0.276 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(OC2CCN(C(=O)C(O)O)CC2)CC1 1836631206 VNMOXKVPKBGXDG-UHFFFAOYSA-N 465.459 0.443 50 20 JCGD Cc1nn(C)c(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1F 1837337491 ZGYOBNWBKSTUGH-UHFFFAOYSA-N 487.536 0.792 50 20 JCGD CC(C)(C)c1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837458812 DUYGCYGHUAUVQZ-XMMPIXPASA-N 497.556 0.156 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1O 1837459544 JJVBBWORTFLXHN-QHCPKHFHSA-N 469.498 0.083 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccn(C(F)F)c3=O)CCO2)C1 1837772063 JPHHLFFGBNNHEO-LIRRHRJNSA-N 463.865 0.567 50 20 JCGD O=C(c1cncc(C(F)(F)F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838179914 UMHZDZFXBRMTJT-PBHICJAKSA-N 451.829 0.770 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1838404348 NRSKZIDKXJDLIR-AZUAARDMSA-N 466.406 0.872 50 20 JCGD O=C(CN1CCSCC1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839197470 XLLVGOFRAUGAOW-GDBMZVCRSA-N 454.362 0.182 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839198447 DPSGSNISROSIPR-ZJNRKIDTSA-N 498.346 0.019 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839199790 UUELMTLYRYATDK-VEVIJQCQSA-N 498.346 0.019 50 20 JCGD Cc1cc2nnc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](F)Br)CCO4)c(C)n2n1 1839200411 HLWWTXNEGDYGCZ-MAUKXSAKSA-N 485.314 0.502 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cc1 1839203742 UXLBHXDPYJWIRN-RDTXWAMCSA-N 458.284 0.546 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1839964721 ARXYQMYYZKZSKL-AUUYWEPGSA-N 466.336 0.973 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)c3cccn3C)C2)C1 1839967537 PSKZCQUFJDJKDB-KUHUBIRLSA-N 456.337 0.838 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4cnnc4)cc3)C2)C1 1840151894 QKIQVCCJVXMJAC-WIYYLYMNSA-N 463.922 0.591 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(N4CCOCC4)cc3)C2)C1 1840152793 UBXHDUDOUURHON-NFBKMPQASA-N 481.977 0.847 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCCC3(F)F)C2)C1 1840182456 JLQLJHQATDZAQP-UZLBHIALSA-N 460.522 0.641 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCNC(=O)C1)CCO2 1840234308 WKYYWQDCAYIODG-JRDZDNNQSA-N 488.491 0.854 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)n1cc(C)cn1)CCO2 1840403754 OPUPBBHRPDGOJE-WVGGCUBWSA-N 485.545 0.343 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)CC3Cc4ccccc4C3)CCO2)C1 1840932188 XTNSAKYTMSUTSW-SANMLTNESA-N 493.564 0.560 50 20 JCGD C[C@@H]1[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CCN1C(=O)OC(C)(C)C 1840962293 PNZBCIAGZVMZTP-PEOGOYOCSA-N 489.997 0.688 50 20 JCGD C[C@H]1[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)CCN1C(=O)OC(C)(C)C 1843015767 YKVZQZZOVTXTDP-LPHOPBHVSA-N 471.363 0.829 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC2(CCCN2C(=O)c2cc([N+](=O)[O-])ccc2OC(C)=O)C1 1844692716 CATVQPLINMGGBX-IBGZPJMESA-N 491.453 0.832 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)Cc1ccc(Br)nc1)C2 1846385415 CKJRMJQDHDNLKY-UHFFFAOYSA-N 452.353 0.963 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1 9930680 JIEBSSNNTOQZOR-GFCCVEGCSA-N 498.410 0.976 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)n(C)c1 16203016 CSMQVBOAZYSXDL-UHFFFAOYSA-N 484.604 0.732 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)COc2cc(C)ccc2C)c1 17202913 CNKIAVXZDWHDDR-UHFFFAOYSA-N 464.544 0.722 50 20 JCGD O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 23723156 SLFZGGRALZDLOK-UHFFFAOYSA-N 489.510 0.960 50 20 JCGD COc1ccc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c(O)c1 28580944 NJVNMKPLKJBOBL-UHFFFAOYSA-N 463.512 0.816 50 20 JCGD CCOc1ccc(S(=O)(=O)N[C@H](CCSC)C(=O)NNC(=O)N2CCOCC2)cc1 745992996 RLPOHPOLRWROSS-MRXNPFEDSA-N 460.578 0.558 50 20 JCGD N#C/C(=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1)C(=O)NNC(=O)C(=O)N1CCCC1 748244988 JMTHIXYXRNDZHF-RVDMUPIBSA-N 483.916 0.756 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@H](C)Oc2ccc(F)cc2)cc1OC 769572447 CSJVBTALORSBCZ-LBPRGKRZSA-N 455.464 0.736 50 20 JCGD NC(=O)C[C@@H](NC(=O)c1ccccc1Cl)C(=O)NNC(=O)c1cc(Br)c[nH]1 786803190 FSAIYRYKAMGPFG-GFCCVEGCSA-N 456.684 0.866 50 20 JCGD O=C(COC(=O)CN1C(=O)COc2ccc(Cl)cc21)NNC(=O)[C@@H]1COc2ccccc2O1 817810875 AXNAWABSYSLMFW-KRWDZBQOSA-N 475.841 0.596 50 20 JCGD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)COc3ccccc3OC)C2=O)cc1 863998995 IPHSFWXZJYZCFW-JOCHJYFZSA-N 456.455 0.697 50 20 JCGD Cc1ccc(S(=O)(=O)c2ccc(NNC(=O)CNS(=O)(=O)c3cnn(C)c3)cc2)cc1 915638640 OSCAMROSOWXVAL-UHFFFAOYSA-N 463.541 0.983 50 20 JCGD CN(C)c1ccc(CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 915927470 PCIWDQQULWPENS-UHFFFAOYSA-N 461.544 0.918 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)N[C@H](C)Cn1ccnc1)N(S(C)(=O)=O)CC2 916623406 RKMNVRKHYYIZJA-PBHICJAKSA-N 494.574 0.568 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)CS(=O)(=O)N1CCN(c2cccc(C)c2)CC1 919822405 SRLKWBTZHCQTPE-UHFFFAOYSA-N 460.556 0.846 50 20 JCGD CCC(C)(C)C1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1)C2=O 919885049 MIVSHCYTSORRRW-LQZXRHCMSA-N 471.580 0.421 50 20 JCGD O=C(NNC(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O)N[C@@H]1CCS(=O)(=O)C1 919886540 SHAAANJFXCFONN-YPMHNXCESA-N 459.322 0.320 50 20 JCGD CC(C)(C)OC(=O)NC1(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1779036234 YTQYNFMJPDKSKW-JOCHJYFZSA-N 488.545 0.186 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1 1779539636 HZOHMJNYTFEDMW-GPMSIDNRSA-N 463.673 0.680 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ncccc3Br)C2)C1 1779650069 RPBHFRXWLIHHCF-HXUWFJFHSA-N 474.120 0.281 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3cccc([N+](=O)[O-])c3=O)C2)C1 1782785220 DULAFGNCHXBATD-SCLBCKFNSA-N 471.308 0.617 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)CCO2 1783538935 VDQNURPUISTEIZ-WTOJCKNJSA-N 491.383 0.368 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)c3ccco3)[C@H]2C1 1783561255 WCKRICNFPSQQMB-BCCZOVBCSA-N 457.487 0.427 50 20 JCGD COc1ccccc1OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 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0.667 50 20 JCGD CC[C@@H](C)[C@H](N)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1795551156 JRSNZYMGLLRGSW-JTIOYYDXSA-N 474.606 0.296 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(CS(C)(=O)=O)nc1 1796076543 KXERITHTHPIILT-HGKCTWBKSA-N 469.636 0.681 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C[C@H]1CCOC1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1796448590 AYRNOCFWYHTHMK-LVZMMCSGSA-N 489.997 0.496 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3ccc(Cl)cc3n1)C2 1797750588 KNYWTZXJPHFEDW-DBWKPXFBSA-N 483.916 0.503 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1cnc[nH]1)C2)NC(=O)NCc1ccccc1 1799094826 ANMRHDSMWCJIPH-BBIADKPPSA-N 483.573 0.278 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)NS(=O)(=O)CC)C2 1800639977 DPEBYQDTYOTFDB-RKQHYHRCSA-N 454.387 0.077 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(S(C)(=O)=O)c(F)c1 1801870688 MLMRVPRIVDDWBZ-UMPJEAMMSA-N 462.927 0.686 50 20 JCGD O=C(CCBr)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1806346950 QHHUEOZTTWOZDO-APWZRJJASA-N 457.369 0.159 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H]2CCC(=O)N2)[C@H]1c1cccnc1 1806637834 TZQBBBYAJRBKOT-ZOCUSQIASA-N 465.514 0.500 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807362122 DUXZZOYQESOPBM-KPDCDPCYSA-N 473.342 0.977 50 20 JCGD Cc1cc2nnc(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)c(C)n2n1 1809184355 AJTKFVJQDONJNA-XXBNENTESA-N 499.340 0.449 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1811068630 SONAKPUQKVRVKX-AUSIDOKSSA-N 473.342 0.856 50 20 JCGD CN(CC(=O)N1CC[C@H](CNC(=O)CNC(N)=O)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1814229147 ATDFKZGXQCICBW-DENIHFKCSA-N 496.572 0.102 50 20 JCGD Cn1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1=O 1815337655 VHMBIWMXTITNTK-CQSZACIVSA-N 452.301 0.061 50 20 JCGD Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nc2nccn12 1815359785 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NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)CCc3ncc[nH]3)sc2C1 1826517536 SVPFWFVJQQUEQZ-NSHDSACASA-N 454.516 0.723 50 20 JCGD O=C(Cc1ccc(O)cn1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1827051667 OUBDRGXZIOMEFX-OAHLLOKOSA-N 452.301 0.392 50 20 JCGD Cn1cc(CCC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)cn1 1827090675 NPHHEWNGRVUBBR-JOCHJYFZSA-N 452.364 0.966 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1 1830719864 MVACMODLVDAEKU-BTYIYWSLSA-N 475.970 0.347 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1831464030 NYBKAPMCFNHHQE-KBRIMQKVSA-N 459.392 0.360 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831876103 AITBNWXYZDJHEP-NHCUHLMSSA-N 489.621 0.450 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1)n1cncn1 1832203777 MIHIGMJVHUHNJY-DNVCBOLYSA-N 454.535 0.771 50 20 JCGD CC[C@H](O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549400 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O=C([C@@H]1Cc2ccccc2CN1)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836485039 MUVGDIPVMRJNRB-ABSDTBQOSA-N 470.339 0.848 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)n1ccnc1 1836777291 CYPXHQDAHPSVFF-KRWDZBQOSA-N 454.336 0.436 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(C(F)F)c3)C2)C1 1837456363 GWNGSFKIGFRVSH-QFIPXVFZSA-N 490.467 0.402 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ncccc34)C2)C1 1837458796 CTNNVEVEWBUMAU-VWLOTQADSA-N 490.520 0.617 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CS[C@@H]3CCCCO3)CCO2)C1 1837510387 KZSVAHFWYVCPCC-WDYCEAGBSA-N 450.985 0.956 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C(=O)Nc1cccnc1)CCO2 1837629885 RDIXGSGGAMABCF-FQEVSTJZSA-N 450.568 0.328 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1838542542 HXNIUWZMZONCCD-PXNSSMCTSA-N 470.910 0.331 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1c(F)cccc1F)CCO2 1838996471 RZOGVZXBTNPNHE-JOCHJYFZSA-N 468.501 0.337 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4[nH]cnc(=O)c4c3C)C2)C1 1839146742 VCSNHYLLPDSWQS-QRWLVFNGSA-N 451.911 0.418 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839155166 LXQCILSETUGVRW-JHVJFLLYSA-N 487.384 0.893 50 20 JCGD CC(C)n1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1C(=O)O 1839197724 GQDOGJXIDYMGHD-KBXCAEBGSA-N 491.314 0.923 50 20 JCGD Cn1c(=O)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)nc2ccccc21 1839201421 XICKZXLRPPFXDB-UZLBHIALSA-N 497.321 0.694 50 20 JCGD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839203456 LRMKCOOOLDAWGC-CSGFNCJESA-N 489.294 0.964 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)ccc1Cl)CCO2 1839327551 QCRCLVVDIJRJTN-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(C)n(C)n3)C2)C1 1839961612 CQRDFYWAXVYYTD-LPHOPBHVSA-N 457.369 0.901 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3CCN(C)CC3)C2)C1 1839963425 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Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)cc1 12800183 SZDFLBCMFZFINW-AWEZNQCLSA-N 467.573 0.725 50 20 JCGD Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2c(C)noc2n1 14231826 WKNKJWZJEVEIEW-UHFFFAOYSA-N 459.484 0.935 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1N1CCOCC1)c1ccccc1F 104779832 ONEAXTDHWHUXAQ-UHFFFAOYSA-N 492.529 0.758 50 20 JCGD CCCN1CCCC[C@H]1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 109445303 UAGAKWVLFSVSIA-IBGZPJMESA-N 495.584 0.840 50 20 JCGD COc1ccccc1NC(=S)NNC(=O)Cn1cnc2c(c(Br)nn2C)c1=O 727176692 XXZNDYJHTHODQN-UHFFFAOYSA-N 466.321 0.919 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1nc(C)no1)N(S(C)(=O)=O)CC2 727230573 SIVTXDWYURNYBY-CQSZACIVSA-N 482.519 0.175 50 20 JCGD COc1ccc(N2C[C@H](C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2=O)c(OC)c1 728845152 HJSLYAXQFSETSD-MRXNPFEDSA-N 468.514 0.911 50 20 JCGD CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1 730569396 YHAOVBLZEORXDU-UHFFFAOYSA-N 494.599 0.286 50 20 JCGD O=C(COc1ccccc1O)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 730821836 RTPKEKGPNFVXDE-UHFFFAOYSA-N 464.500 0.323 50 20 JCGD C[C@@H](COCC(F)(F)F)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 743340788 BASZKWJIJXQVIL-LBPRGKRZSA-N 468.454 0.619 50 20 JCGD O=C(COC(=O)CCC(=O)c1ccc2c(c1)OCCO2)NNC(=O)[C@@H]1COc2ccccc2O1 762407889 MAWBTOSOZNSYEV-FQEVSTJZSA-N 470.434 0.951 50 20 JCGD COc1cc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3c(C)n[nH]c3C)CC2)cc(OC)c1OC 813633337 JONVZVXWDFCECU-UHFFFAOYSA-N 495.558 0.914 50 20 JCGD Cc1cccc(O[C@H](C)C(=O)NNC(=O)Cn2c(=O)oc3cc(S(N)(=O)=O)ccc32)c1C 817782059 NMLMDBWRMWZIHJ-CYBMUJFWSA-N 462.484 0.474 50 20 JCGD O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc(I)ccc1-n1cnnn1 859435911 WLZVVXNCXIEHRG-OAHLLOKOSA-N 492.233 0.868 50 20 JCGD O=C(CCCNS(=O)(=O)c1ccc2c(c1)OCCO2)NNC(=O)[C@@H]1COc2ccccc2O1 913416698 QDNVFLKHUHYLEK-IBGZPJMESA-N 477.495 0.504 50 20 JCGD C[C@H](CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)CN1CCCC1 918222498 ICZAKXMAROCKDX-GOSISDBHSA-N 481.619 0.702 50 20 JCGD Cn1nc(SCC(=O)NN=C2CCOc3c(Br)cccc32)c(=O)n(C)c1=O 920370283 GLDRKFQPPNGRQF-UHFFFAOYSA-N 454.306 0.637 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)[C@H]1Cc2ccccc2CN1S(=O)(=O)c1ccc(F)cc1 920827555 UIYCBQCWVCKQRY-LJQANCHMSA-N 474.514 0.711 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779036886 ICFMFKFUHYTLRJ-DEOSSOPVSA-N 481.509 0.619 50 20 JCGD COc1ccc(C)c(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779036908 IIFYPPAUBBTGSD-HSZRJFAPSA-N 453.499 0.759 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)n1 1779237761 ZBNWCNNZEXBSKL-KSSFIOAISA-N 459.316 0.807 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1779310106 HYCBYLLVXFKSHY-GCKMJXCFSA-N 490.985 0.100 50 20 JCGD C[Si](C)(C)c1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)co1 1779350418 DZVZVVPWMAOKHJ-HYBUGGRVSA-N 484.434 0.946 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncnn1C)C2)NC(=O)NCc1ccccc1 1780558987 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CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3C=CCN3)C[C@@H]21 1785076449 IEPMYQCZKWCUMB-WOYTXXSLSA-N 456.971 0.626 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc(OC)c1C 1785175029 AYGSGYVXNLNFNT-XMMPIXPASA-N 468.315 0.449 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cc(F)ccc3F)C2)C1 1785359800 BPFQARGKMDCXDG-QFIPXVFZSA-N 459.453 0.650 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc[n+]([O-])c3)C[C@@H]21 1787506845 QKZVIQHVPRUHOP-QECDCCOMSA-N 454.487 0.047 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)on1 1789724600 ACMFTSVDNHCQAA-BVSLBCMMSA-N 498.584 0.851 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3ccc4c(c3)CCO4)[C@H]2C1 1791004802 IAQKRGXROGOWCD-ZJOUEHCJSA-N 458.559 0.517 50 20 JCGD O=C(CCc1ccc(F)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1791096468 IJBQSWISONKLTR-NYVOZVTQSA-N 454.307 0.732 50 20 JCGD CC(C)(C)OC(=O)N1C[C@](C)(O)C[C@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1791124067 PEBOSLGEYAKULD-YSMZAPSNSA-N 489.997 0.326 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)c3ccc(Cl)cc3)C[C@@H]21 1791288113 ZKEFYIMSCIJEKU-SZMVWBNQSA-N 464.950 0.875 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1C[C@@H]1c1ccc(F)cc1 1792807448 OVXYQLCOGFZZQM-XWMYTOBWSA-N 467.501 0.831 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1cccnc1 1793146495 BWTNJULYIFYODW-CWQOZTLDSA-N 482.965 0.837 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCSC(=N)N 1795585130 VQTMMBYVJCTIDG-XFMPKHEZSA-N 478.015 0.725 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(C)nc3ccccn13)C2 1796442055 PKFXUQOHXFXWGK-XSLZEOFGSA-N 477.525 0.980 50 20 JCGD C[Si](C)(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)co1 1797726309 IZAILLCRDFTCRD-CCWDJLKJSA-N 471.590 0.340 50 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O=C(NC[C@H]1CCN(C(=O)c2ccc(-n3cccn3)nc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362964 XSQNELWDKVLUPM-HYBUGGRVSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365874 ZLUZSVCNEOXCRS-GCJKJVERSA-N 475.314 0.374 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807376674 XEUKDCRSRMJLIE-BSIFCXSSSA-N 462.319 0.009 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1808712493 ILHAEMXXMBDYRB-LPHOPBHVSA-N 477.529 0.886 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCCO3)[C@@H]1c1cccnc1 1809867984 NKZPHLWIKMXWOY-JTSKRJEESA-N 469.546 0.753 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(=O)Nc1cccnc1 1810462704 LOOGMWXMTVRKST-WIYYLYMNSA-N 473.298 0.115 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1 1812775469 HYKXOHNHXXQETF-LSTDLKDCSA-N 469.380 0.912 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 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CCC(=O)N[C@H](C)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401568 IJAHRZVUEGIZHI-WBMJQRKESA-N 456.507 0.629 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnc3[nH]ncc3c1)CC2 1819797198 PJJXNWKBBVTGOF-LBPRGKRZSA-N 477.510 0.953 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)COc3ccc(O)nn3)sc2C1 1824561964 LRYYVWQSHWXGNT-LLVKDONJSA-N 463.520 0.003 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCNC(=O)C3)sc2C1 1826218650 DAYHIRLDUUGXMG-JCRPABRNSA-N 471.543 0.715 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2)n1cccn1 1826858338 CXNJVBSWFOMJJM-VXGBXAGGSA-N 454.516 0.825 50 20 JCGD O=C(c1cc(=O)nc2cccnn12)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052212 FBPCAUSSOMOEAH-FQEVSTJZSA-N 489.341 0.316 50 20 JCGD Cn1ncnc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828549104 VNVWDYRJAIGZMO-HTAPYJJXSA-N 490.948 0.481 50 20 JCGD CC(=O)NCCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829308850 QSOLZZOGSGIZQH-XXBNENTESA-N 494.976 0.564 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725653 LNQYDCWLXXSTNL-KKSFZXQISA-N 467.906 0.041 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830739014 XJLOKQOOYJSLBB-BXTJHSDWSA-N 496.026 0.299 50 20 JCGD COc1ccccc1CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1830991665 BILYBKBEBRIJBG-RUZDIDTESA-N 482.342 0.078 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3csnn3)CCO2)C1 1831750464 ASKWNYNIZWBJJL-FQEVSTJZSA-N 491.482 0.755 50 20 JCGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@](C)(Cl)CCl)C3)C2)c(=O)[nH]c1C 1833389606 AUYNJOIQXDECML-RBUKOAKNSA-N 461.346 0.693 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cncs1)CCO2 1834464277 ZUZVOLRRDOBWFQ-BTVXTAIASA-N 460.516 0.347 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1834822149 AXURYPJUFUPRBZ-GOSISDBHSA-N 452.309 0.584 50 20 JCGD Cc1cnc2c(C(=O)NC3CCN(C4CCN(C(=O)CCC(=O)NN(C)C)CC4)CC3)cnn2c1 1835564279 ZPCYHKYHIWCSOU-UHFFFAOYSA-N 484.605 0.596 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)nc3Cl)C2)C1 1835930631 QRYJTLGAVRAMIU-OAQYLSRUSA-N 494.140 0.452 50 20 JCGD O=C(/C=C/C1CCCCC1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939559 SWLFIHBKLGUQSR-GTCGAKFVSA-N 456.348 0.573 50 20 JCGD Cc1cccc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)[nH]c12 1836853446 DDZYYUVOEFPCAV-VWLOTQADSA-N 477.326 0.540 50 20 JCGD O=C(CCBr)N1CCC(OC2CCN(C(=O)CN(CCO)CCO)CC2)CC1 1837654856 AZHQMRXTMFVSMW-UHFFFAOYSA-N 464.401 0.057 50 20 JCGD NC[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccc1 1837895574 CPIQTKGUIVZAKN-DEOSSOPVSA-N 479.386 0.721 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cnc4snnc4c3)CC2)CC1 1837919190 OSKAVXMIQZAETM-UHFFFAOYSA-N 495.370 0.692 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837949751 YRDHSWOXUDIRDY-GTNSWQLSSA-N 457.281 0.028 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC3(F)F)C2)C1)NC(=O)NCc1ccccc1 1839054163 JEKYMIJTUGYGHL-XMSQKQJNSA-N 495.527 0.444 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1839150407 LPLGTPVGTGZFHK-XYPHTWIQSA-N 474.407 0.007 50 20 JCGD O=C(c1cccn2c(O)nnc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199280 LRZSOOBPMFWUNL-PXAZEXFGSA-N 472.271 0.195 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCOCCOCCOC)CCO2)C1 1840077786 LLRJQEWYMPSGEV-YLJYHZDGSA-N 450.960 0.530 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CCO[C@]2(COCCN(C(=O)CO[Si](C)(C)C)C2)C1 1840436639 SCIFQNHQZVPVGL-OAQYLSRUSA-N 452.628 0.887 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C13CC(c4ccccc4)(C1)C3)CCO2 1840953254 BMPOWLJMLTWJCZ-RCSZBHJWSA-N 490.365 0.558 50 20 JCGD O=C(COC(=O)c1ccc(F)c(S(=O)(=O)N2CCOCC2)c1)NNC(=O)c1cccs1 10931009 NLLQOQZIVINDEO-UHFFFAOYSA-N 471.488 0.526 50 20 JCGD Cc1cc(=O)c(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)nn1-c1ccccc1[N+](=O)[O-] 12804744 HKXHMTYFHBFRNK-UHFFFAOYSA-N 485.482 0.817 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)NCC(=O)NNc2ccc(S(=O)(=O)NC3CC3)cc2)cc1 728210881 YYXJCCNHIDDAPP-UHFFFAOYSA-N 466.541 0.752 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cc2c(C)nc3cc(O)nn3c2C)cc1 729511861 YDHYWVJJKCDHKS-UHFFFAOYSA-N 460.516 0.371 50 20 JCGD COc1ccc(NS(=O)(=O)c2cccc(C(=O)NNS(=O)(=O)c3cn(C)cn3)c2)cc1 751260215 JDNMCOZNPROLGS-UHFFFAOYSA-N 465.513 0.853 50 20 JCGD CC(C)C[C@H](C(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)N1C(=O)[C@@H]2CC=CC[C@H]2C1=O 784471836 PKHREPBLCFFQFN-VIPLHTEESA-N 499.520 0.883 50 20 JCGD CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1)C2=O 789364673 BYYYWNXTVRIPAV-UHFFFAOYSA-N 485.950 0.639 50 20 JCGD Cc1c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)sc2nc3n(c(=O)c12)CCC3 849211489 ZNXRPILKSYOUAX-CQSZACIVSA-N 484.490 0.857 50 20 JCGD O=C(Cc1csc(NC(=O)c2ccc(Br)o2)n1)NNC(=O)C(=O)NC1CC1 916111085 WRIFAENGJXZNIR-UHFFFAOYSA-N 456.278 0.719 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@H](Cc1ccc(F)cc1)n1nnnc1C 916134699 XCHYXCVRPVNZHB-INIZCTEOSA-N 474.522 0.967 50 20 JCGD CC(C)[C@@H](CNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)N1CCOCC1 916254142 HMSIWCOYTCDUNF-LJQANCHMSA-N 467.592 0.772 50 20 JCGD CO[C@H](C)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 917703899 ROYBDTBCCXWMLL-OAHLLOKOSA-N 456.503 0.246 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCn2c(=O)nc(O)c3ccccc32)cc1OC 918921649 HCHWGWWCNLKDKN-UHFFFAOYSA-N 470.438 0.514 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1 920297609 KHAYSPVJOVSXME-KFWWJZLASA-N 454.549 0.554 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCc3ccc(N(C)C)cc3)nc2)CC1 1115951715 ASCLKWJHRCQZMM-UHFFFAOYSA-N 461.592 0.953 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1c[nH]c2ncccc12 1778519442 XPIYINZETUKEOY-HYBUGGRVSA-N 462.315 0.684 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1779034741 UDNVIJMAZAUNNC-XYHYBEPMSA-N 490.520 0.039 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)N(C)C(C)=O)CCO2 1780097781 JWSPATFSYQEOHE-JLCFBVMHSA-N 476.486 0.830 50 20 JCGD N#CCc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1781010823 LUDMXQYEXPRWQK-RCZVLFRGSA-N 461.327 0.874 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2CCCS2(=O)=O)C1 1781661251 SDDUWNVMFNBZAB-UMPJEAMMSA-N 451.383 0.861 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1783232440 WYHHOYGEPNAVPL-UZUQRXQVSA-N 475.546 0.402 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2CCSCC2)C1 1783294002 VKZSFWOBXXAKJB-XMSQKQJNSA-N 461.588 0.956 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCCCN3C(=O)OC(C)(C)C)C2)C1 1783573799 VJKBQDJWLCWCLI-HOYKHHGWSA-N 495.621 0.979 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CCS(=O)(=O)c3ccccc3)CCO2)C1 1783875272 HCTROMGQKNYQOQ-YLJYHZDGSA-N 458.964 0.934 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(S(C)(=O)=O)ccc1F)CCO2 1783934231 BNKTYKWZTNZGQV-NRFANRHFSA-N 484.550 0.046 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1784414771 YKQODODORMYOQZ-KSFYIVLOSA-N 455.345 0.386 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cn4c(Cl)cccc4n3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979603 CFFXWAGUNHPZDE-IEZWGBDMSA-N 482.733 0.575 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4ccc(Cl)cc4nn3)C[C@@H]21)c1cccc(B(O)O)c1 1786983032 LLCLLNKQZVXHNP-BPXKWBHBSA-N 494.744 0.870 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3noc4c3CCCC4)C[C@@H]21)c1cccc(B(O)O)c1 1786984554 SHOJEBBSDUJBLT-QSFXBCCZSA-N 453.304 0.140 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccco4)no3)[C@H]2C1 1787286945 PLOYLLFQVAGLQH-DOXZYTNZSA-N 459.503 0.901 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3cnncc3C(=O)O)CCC2)cc1)c1ccc(B(O)O)cc1 1788142498 ZUZDWGHEFUYJNS-UHFFFAOYSA-N 460.255 0.916 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncn3-c3ccncc3)C[C@@H]21 1788611500 GGGVGHDNZRGKBU-ZRCAFCQKSA-N 490.524 0.173 50 20 JCGD 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc[nH]c1[N+](=O)[O-] 1796403986 DIFDAOKLGXLWLN-DRXBFXEBSA-N 488.413 0.668 50 20 JCGD CC(C)(C)OC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1796448235 IWMKAAKYRLRAQL-BPKGMFCQSA-N 492.013 0.884 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](C)Br)C4)cnc2c1 1797067696 GZJKOGDATXEJSQ-VWPFQQQWSA-N 463.332 0.990 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2c[nH]c3nccc-3c2n1C 1798479768 QXKNJYHUHLQDLW-VPTLXERWSA-N 481.557 0.582 50 20 JCGD CSc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1O 1798562192 GUQWJSNKBWLMBN-IVWMJMPLSA-N 471.539 0.630 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccnnc1O)NC(=O)NCc1ccccc1 1799069746 ILRJHWNLUSASGR-BCDXTJNWSA-N 467.530 0.780 50 20 JCGD CC[S@@](=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097077 BHCOYYYTLILWLL-OCWQZHKYSA-N 493.630 0.081 50 20 JCGD 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465.532 0.481 50 20 JCGD O=C(NCc1ccc(CN2CCC(O)CC2)cc1)NNC(=O)c1ccc(-n2cnnn2)cc1 729494411 PXBSESCKWDTVLE-UHFFFAOYSA-N 450.503 0.763 50 20 JCGD O=C(CNC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)N1CCOCC1 745995782 BCFNBZPOPYSXQT-FQEVSTJZSA-N 451.483 0.573 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3c(c2)CCCN3S(C)(=O)=O)n1 761902786 JRGQFLPEXPSPTQ-UHFFFAOYSA-N 466.541 0.711 50 20 JCGD O=C(COC(=O)[C@H]1C[C@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1cccs1 771192290 RRSYAYQXVZMGEW-GXTWGEPZSA-N 487.943 0.530 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)CNc2ccccc2OC)c1 825624228 HRALIPTXAXCMBV-UHFFFAOYSA-N 465.532 0.147 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O 856546603 RHIRPOILYWMLOK-PMACEKPBSA-N 455.559 0.911 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)NC[C@@H]2CCCO2)c1)c1ccc(-n2cnnn2)cc1 913155915 DQZDUFCZHABBIX-KRWDZBQOSA-N 471.499 0.194 50 20 JCGD C[C@H](O)CNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 915487034 XFDVHGJDUIQUTB-LBPRGKRZSA-N 469.903 0.617 50 20 JCGD Cc1cc(C)n(CCCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)n1 915889476 BHERFPAMNZSRDI-UHFFFAOYSA-N 450.569 0.547 50 20 JCGD Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 917271025 CAIDJAPAZMFAHB-VQIMIIECSA-N 484.444 0.435 50 20 JCGD O=C(NNC(=O)[C@@H]1CCN(c2cccc(Br)c2)C1=O)N[C@H]1CCS(=O)(=O)C1 919886529 SHAAANJFXCFONN-AAEUAGOBSA-N 459.322 0.320 50 20 JCGD CN(C)S(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2nnc(-c3ccccc3)o2)c1 919961468 JLLFWYWKYIQTKF-UHFFFAOYSA-N 451.486 0.610 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CC(N)=O)CCO2 1780095239 LHNDZRQZIROZJO-YEJXKQKISA-N 462.459 0.475 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1Cc3ccccc3O1)C2 1782214080 BOTJMXYYBYKRGT-DCLXLUIPSA-N 458.559 0.877 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2s1 1782297638 OHKVBEQSNWUNIB-QFIPXVFZSA-N 453.329 0.975 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1783343446 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O=C(c1cc(Br)ncc1F)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830728094 OXMBBMDWGRFSNV-SUMWQHHRSA-N 480.718 0.653 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1F 1830736618 VFLHOKNDWWLGDM-OXQOHEQNSA-N 461.893 0.701 50 20 JCGD CCOC(=O)N(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)Cc1ccco1 1830737868 JKZZUSYYAXJRMG-LAUBAEHRSA-N 487.937 0.294 50 20 JCGD CN1CCC(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1834800256 AJNRJJZUJFPAQT-UHFFFAOYSA-N 470.423 0.284 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccc2[nH]ncc12 1834998230 JSNPMPXTLKLDAL-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(CO)o3)CC2)CC1 1835737835 GCACMRLOQTXYDQ-UHFFFAOYSA-N 470.530 0.269 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(F)ccc3F)C2)C1 1835938345 SREYPWFFURQVCG-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD Cc1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(C(F)(F)F)o1 1836511230 SRGYDZZGGLVEMJ-ZBEGNZNMSA-N 455.817 0.672 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)CCO2 1836687545 LOOJIXSFRJRREX-YZUZCNPQSA-N 496.004 0.598 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836717148 KFTDSHNQPDFHRN-ROUUACIJSA-N 462.927 0.080 50 20 JCGD O=C(c1cc(-c2cc[nH]n2)n2ccccc12)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836774516 ACARURQMOWMVPK-REWPJTCUSA-N 487.944 0.999 50 20 JCGD CC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1837079068 DPQPFIQYZBGMRC-SFHVURJKSA-N 464.028 0.733 50 20 JCGD CCc1[nH]nc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1Cl 1837457569 JMYIRKPAZBCHDK-NRFANRHFSA-N 491.936 0.008 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc4ccccn4n3)CC2)CC1 1837920441 ZHSQUSPJOCOARE-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1 1839197389 SUBQTDWIVGPNDO-YJBOKZPZSA-N 493.351 0.851 50 20 JCGD O=C(c1cc2cccnn2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201179 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Cc1cccc(C)c1N1C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)CC1=O 1848091275 NTOPKPAAMMGSQM-BVSLBCMMSA-N 475.354 0.852 50 20 JCGD COc1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1S(=O)(=O)N1CCOCC1 15793749 XLELHGVOMXMTIA-UHFFFAOYSA-N 463.468 0.520 50 20 JCGD CCn1nc(C(=O)NNC(=O)CN(C)C2=NS(=O)(=O)c3ccccc32)c2ccccc2c1=O 20908255 GEFCPTDXEZLPCL-UHFFFAOYSA-N 468.495 0.258 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)CNS(=O)(=O)c1ccc(Br)s1 725739704 MLDFLIAVICRDKG-UHFFFAOYSA-N 481.375 0.428 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Nc1ccc(OC)nc1)c(=O)n2Cc1ccccc1 726875270 TZXSIWBHYGOWJP-UHFFFAOYSA-N 492.496 0.684 50 20 JCGD O=C(CCc1nc(-c2ncccn2)no1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 727723225 UBKIGPINHHTIHI-UHFFFAOYSA-N 471.499 0.705 50 20 JCGD COc1ccc2c(=O)c(C(=O)NNC(=O)c3ccc(Cl)c(S(N)(=O)=O)c3)c[nH]c2c1 728204234 ZEQAHIYMGOUDIV-UHFFFAOYSA-N 450.860 0.912 50 20 JCGD Nn1c(SCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)nnc1C1CCCCC1 728317723 BCKMOZDDCDFLEI-INIZCTEOSA-N 490.542 0.662 50 20 JCGD O=C(O)c1cc(Br)cc(S(=O)(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)c1F 728503542 UZWAFGDKMLYFGV-LURJTMIESA-N 459.271 0.031 50 20 JCGD O=C(NNC(=O)C1CCN(c2ncccn2)CC1)c1ccc(S(=O)(=O)N=c2cc[nH]cc2)cc1 728890561 VWVFIPLDNFRULO-UHFFFAOYSA-N 481.538 0.772 50 20 JCGD O=C(NNC(=O)N1CCN(C(=O)Cc2ccccc2F)CC1)C1CCN(c2ncccn2)CC1 728959318 KWXZSPGCNFKVAC-UHFFFAOYSA-N 469.521 0.960 50 20 JCGD Cc1ccc(NS(=O)(=O)c2ccc(C)c(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)c2)cc1 729274850 FWDVXERUTBMFHQ-AWEZNQCLSA-N 468.557 0.803 50 20 JCGD O=C(COc1ccccc1O)NNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCCC2)cc1 730813374 HGGHGEWNBYRTTJ-UHFFFAOYSA-N 469.541 0.955 50 20 JCGD Cc1nc(-c2ccccc2)sc1C(=O)NNC(=O)NCCN1CCN(S(C)(=O)=O)CC1 746512733 XOWLHXDKVZPSLC-UHFFFAOYSA-N 466.589 0.640 50 20 JCGD CC(C)NS(=O)(=O)CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 746973013 QUQJQNKCDUSMBD-UHFFFAOYSA-N 475.593 0.133 50 20 JCGD C[C@@H](O)[C@H](NS(=O)(=O)c1ccc2ccccc2c1)C(=O)OCC(=O)NNC(=O)c1cccs1 776971508 YEODUSWWSWFHPB-YJYMSZOUSA-N 491.547 0.933 50 20 JCGD O=C(c1cc(S(=O)(=O)NC[C@H]2CCCO2)ccc1Br)N1CC[C@H](B(O)O)C1 864232668 AXSNEWPFZQTQCK-NWDGAFQWSA-N 461.143 0.595 50 20 JCGD Cn1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cc1C(N)=O 912979387 OJOSSXCXPVUGNH-UHFFFAOYSA-N 491.551 0.226 50 20 JCGD Cn1c(CC(=O)NNC(=O)CNS(=O)(=O)c2ccc3c(c2)OCCCO3)nc2ccccc21 913534541 XKCKCENTYZEIFH-UHFFFAOYSA-N 473.511 0.403 50 20 JCGD C[C@@H]1CCC2=S=C(C(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCOCC4)o3)C=C2C1 914752128 JKIIKNNZOIPTKX-GFCCVEGCSA-N 453.542 0.900 50 20 JCGD COC(=O)N1CCC(=NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 917532282 RLPHUVZLVMNKGL-UHFFFAOYSA-N 452.533 0.975 50 20 JCGD CCCN1CC[C@H](CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 919795907 BUCHHMWJKHORKU-LJQANCHMSA-N 481.619 0.702 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)C1CCN(C(C)=O)CC1)N(S(C)(=O)=O)CC2 1115821018 BMMXNLABPGNLOH-SFHVURJKSA-N 496.586 0.359 50 20 JCGD COc1ccc(Cl)cc1C(=O)N1CCC(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)CC1 1319919328 ZGSDJYPDSDJHOV-CQSZACIVSA-N 472.951 0.718 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc4ccsc4[nH]3)CCO2)C1 1779036735 DIRSVMKGDIHUHO-NRFANRHFSA-N 454.512 0.985 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc(Cl)n1 1779793192 BGQYBGTXCRATJB-NRFANRHFSA-N 474.905 0.499 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(=O)nc3cccnn23)C1 1780040470 KPHGDNCNBMIKNR-IUSZMWJPSA-N 463.922 0.471 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)C3=NN(C)C(=O)CC3)CCO2)C1 1780095896 ZCOOGYJFLGSFBH-JOCHJYFZSA-N 487.469 0.572 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(O)n[nH]3)CCO2)C1 1780096849 IVAMOFOHJVHJBO-FQEVSTJZSA-N 459.415 0.706 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1780290650 XDBILYVVBLMDGB-QHCPKHFHSA-N 454.531 0.893 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n(C)n1 1780969939 OQFGNGUTGQCZJY-XMMPIXPASA-N 483.573 0.518 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1781232882 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CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3COc4ccccc4O3)C[C@@H]21 1791288074 UVZSQKCDAXYOGV-NYUBLWNDSA-N 474.558 0.569 50 20 JCGD C[C@@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(S(C)(=O)=O)cn1)C2 1792870952 ZVGAZQSNFRQJSW-JFILPPLUSA-N 474.377 0.719 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(O)ncn1)NC(=O)NCc1ccccc1 1793727452 URYCGLGFTAKXJS-BCDXTJNWSA-N 467.530 0.780 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cncnc1 1794162560 IKBBHBVMTDNJEY-DFGXFYAUSA-N 467.954 0.741 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3c(F)cccc31)C2)c1ccc(B(O)O)cc1 1795733063 ZGWFINSSPHMCLD-GPVSGQMNSA-N 465.290 0.364 50 20 JCGD CCOc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)cnc2c1cnn2C 1796069930 UUUWQDPORDPLJQ-NOXHYTERSA-N 451.911 0.170 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccccn2n1 1796099599 JKPXWCLPYVESAZ-OBAMXFLESA-N 464.486 0.067 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](NC(C)C)C(C)C)C2 1796440683 XYRDJKKUALSPFK-JVRIXLFASA-N 460.579 0.733 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(O)cc1F)C2 1796443690 BNPNGUUUYAHHAC-NXTZLTDHSA-N 457.462 0.869 50 20 JCGD C[C@@H](Sc1cccs1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1797596593 GNDJHONIWLGUSM-JNNRSPCRSA-N 460.386 0.812 50 20 JCGD COc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1C 1797748612 MEYCNNJBFCYUOE-FAQVEIGNSA-N 467.526 0.448 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCCC1(F)F)C2 1797748698 VJSXARKCJNSUTH-DLTLXFJOSA-N 451.474 0.714 50 20 JCGD COc1cccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797753618 BHYFAKFWYLQZLN-INUXOSNVSA-N 465.510 0.610 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)nn1 1798372142 HXFHWJXUGVUETI-OPMZPASUSA-N 497.556 0.035 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cc1cccc(F)c1)NC(C)=O)C2 1800982293 BXDMIGFSQOPUDI-LWASTNQWSA-N 469.941 0.716 50 20 JCGD CSCC[C@H](O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1801027288 PCFUUYQVSJAITH-CSHUHZATSA-N 481.527 0.837 50 20 JCGD COc1nn(C)cc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1805301454 NTCVEIIMAAFTPM-FXAWDEMLSA-N 463.303 0.137 50 20 JCGD O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)CC2)C1 1805517321 BHKVKYZCXHEEKB-CZUORRHYSA-N 452.939 0.824 50 20 JCGD CC(C)(NCCC#N)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1807148090 VAOONIICXWJNFD-XLIONFOSSA-N 478.557 0.682 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1 1807357414 GJXQVAMWQOIHCW-HNAYVOBHSA-N 469.578 0.984 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2ccc3c(n2)OCCO3)[C@H]1c1cccnc1 1808184045 NMKCCHGQPCWRGX-HTAPYJJXSA-N 482.541 0.940 50 20 JCGD COc1ccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc1 1808895293 QCBWGWNBXGAGGB-GCJKJVERSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccnc(Cl)n1 1810765933 IORCJNIRXDNIPH-APWZRJJASA-N 465.706 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cc(O)no2)[C@H]1c1cccnc1 1810985366 PUFOFBXMVGWNHP-FZKQIMNGSA-N 451.443 0.407 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc(O)ccc1O 1811894548 HIGXDQZUQHJZMU-HTAPYJJXSA-N 461.283 0.806 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@@H](CNC(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1 1813186567 PKRFXFCDTBLYPG-PWZKMPOXSA-N 451.332 0.632 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815335747 NTOWAOMBOSKBAZ-SWLSCSKDSA-N 488.375 0.962 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cnn3ncccc13)CC2)c1ccc(B(O)O)cc1 1815341333 WREPTWRJUWPOBG-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD Cn1c(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cccc1=O 1815355108 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CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCOc1ccc(F)cc1)CCO2 1830255711 KKLZKZDCPZVWLI-QHCPKHFHSA-N 480.537 0.424 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccn4c(O)nnc34)C2)C1 1830538662 LYZGYLQENHRJTC-YJYMSZOUSA-N 482.335 0.536 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1 1830719865 MVACMODLVDAEKU-QVKFZJNVSA-N 475.970 0.347 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CS(C)(=O)=O)CCO2 1831452211 NAYOCNFJBCKZHB-CKEIUWERSA-N 469.398 0.155 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1 1833264703 IGSAWEVHFVLMSV-CYBMUJFWSA-N 472.384 0.141 50 20 JCGD COc1nccnc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1833502204 JWZSZXPBKOXFLS-SCLBCKFNSA-N 457.325 0.586 50 20 JCGD CCc1oncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834313762 BMTPYSIAYQUHNQ-UHFFFAOYSA-N 469.546 0.735 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc4cccnc34)C2)C1 1835928443 QILYRZCZIAHFAK-RUZDIDTESA-N 475.310 0.298 50 20 JCGD Cc1cccc(F)c1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934504 WCOIVWHHEXYGQQ-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1 1835990724 AIYQEUKSVKDVQG-VQIMIIECSA-N 457.369 0.983 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)C1 1836712292 RRFASRWFWQUJOP-OALUTQOASA-N 486.374 0.568 50 20 JCGD O=C(c1cn2cccnc2n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836893614 CNPUSNYPHNIIIP-GUYCJALGSA-N 456.272 0.490 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3ccccc3)C2)C1 1837457954 YFPKPXKGBYJWGS-HSZRJFAPSA-N 485.566 0.547 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)Cc3ccccc3)C2)C1 1837715708 FVGKPPOQOVWPRH-UGKGYDQZSA-N 450.608 0.898 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3C[C@@H](O)C3)C2)C1 1838528103 FNSYKZXAFAFIRX-ULYRPOKDSA-N 477.470 0.361 50 20 JCGD O=C(c1ccc(-n2c(O)nnc2O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1838605030 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O=C(COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1ccccc1 771189380 QCHOJWMKZXRXDH-WBVHZDCISA-N 481.914 0.468 50 20 JCGD O=C(COC(=O)CNC(=O)c1ccc(Br)o1)NNC(=O)c1cccc([N+](=O)[O-])c1 802265119 QORZXEQFKMIHEX-UHFFFAOYSA-N 469.204 0.685 50 20 JCGD CCN1CCC[C@@H]1CNC(=S)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 884086668 DYPYSOUMJWVPJO-GOSISDBHSA-N 483.660 0.620 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NN=C1C(=O)Nc3ccccc31)c(=O)n2Cc1ccccc1 916332225 RVUMPLDAYIANDU-UHFFFAOYSA-N 471.477 0.901 50 20 JCGD CNC(=O)CN1CCC(NC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CC1 916516528 BKFGXBLHISEREH-UHFFFAOYSA-N 494.599 0.703 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC(=O)N2CCN(C(=O)OC(C)(C)C)CC2)nc1 918140710 ZYPOZBWYGGRWFQ-UHFFFAOYSA-N 499.594 0.474 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(F)cnc1Cl)CCO2 1779032347 NSTLHZRECQVCAY-FQEVSTJZSA-N 462.869 0.630 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnc(Cl)s3)CCO2)C1 1779032835 XOSGPXQVXOXSRW-SFHVURJKSA-N 450.908 0.552 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1779068267 ICDGSXUECSTCAI-XLWVJDPXSA-N 463.325 0.342 50 20 JCGD CCOC(=O)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1 1781138320 FBVSOMFUHHWRRV-ATIYNZHBSA-N 494.353 0.984 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781226075 UVMGXSBFZRDQBW-MJXNMMHHSA-N 468.378 0.938 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1781859258 BYKWXJVBZLEQHB-VEVIJQCQSA-N 464.357 0.833 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1 1781997911 NUXFJKHLETWSMG-BMHLXIAXSA-N 477.352 0.779 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1 1782001137 AOTDKKZGIIGDPJ-AEVYOOLXSA-N 484.395 0.754 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCNC3=O)C2 1782170868 CQUDEDMUJTYWCK-OWDMVUQNSA-N 453.927 0.008 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cc1 1782214251 PCAJHTLWBVZPOY-CJFMBICVSA-N 487.601 0.612 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(F)c(OC)c1F 1783934301 CXUBHILFLGCYIM-QFIPXVFZSA-N 484.500 0.799 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(Br)ncc1F)CCO2 1783934360 FLQROPKSJURWSQ-LJQANCHMSA-N 486.342 0.800 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)CCO2 1783935474 USQXXIAWDMJWRZ-HXUWFJFHSA-N 451.455 0.550 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCO[C@]4(CCN(C(=O)C(Cl)Cl)C4)C3)n2)CCCN1 1783943580 LJMIMAJMKOZOLE-FQEVSTJZSA-N 470.357 0.655 50 20 JCGD Cc1nnc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)s1 1785326813 PCRYYVKJXWETOI-JYJNAYRXSA-N 452.581 0.132 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4c3CS(=O)(=O)C4)[C@H]2C1 1787151384 YKEANUMNSNDBAK-YXMPFFBPSA-N 489.392 0.462 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN3CCN(C(C)=O)CC3)[C@H]2C1 1788247443 ACWATULNZODGDJ-FJIDUMEYSA-N 473.412 0.304 50 20 JCGD Cc1nc[nH]c1CSCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1788541482 TVBDQFSIQVPNPZ-BQFCYCMXSA-N 466.608 0.304 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ncccc1Br 1788958816 QUUUSFQTSNEERK-ZVZYQTTQSA-N 488.147 0.431 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc4c3NC(=O)C4)[C@H]2C1 1790448840 JTPRINFFHYKZKK-SZMVWBNQSA-N 457.531 0.148 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CN(C(=O)OC(C)(C)C)CCO3)C[C@@H]21 1791249496 LFLVIQKWEAUESX-JCECYMMASA-N 489.997 0.856 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1csnn1 1793499502 GGQSCDCHSKCUNI-DPIQGUFMSA-N 461.456 0.889 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878284 OBJUGAYTPRUIHK-FZKCQIBNSA-N 474.986 0.623 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CC(=O)N(Cc2cccs2)C1)c1ccc(B(O)O)cc1 1794242320 RNSJEMBKKOREGW-RSPOEFSDSA-N 481.383 0.728 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCBr 1795113324 YDCIMIIPLKZSHX-QVHKTLOISA-N 464.357 0.247 50 20 JCGD COc1c(Cl)cccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795737054 YPBBSHKSVMKBAS-CCWDJLKJSA-N 458.707 0.545 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc3ncccc13)C2 1797748617 MPZHQMZBBPDDCQ-GPVSGQMNSA-N 474.521 0.679 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(-n3cncn3)c1)C2 1798441627 AVMYJQCKQVADQA-VBUUOAMHSA-N 460.498 0.831 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccccc1=O)C2 1798522446 YBWQZFMGAJIEOM-MFKICJERSA-N 484.465 0.585 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)C2 1799217959 PFGONFAAAYYKBE-BTTYYORXSA-N 495.452 0.817 50 20 JCGD O=C1CC[C@@H](C(=O)N2CSC[C@@H]2C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](F)Br)C3)N1 1801443270 DGYUEKYSASCYIU-WCSPYGGUSA-N 491.383 0.495 50 20 JCGD COc1nccnc1C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1804982390 XPKWYNUQKXWBSA-OXQOHEQNSA-N 455.519 0.573 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCCC2(CCN(C(=O)C[C@H]3NC(=O)NC3=O)CC2)C1 1806758992 VEEJKNJEIDGGCW-CABCVRRESA-N 499.996 0.948 50 20 JCGD N[C@H](CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccnc1 1807259913 NHOGURNYQKJUOP-KIFXHHALSA-N 473.342 0.566 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364908 UWQRSNWPIXZGJL-DVECYGJZSA-N 484.325 0.526 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@H]1Cc2ccccc2CN1 1808323595 NMPOFVIYTZDJDG-ICDZXHCJSA-N 484.365 0.796 50 20 JCGD CC(C)=NO[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808846463 YCVFZQJFQHGCDE-LKUPVBHCSA-N 452.320 0.882 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccccc1-n1nccn1 1811469734 JRTZZMHZPFCTAA-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@H](N)c2ccccn2)[C@H]1c1cccnc1 1813070856 LQLBPYAZBNJKSA-WTOYTKOKSA-N 453.547 0.555 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3c(c1)CNC3=O)CC2)c1cccc(B(O)O)c1 1815356647 KMXLTNZPFACQPH-MRXNPFEDSA-N 476.323 0.606 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819402963 PRYABGNMJTWNAU-SJKOYZFVSA-N 456.507 0.581 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)C(=O)Nc2cccnc2)n[nH]1 1819531021 PQIWPECKMCQHMQ-MRXNPFEDSA-N 456.507 0.809 50 20 JCGD C=C(CC(=O)OCC)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1820894984 ZIWUDMPQQINQJV-GOSISDBHSA-N 454.292 0.905 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C[C@](C)(O)CC(=O)O)[nH]n1 1822416804 PZVCHYIZNXLYFL-VLIAUNLRSA-N 452.512 0.391 50 20 JCGD Cc1c(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn2[nH]cnc(=O)c12 1826087391 AQUCMXKZYVULMB-GFCCVEGCSA-N 486.558 0.386 50 20 JCGD CC(C)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1830359296 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YIORUGJPUHLXSU-XMMPIXPASA-N 467.526 0.306 50 20 JCGD O=C(CCc1ccc2c(c1)OCO2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1835177522 AZPTXHLEOSUFBJ-KKSFZXQISA-N 454.907 0.404 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cccn2ccnc12 1835577215 NVIYJVGRISZUHD-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)no1 1835737143 ORXMMWVVWPIRMF-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD Cn1nc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c2c1CCC2 1835737872 KTUYBCRQUGLCGP-UHFFFAOYSA-N 494.600 0.406 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cncnc3)CCO2)C1 1836048397 HIWMMKAGUGYOEB-HNAYVOBHSA-N 455.353 0.897 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1836255662 MIWLATDUCIALPY-LJQANCHMSA-N 474.967 0.173 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3O1)CCO2 1836648697 HLFUISJLZBZDOH-WCBNNDDYSA-N 495.536 0.581 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](Br)CC)C2)C1 1837679127 FJXCZYBYKHNDAE-SPYBWZPUSA-N 462.385 0.921 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Nc1ccccn1)CCO2 1837741429 RVGSBPMLMDHYKC-IQQKDHQBSA-N 497.556 0.472 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc[nH]1)CCO2)NC(=O)NCc1ccccc1 1837787453 PSVBLEWIWHVAGS-DEOSSOPVSA-N 484.557 0.431 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837869213 GNDITBYCTBBKHV-UHFFFAOYSA-N 485.589 0.579 50 20 JCGD CCCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839014671 DZGAGZQJSFMVEX-RUZDIDTESA-N 466.343 0.703 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839150238 GHTJCOPZVJQPMZ-RBUKOAKNSA-N 452.379 0.841 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)CCO2 1839354133 KRSWOYONMLZUSK-OAQYLSRUSA-N 481.481 0.177 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cnc3c(c1)CCNCC3)CCO2 1839692683 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CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840187687 QFJLJMZPJGTXBQ-KPZWWZAWSA-N 470.350 0.132 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840189226 FDCVMCRMEXDGER-SJCJKPOMSA-N 456.323 0.090 50 20 JCGD COc1ccc(CCC(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)cc1OC 1843013085 GXIBFPMMHJXBIU-UHFFFAOYSA-N 452.316 0.833 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1F 1844698222 FQRBHGUIMJWWOF-UHFFFAOYSA-N 454.263 0.813 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)C[C@@](C)(O)CC(=O)O)C1)NC(=O)NCc1ccccc1 1846381779 ILXMEJKJWJQPLK-JOCHJYFZSA-N 475.546 0.152 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1846472602 KXABBHBHJHIOEA-QGZVFWFLSA-N 471.363 0.831 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1846472757 SNOKDFNRBNHTHD-KRWDZBQOSA-N 471.363 0.831 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)C[C@](C)(O)CC(=O)O 1848098690 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CC(=O)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1783141769 NMVOVMJSVIUJDO-PXNSSMCTSA-N 452.349 0.959 50 20 JCGD CCOc1ccc(CC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1OC 1783706601 SBNKOFQOMFKIMH-XMMPIXPASA-N 476.574 0.839 50 20 JCGD O=C(CSc1ccccc1[N+](=O)[O-])N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1783782504 UNZBYERWWAHHCS-JOCHJYFZSA-N 485.327 0.510 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CCS(=O)(=O)c3ccccc3)CCO2)C1 1783875265 HCTROMGQKNYQOQ-PXNSSMCTSA-N 458.964 0.934 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935355 NIYXYXGTSZOXHD-QMHKHESXSA-N 477.537 0.147 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)CC1CN(C(=O)OC(C)(C)C)C1)CCO2 1783939348 DDDSRZJXZYFYNJ-HSZRJFAPSA-N 481.594 0.446 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)C(Cl)Cl)C3)C2)[C@@H](O)C1 1783946715 GCYLBCCDSYSMSH-JMERFSKESA-N 466.362 0.848 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCc4nc(O)nc(O)c4C3)[C@H]2C1 1785332661 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50 20 JCGD C=CCCc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(O)n1 1795732453 HAMBKCZSCZFPPJ-UPHUGPLXSA-N 465.315 0.103 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccc(O)cc1Cl)C2)c1ccc(B(O)O)cc1 1795736866 ONUJTDOOCONXMC-JMJLSGOLSA-N 470.718 0.642 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)cc1 1796187244 SLLOBFDHHAHLGY-ACDBMABISA-N 470.356 0.401 50 20 JCGD CC(=O)N[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1ccc(F)cc1 1796191597 BSHMAGNUUPQGPY-LRSLUSHPSA-N 467.306 0.635 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(C)C)C(C)C)C2 1796440684 XYRDJKKUALSPFK-YJYPOECXSA-N 460.579 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCCN1Cc1ccccc1)C2 1797754069 KVXYYAFSKGNRTR-YDLSIGKMSA-N 492.580 0.553 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Cl)nc1Cl 1798029572 VXCJPNQWFDEJSC-DPIQGUFMSA-N 458.346 0.965 50 20 JCGD 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)CN)[C@@H]1c1cccnc1 1811360053 PFDDNLIZMXQECH-MOXGXCLJSA-N 470.486 0.521 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnn2c1OCCC2 1812117433 IWUBVYGMOURCBB-GHTZIAJQSA-N 475.314 0.374 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1812365259 GOIIMBCEWVLBFP-ZTNFWEORSA-N 469.303 0.643 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CC[C@@H](N)C(N)=O)[C@H]1c1cccnc1 1812777387 SAHXKTZDJKRCRH-MPTYRVRUSA-N 454.369 0.854 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@@H](C)n2cnnn2)[C@@H]1c1cccnc1 1813468707 JFGABGIMCDCFQZ-YAODLSSASA-N 478.517 0.469 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCCO3)[nH]n1)c1cccc(B(O)O)c1 1817476098 FSTRZKCCLLYUAB-SFHVURJKSA-N 464.291 0.688 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)cco2)[nH]n1 1819401850 CHMJNPAHHHLPGS-INIZCTEOSA-N 451.443 0.981 50 20 JCGD Cc1ncncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797802 KOAGDAUQSALJOS-NSHDSACASA-N 452.500 0.780 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)COc2ccc(O)nn2)[nH]n1 1822416389 CGZSLJIAEAGGNM-AWEZNQCLSA-N 460.495 0.349 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cccc([N+](=O)[O-])c1=O)CC2 1826089689 LRIPSXFVYGLDCR-LBPRGKRZSA-N 491.530 0.198 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](C)NC=O)C2)C1 1829340830 PUGTZVAZJPDBDZ-WCAVRKLYSA-N 494.976 0.827 50 20 JCGD NC[C@H](N)C(=O)N1CC[C@]2(CN(C(=O)C(Cl)Cl)CCN2C(=O)OCc2ccccc2)C1 1829359706 DCFCNGYXNBDTMD-MGPUTAFESA-N 472.373 0.528 50 20 JCGD C=CCOCCCC(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1831407345 VMEJOFDULHHUPO-DMUURETOSA-N 475.546 0.560 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1832208200 IKLVHTQWAADELW-AEFFLSMTSA-N 470.299 0.578 50 20 JCGD Cc1cncc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1832958472 DGFHBFUBENVPEI-DEOSSOPVSA-N 482.541 0.091 50 20 JCGD Cc1cc2nnc(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)c(C)n2n1 1833310641 XMJWPMSAFRFPCZ-KRWDZBQOSA-N 463.970 0.526 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)Br)CC2)CC1 1833451315 VCHJJWNWIBZVDN-ZIAGYGMSSA-N 481.457 0.669 50 20 JCGD Cc1onc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1C 1833605535 NVOXHWDJSHNRLV-UHFFFAOYSA-N 454.336 0.470 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CSc1ccccc1)CCO2 1835094560 RYONRDUZPCATNF-JOCHJYFZSA-N 464.588 0.608 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835117834 OQEBSBPQABZSPB-TXMABLNQSA-N 485.589 0.383 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)CSC(=N)N)CCO2)C1 1835514577 PVZSFNNQSXKXFH-FQEVSTJZSA-N 495.514 0.217 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737921 MPGICHYGCUCQJH-QGZVFWFLSA-N 494.600 0.766 50 20 JCGD O=C(/C=C\c1c[nH]c2ccccc12)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927109 GFYVTUMYQGQLRK-PNBGDMMNSA-N 489.337 0.631 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835927156 JDIYZHVKIXXPEP-UUOWRZLLSA-N 484.383 0.617 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc2cccnn2c1 1836491701 CFPRNQSMMJMWAB-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD CNC(=O)CC(=O)N1CCC(OC2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1836832295 BVYDDQQHDKRIHJ-MFKUBSTISA-N 460.535 0.255 50 20 JCGD Cc1ncccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837456057 HXTQILDTWUTMDK-XMMPIXPASA-N 482.541 0.091 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3Cl)C2)C1 1837459415 FPRQDYXISFJSHD-JOCHJYFZSA-N 491.907 0.861 50 20 JCGD O=C(c1ncccc1Br)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838073679 JLKGFBZODMIHFT-SUMWQHHRSA-N 462.728 0.514 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1 1838529298 VQOZYANPYFWGQU-IFXJQAMLSA-N 456.337 0.486 50 20 JCGD O=C(c1ccc(OCCCO)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838545847 ZEPDSPSGMVEXFO-RXVVDRJESA-N 456.923 0.118 50 20 JCGD CSc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1O 1838564699 QQRJCYHHFMCYTI-QHCPKHFHSA-N 486.355 0.178 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN(CCO)CCO)CC2)CC1 1838761026 SGQKESVIOUUMMU-OAHLLOKOSA-N 464.401 0.055 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSc3nc[nH]n3)C2)C1 1839154913 BRBYNHKLLMFITC-JKSUJKDBSA-N 452.364 0.590 50 20 JCGD O=C(c1ccc2ncnn2c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199999 BWXIGAKMBFZKDR-RHSMWYFYSA-N 456.272 0.490 50 20 JCGD COc1ccc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1839358647 JQQZYZPISZNOGC-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839668456 SDPFNRGBIFRNEQ-UGSOOPFHSA-N 473.324 0.048 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)NCCC#N)C2)C1 1839963844 YEYGRSBQUPEDDB-KXBFYZLASA-N 459.385 0.898 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1840153959 GNMSTKNLILWSIK-JJDSTIRJSA-N 457.955 0.098 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1840154575 ZRSIDRDGWKQPIF-DYESRHJHSA-N 499.904 0.844 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc4ncccc34)C2)C1 1840184788 BQSOSPQZJJYOKC-HSZRJFAPSA-N 470.530 0.073 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(F)(F)Cl)CCO2 1840284832 KPWSZQQVOVXVFJ-FZJZADEZSA-N 461.853 0.408 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3COC[C@H]31)CCO2 1840608811 XHWURIPFJVVRCJ-QWIQJREVSA-N 489.481 0.483 50 20 JCGD O=C(NNC(=O)c1cccc(NS(=O)(=O)c2ccc3c(c2)OCCO3)c1)C(=O)NC1CC1 9890012 NERWQYNJKLMPAI-UHFFFAOYSA-N 460.468 0.298 50 20 JCGD O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl 15795294 XMUQSTKSEAEGII-GOSISDBHSA-N 481.914 0.962 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)OCC(=O)NN=C(c2ccccc2)c2ccccc2)n(C)c1=O 25039813 AHVRVJVLVYKHCD-UHFFFAOYSA-N 474.477 0.546 50 20 JCGD Cc1nc(N2CCOCC2)[nH]c(=O)c1CCC(=O)NNC(=O)c1cc(-c2ccccc2)on1 28792556 BEYQDDIOIQNQFL-UHFFFAOYSA-N 452.471 0.964 50 20 JCGD CN(C)S(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=O)c1cccc([N+](=O)[O-])c1 728705138 PSSUODFWZPERKN-UHFFFAOYSA-N 463.428 0.214 50 20 JCGD CC(=O)NCC(=O)N1CCC[C@H]1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 729298885 XMILYAOVKYRZHU-FQEVSTJZSA-N 490.520 0.333 50 20 JCGD O=C(CN1CCN(S(=O)(=O)c2ccc3nc(O)[nH]c3c2)CC1)NNC(=O)c1ccc(F)cc1 741807676 YTBSNUQCYNSKPD-UHFFFAOYSA-N 476.490 0.175 50 20 JCGD O=C(CS[C@H]1CCS(=O)(=O)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 747405284 AXRNYXILGSLXIL-HNNXBMFYSA-N 475.614 0.543 50 20 JCGD C[C@@H]1CN(S(=O)(=O)c2cc(C(=O)NNC(=O)C(=O)N3CCCC3)ccc2Cl)C[C@@H](C)O1 748246949 IHDLLVCLTZWYMY-CHWSQXEVSA-N 472.951 0.521 50 20 JCGD C[C@@H](NC(=O)CC1CCCCC1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 749838789 TZSBJVSMALFJDK-MRXNPFEDSA-N 480.587 0.944 50 20 JCGD CN(C)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)CNC(=O)c1cccs1)n2C 751209538 RLAHDLHPQTUZBW-UHFFFAOYSA-N 492.583 0.395 50 20 JCGD O=C(COC(=O)CNC(=O)c1ccc(Br)o1)NNC(=O)[C@H]1COc2ccccc2O1 802258530 BXFNVESXUGMWRU-CYBMUJFWSA-N 482.243 0.303 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)c1 912642987 AFRVIHRGNMVFNJ-UHFFFAOYSA-N 493.586 0.979 50 20 JCGD CC(C)(C)NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CCS(=O)(=O)C2)ccc1Br 915141140 GDAPELHKCKVLJT-NSHDSACASA-N 496.405 0.722 50 20 JCGD CCn1nc(C(=O)NNC(=O)NCCCN2CCN(c3ncccn3)CC2)c2ccccc2c1=O 916266954 PVRPGJRNSSPFFW-UHFFFAOYSA-N 479.545 0.363 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=Cc2c(C)nn([C@@H]3CCS(=O)(=O)C3)c2C)cc1 917026955 XEYOJWUQDIDXRJ-QGZVFWFLSA-N 481.600 0.939 50 20 JCGD Cc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N1CCCCC1 919884992 JITCQTVXCPAIMO-HNNXBMFYSA-N 458.562 0.301 50 20 JCGD O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919885413 OZDPNQYSHXJOMK-SNVBAGLBSA-N 453.399 0.933 50 20 JCGD Cc1nn(C)c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1[N+](=O)[O-] 919975412 DHLDUTSGKMPDJD-UHFFFAOYSA-N 480.503 0.051 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2nc3ccccn3n2)C1 1777815250 LKXPFNJWCXMRBI-PDHFBFRESA-N 492.540 0.991 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@H]1ON=C(c2ccccc2)O1 1779261132 ZOLTXANOHDEPDK-NIJXNBFTSA-N 493.325 0.229 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3ccncc3=O)C2)C1 1782659065 QMFOPGQSJIZQJF-YCRPNKLZSA-N 483.953 0.205 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCO2 1783022739 NRNNKEPKHYANPS-RYLXDESZSA-N 466.376 0.545 50 20 JCGD COc1cc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)ccc1[N+](=O)[O-] 1784093282 UOEDOGOCTLCMNA-KMCQBPLKSA-N 455.895 0.725 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)CCc3ccc(N(C)C)cc3)C2)C1 1784246810 PENAAWSOKJASKY-DEOSSOPVSA-N 459.591 0.888 50 20 JCGD COc1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1F 1784700126 GHZUAFMSOKOXGF-HSZRJFAPSA-N 456.279 0.200 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCc3cccnc3)C[C@@H]21)c1cccc(B(O)O)c1 1786986651 VENUKCICZGEMKD-BVSLBCMMSA-N 451.332 0.378 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Nc3ccccn3)C[C@@H]21 1787508820 VVXIBXIWWRYRRG-FIVHUMIPSA-N 481.557 0.996 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cnn(Cc2ccccc2)c1 1788928430 PJZICAJSNYJZGK-OYDLWJJNSA-N 488.353 0.518 50 20 JCGD CN(C)[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccccc1Cl 1790678523 ZRPRAUWLYHALJX-RBQRNVLBSA-N 499.804 0.916 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc2c[nH]nc12 1791293824 LLKUNCGWNUABCW-SNRMKQJTSA-N 456.547 0.838 50 20 JCGD C#CCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792978684 MNYZLVJYAAMUQR-ADHGMGHFSA-N 471.982 0.873 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2ccccc2[C@H]1O 1793035807 BDJOAXCHHCAOGY-PLMYSNCYSA-N 479.537 0.184 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(NC(=O)C3CC3)cc1)C2)c1cccc(B(O)O)c1 1795739935 SLEASUZWESMSHE-HATOLVCRSA-N 477.326 0.232 50 20 JCGD O=C(CCCN1C(=O)c2ccccc2C1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188249 GRVOEHQAWHGPNZ-ACDBMABISA-N 489.337 0.695 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)C2 1796321370 CVRYTIIYBOLPHH-JLNHVSMJSA-N 461.469 0.908 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)cc1 1796361490 RRZDSEMZXLPOKK-GFISCPRKSA-N 461.943 0.786 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)C(=O)C1 1796371510 ZRLXEDUXPIKXNX-DLTLXFJOSA-N 476.933 0.190 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnn3cccc(F)c13)C2 1796443853 OHGWUFQNHDEDBC-UTRJNVLQSA-N 481.488 0.811 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nccnc3c1)C2 1797750880 UGQKOGGVXDWLPQ-YVWYUNDQSA-N 461.482 0.145 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ccsc3[nH]1)C2 1797753664 DGDRVUQMXGVTNB-FVCICTRLSA-N 454.512 0.745 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C(/C)C(=O)O)C2 1798525865 NGXXVRDVVZAGEL-DNSCMWKWSA-N 461.427 0.754 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncccc1F)C2)NC(=O)NCc1ccccc1 1799097520 NZVWTWVTAZODDA-RMFSNUHRSA-N 484.532 0.770 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1 1800298957 YXFAVBJNWMKYJI-XVAUXIKLSA-N 480.403 0.995 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CC13CN(C(=O)OC(C)(C)C)C3)C2 1801012759 JZNUAABEOJQVSA-AXVVYFOYSA-N 493.605 0.206 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)n1cnnn1 1801438980 QHGZFDYUIQQRDR-FWEDZOCSSA-N 477.363 0.830 50 20 JCGD O=C(CN1C(=O)CSC1=S)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2 1802107627 QNMYQJUBKIAARO-IWXIMVSXSA-N 454.343 0.127 50 20 JCGD 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CCCC(=O)N[C@@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360666 LWGQZIKIKJZBBC-WFASDCNBSA-N 458.349 0.354 50 20 JCGD Cc1nc2ncccn2c1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1818391677 DNIMMTDTUTUDOO-OAHLLOKOSA-N 476.327 0.714 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2)c1nc2c(=O)[nH]c3ccccc3n2n1 1818583971 ICFWRLRCXFUNCN-NOZJJQNGSA-N 487.929 0.853 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)cco2)[nH]n1 1819401852 CHMJNPAHHHLPGS-MRXNPFEDSA-N 451.443 0.981 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819404759 XTLGZQKKZOUEMU-INIZCTEOSA-N 471.522 0.087 50 20 JCGD Cc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n(C)n1 1819795824 UMZHHQXVQDTNCN-NSHDSACASA-N 454.516 0.723 50 20 JCGD Cn1nc2c(c1C(=O)Nc1nc3c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC3)CCC2 1824242546 MKVBCLAQUMTFOW-LLVKDONJSA-N 480.554 0.903 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CN1CCS(=O)(=O)CC1)CC2 1825993718 DPCSDZUATHKBPH-RYUDHWBXSA-N 464.997 0.039 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)C[C@@](C)(O)CC(=O)O)CC2 1826090153 XGINHZBBPSRZTJ-NSPYISDASA-N 455.537 0.044 50 20 JCGD N[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)c1ccccn1 1826909192 UBQKDPUEJFGVSJ-FGZHOGPDSA-N 450.348 0.695 50 20 JCGD Cn1nncc1C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828641993 QMMDVSIJQMEYJC-GCJKJVERSA-N 490.948 0.481 50 20 JCGD Cn1ncnc1C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828663843 BDOVWOXOXNZIQE-HTAPYJJXSA-N 490.948 0.481 50 20 JCGD CCC(=O)N[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923574 MTLXAXQXCIJICG-HNAYVOBHSA-N 458.563 0.833 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccnc1S)CCO2 1829793907 DDTNSCWHSNNHKI-BHSKHCGUSA-N 486.554 0.574 50 20 JCGD O=C(CN(CCO)CCO)N1CCC([C@@H]2CCCCN2C(=O)[C@@H](F)Br)CC1 1830381492 BOFXOEDEGKIGQC-DOTOQJQBSA-N 452.365 0.583 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](C)CBr)CCO3)C2)n1 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Cc1scc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1C 1834542082 ZPLDVQWCUACGSJ-OAQYLSRUSA-N 452.577 0.808 50 20 JCGD CC(C)n1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834798409 RROIWFUVFZQWGY-UHFFFAOYSA-N 467.379 0.643 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cc2n(n1)CCCC2 1835571127 XRYDOSXTWVRXKT-UHFFFAOYSA-N 479.390 0.398 50 20 JCGD CC[S@](=O)CCC(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1835658901 MYFINDJTPLQMIL-HKBQPEDESA-N 457.641 0.090 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3CCCC4)C2)C1 1835941905 TWYPWMWEZCCOFA-SANMLTNESA-N 478.354 0.629 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC1CCN(C2CCN(C(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1836398677 RMAVHAPXPFIYIB-HXUWFJFHSA-N 484.388 0.839 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](F)Br)CC2)CC1 1836414425 KDWWHMADQMHATR-QGZVFWFLSA-N 464.380 0.622 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1836932341 AGTFUSGFIJDFDG-UHFFFAOYSA-N 467.611 0.520 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc4c3NC(=O)C4=O)CCO2)C1 1837135470 JOXREEWRXAARDW-ASSNKEHSSA-N 494.342 0.922 50 20 JCGD O=C1Nc2c(cccc2C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)C1=O 1837139313 ZYHLRMZTCSSFJW-DNVCBOLYSA-N 484.278 0.582 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1C 1837452382 JCEDRRNUXRDNJW-UHFFFAOYSA-N 469.546 0.653 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(Cl)nc1Cl)CCO2 1837824364 PMURUSYBZBYSFW-NRFANRHFSA-N 494.140 0.452 50 20 JCGD Cn1ncc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1Cl 1837919143 JLWCEIYUDUSIGB-UHFFFAOYSA-N 474.754 0.679 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(F)nc1C)CCO2 1838265524 QSQCVIQKZBHJOE-PVPASAESSA-N 486.504 0.733 50 20 JCGD CCOC(=O)C1(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1838394485 APUNOZYPQIUXHP-UHFFFAOYSA-N 487.557 0.641 50 20 JCGD CC(=O)C[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838395320 CKYJLYDVMGLMJR-HNNXBMFYSA-N 459.547 0.913 50 20 JCGD Cc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)CBr)C3)C2)cn2[nH]cnc(=O)c12 1838468617 KITHEZQKSJDDND-RNODOKPDSA-N 496.362 0.432 50 20 JCGD CCc1ncsc1C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1838837297 NADDORVNKPSKCW-BHSKHCGUSA-N 488.570 0.910 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1839142989 IBRJCTPTACCCGQ-KXBFYZLASA-N 459.952 0.573 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccc(O)cc1 1839171309 RPSDROOIJUGDSO-HXOBKFHXSA-N 462.547 0.325 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3nscc13)CCO2 1839575654 CZGYULGRWNMGFI-HSZRJFAPSA-N 481.339 0.360 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3OCCO4)C2)C1 1840152809 UPFZETWXQFLVRL-HRAATJIYSA-N 454.907 0.782 50 20 JCGD CC(C)(C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccn1 1840328219 CBBJUXPDEYQFKW-XMMPIXPASA-N 482.541 0.128 50 20 JCGD CC(C)(CCl)C(=O)N1CCCC12CN(C(=O)[C@H]1CSCN1C(=O)[C@@H]1CCC(=O)N1)C2 1841227658 REOFPXFLKBZLER-UONOGXRCSA-N 456.996 0.635 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843011333 TUABYTQVAFOCHY-IEBWSBKVSA-N 489.353 0.779 50 20 JCGD C=CCOC(=O)NC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1844215308 STKOBKTXDJKZQA-CABCVRRESA-N 488.969 0.595 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CCCC13CN(C(=O)c1ccc(B(O)O)cc1)C3)C2 1847094964 QIYITYBUMUWNHX-SLFFLAALSA-N 483.374 0.971 50 20 JCGD CCn1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c(=O)c2ccc(C)nc21 728317833 WIRZGHFMRWYSNV-GOSISDBHSA-N 466.450 0.869 50 20 JCGD CCNC(=O)COc1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC 728945666 DPRLZTMLZAYTEN-UHFFFAOYSA-N 485.545 0.747 50 20 JCGD O=C(NNS(=O)(=O)c1cccc2cccnc12)c1cccc(S(=O)(=O)N2CCOCC2)c1 734739609 HAJKMSQKYZDIBG-UHFFFAOYSA-N 476.536 0.879 50 20 JCGD CC1CCN([C@H](C)CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1 743340558 HDJVNEKIZKTFHK-QGZVFWFLSA-N 453.613 0.764 50 20 JCGD 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CCn1nc(C(=O)NNC(=O)NCc2ccc(OCCO)c(OC)c2)c2ccccc2c1=O 918228341 ILRUJJOXKFTCLD-UHFFFAOYSA-N 455.471 0.940 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCN(C)Cc3ccccc3)nc2)CC1 919789927 CEJNLJWXSSCTOS-UHFFFAOYSA-N 461.592 0.776 50 20 JCGD COCCCNC(=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(=O)OC)CC1 920862439 FFZOJONPOYATEM-UHFFFAOYSA-N 456.521 0.241 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCCn1ccnc1C)c(=O)n2Cc1ccccc1 920924947 AQVKKNWVPUORDX-UHFFFAOYSA-N 492.540 0.561 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cnc2ccoc2c1 1777919387 IWPQWROGOUTHKG-ZJSXRUAMSA-N 463.299 0.949 50 20 JCGD O=C(NC1(C(=O)N2CC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)CC1)OCc1ccccc1 1778278027 MVVJDLTWIAEMAW-UTKZUKDTSA-N 465.934 0.875 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccc3c2OCCO3)C1 1778592830 NDWKIUIFQSSPSH-CJFMBICVSA-N 495.536 0.898 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3n[nH]c4cc(Cl)ccc34)C2)C1 1778665515 SLTMSBDQXVKHOC-QFIPXVFZSA-N 468.706 0.653 50 20 JCGD 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50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1)NC(=O)NCc1ccccc1 1839054141 IQODYDJIQKPJPC-NQIIRXRSSA-N 485.944 0.323 50 20 JCGD Cc1nn2cc(CC(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)nc2s1 1839198488 FRXSJMKEVOMGNM-PBHICJAKSA-N 490.355 0.789 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839203439 LLQUIAKXTZPFST-DKICVRJWSA-N 486.338 0.952 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1 1839437294 PPHKRBGPKPDGDB-GHTZIAJQSA-N 463.922 0.591 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc(C)c(C)[nH]c3=O)C2)C1 1839962619 LRBWRHQIZBXPAV-KUHUBIRLSA-N 471.352 0.630 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1840031073 FIQIHNVVIYIYDX-APPDUMDISA-N 457.281 0.028 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1 1840154445 XCSBPEWWKCAPAF-HRAATJIYSA-N 463.922 0.796 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4)C2)C1 1840154991 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NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)c1cc(Cl)nc3n[nH]cc13)C2 1844264261 ZOLRCWXIYFSFCU-UHFFFAOYSA-N 454.878 0.741 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)Cc1cn2nc(C)sc2n1 1847976936 RRBPDDJSPVFNBX-GJPMGDBYSA-N 468.543 0.978 50 20 JCGD CC(C)(C)OC(=O)N1CCC=C(C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)C1 1848095421 UXBDDRYEAMKWEP-PMACEKPBSA-N 469.347 0.749 50 20 JCGD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 729284462 VKXSILQFNIYGLU-IBGZPJMESA-N 498.569 0.520 50 20 JCGD Cc1cc(C)c(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)c(C)c1NS(C)(=O)=O 751282613 OZONEACMCUTKHZ-UHFFFAOYSA-N 458.518 0.316 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c1 916267061 XCPWEIPKUVCBID-UHFFFAOYSA-N 465.532 0.679 50 20 JCGD Cc1ccc(C(=O)N2CCN(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)CC2)cc1F 918779514 YAFISMFJPYNKDB-UHFFFAOYSA-N 452.450 0.922 50 20 JCGD CNC(=O)CN1CCC(NC(=O)/C(C#N)=C/c2cn(CCC(N)=O)nc2-c2ccc(OC)cc2)CC1 920855066 WBURDKYGBNEHFY-QGOAFFKASA-N 493.568 0.668 50 20 JCGD C/C(=C/C(=O)NNC(=O)c1cccc(N(C)C)c1)C(=O)NNC(=O)c1cccc(N(C)C)c1 1527513975 KTQQADYEPMAXDQ-QINSGFPZSA-N 452.515 0.987 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778113835 DUGDNMYKZCVNQV-KSSFIOAISA-N 480.425 0.519 50 20 JCGD CC(C)COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccn1 1779030241 LOQLTLUUZHVPFF-XMMPIXPASA-N 482.541 0.872 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c2n1 1779032849 YJYCSCRNXHNWTB-QHCPKHFHSA-N 479.497 0.327 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372222 CPVJQFIVRNUEQU-SWWFSWNPSA-N 481.557 0.708 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779374938 GZZXLODXNYUGRZ-UZUQRXQVSA-N 475.546 0.402 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn(C(F)F)c2=O)C1 1779584970 QXUZWSGJYZCROM-OPAMFIHVSA-N 483.516 0.744 50 20 JCGD CN(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@](C)(Cl)CCl)C1)C(=O)C(=O)O 1780717155 XPRWYIDFHNWRMD-OCBCSQNSSA-N 452.335 0.280 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CC[C@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2 1781268711 UNHRQFSNKIHLLM-OLCUMFGGSA-N 459.503 0.460 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781333536 ICOOMCWFHSSHTK-CJNGLKHVSA-N 461.244 0.277 50 20 JCGD CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1782026057 XNLVPGATCWHKFJ-QAPCUYQASA-N 480.370 0.755 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)n1 1782214601 LQQHRPVWHBUBPT-HOYKHHGWSA-N 490.605 0.174 50 20 JCGD C/C(=C/C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)C(=O)O 1783154663 GYQAXHQLHLFTSA-LACGSMOSSA-N 459.503 0.665 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)CCO2 1783339133 OXWQALWAGKRUQM-IQUTYRLHSA-N 478.384 0.875 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)COCCNC(=O)OC(C)(C)C)CCO2)C1 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50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CC(c3ccccc3)=NN2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373055 MJYZUPDIXGFZPP-GPUOULLFSA-N 497.364 0.847 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3cccnn3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375033 MHNGWYFKNTZSIV-AVRDEDQJSA-N 470.298 0.438 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)C#CC(=O)O)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807453049 MWQJMVGXFKZWJT-GBXCKJPGSA-N 492.536 0.522 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CCN2CCOC2=O)[C@H]1c1cccnc1 1810303308 QBVUGJNJACJCKR-UZLBHIALSA-N 481.513 0.242 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnncc2C(=O)O)[C@H]1c1cccnc1 1810804711 SXBKPZSOUVFOTI-MGPUTAFESA-N 469.502 0.262 50 20 JCGD CCn1nc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1C 1811019105 BCQMYUNMXUVPTR-SIKLNZKXSA-N 461.331 0.920 50 20 JCGD COC(=O)C12CC(C(=O)NC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)[C@H]3c3cccnc3)(C1)C2 1812839533 ZKCGAAGNJJLMTJ-ALTBTQMMSA-N 471.558 0.804 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cn3ncccc3n1)CC2)c1ccc(B(O)O)cc1 1815340245 HFIYERIRUNIEFU-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD Cc1cnn([C@H](C)C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1 1815361763 QYVUXNIUYAHUNO-CZUORRHYSA-N 453.333 0.815 50 20 JCGD C[C@@](O)(C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)C(F)(F)F 1815527549 DEKMZDGMNWTBQA-KBXCAEBGSA-N 454.214 0.709 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1)[C@H]1SC(=N)NC1=O 1819403083 UNZLDZBHPMUKAQ-JMPLFQLZSA-N 499.557 0.517 50 20 JCGD COc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)nn1C 1821766095 PXVYTNSOVNSWFO-ZDUSSCGKSA-N 455.305 0.105 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)sc2C1 1822628857 AYDHOTREPXZCEN-RRFJBIMHSA-N 476.603 0.829 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)cc1 1830213446 IKVNXEFDFTWXGA-AZUAARDMSA-N 471.348 0.970 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1830539102 AZABNYBHCBJNJH-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1831639822 DVNJRRNAMFXOPZ-RQVMVGKASA-N 482.965 0.857 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)c3ccccc3)CC2)CC1)c1ccc(B(O)O)cc1 1834797918 LSRRGWXQRGFZLA-QHCPKHFHSA-N 465.359 0.285 50 20 JCGD CO[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccc1 1834801171 SBSKEOAHXFSIAB-XMMPIXPASA-N 479.386 0.939 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738231 NPJGYGNHTQHULT-OAHLLOKOSA-N 490.561 0.432 50 20 JCGD N[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)c1cccnc1 1835829140 UWQJOZQOQDFDOV-VQIMIIECSA-N 455.353 0.713 50 20 JCGD O=C(Cc1c(F)cccc1Cl)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835926293 LNUPVMFDYSKODU-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccc(Cl)cc1 1835934331 VRXZIXVAVWTUDN-OSPHWJPCSA-N 486.761 0.894 50 20 JCGD O=C(CCc1ccc(F)c(F)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934370 XWRYDNKOGVFAQV-DEOSSOPVSA-N 488.296 0.347 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C=O)s1)CCO2 1835948172 XPQBQGYFKDHLDN-HXUWFJFHSA-N 452.533 0.004 50 20 JCGD Cc1cccc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)[nH]c12 1836853891 IHMGPRSJDNSBCF-RUZDIDTESA-N 477.326 0.540 50 20 JCGD C[C@H](Nc1nccs1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920131 CRHLJHBHVMNEAB-INIZCTEOSA-N 486.403 0.936 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1837922078 IQXPZGCXSLJWKK-SFHVURJKSA-N 468.363 0.745 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnn(Cc3ccccc3)c1)CCO2 1838017438 HKPQYKPGLZLHQJ-VWLOTQADSA-N 498.584 0.374 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1csc(C(F)(F)F)n1)CCO2 1838189924 WLOPARNLWRWZJL-IBGZPJMESA-N 499.276 0.226 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838813610 TXQZZEFUGBHQLW-HSZRJFAPSA-N 478.594 0.469 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)c1ccc(F)cc1 1839037931 FOOVWAOOORVKJR-ZWOKBUDYSA-N 459.877 0.994 50 20 JCGD Cc1ccc(C(=O)NCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cc1 1839203184 CJZFSBRTNKCZFP-PXNSSMCTSA-N 486.338 0.872 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839945890 QTTQJPOFVKTREC-DFBJGRDBSA-N 466.343 0.549 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1840151372 ZXOGYYOZGSQLOE-IINYFYTJSA-N 464.796 0.052 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3(C)CN(C(=O)OC(C)(C)C)C3)C2)C1 1840153115 DYPSJUBEUJKQMP-OPAMFIHVSA-N 489.997 0.954 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)nc2ccccn12 1840184535 SGZIMONFJRZRTC-HSZRJFAPSA-N 472.546 0.086 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H]3C[C@@H]4CC[C@H]3C4)C2)C1 1840184672 ANGUSEABDJFIOP-XQQXVUDOSA-N 450.580 0.642 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](O)C[C@H]1C(=O)N1CCOC[C@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840188219 XQZPRUKALUWAFC-PJSUUKDQSA-N 496.388 0.617 50 20 JCGD O=C(c1ccc(N2C(=O)C=CC2=O)cc1)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840190115 FYTXMTRKXZAFLD-NRFANRHFSA-N 482.320 0.990 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840277347 XAGLPMWHQPFUKU-PNLZDCPESA-N 489.997 0.690 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840391293 YMVBXMUYUTWGBH-UZUQRXQVSA-N 485.371 0.012 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1 1840787789 QQHAZQZRVNQCGW-DYESRHJHSA-N 453.923 0.058 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1840908621 CUCGATQSPQSTBW-BXTJHSDWSA-N 461.918 0.894 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CCCC23CN(C(=O)CCC(=O)NN(C)C)C3)cc1 1842758817 BVZURZCRQZXVPI-UHFFFAOYSA-N 450.561 0.345 50 20 JCGD Cn1c(=O)n(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c2ccccc21 14330717 LJPGPEQZXBQVKN-UHFFFAOYSA-N 457.512 0.586 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 14841920 ZAOSGBPJKBYRAZ-UHFFFAOYSA-N 461.475 0.878 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)[C@H](C)Nc2nc3ccccc3s2)cn1C 725880774 LTLZUXNWWMIAQN-NSHDSACASA-N 465.561 0.655 50 20 JCGD NC(=O)c1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 726435157 MPLWTXJTPMEKKP-UHFFFAOYSA-N 463.541 0.438 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2nc(-c3ncccn3)no2)cc1 727723300 WVNSMYWMXWCHNF-UHFFFAOYSA-N 459.488 0.236 50 20 JCGD COc1ccc([C@@]2(C)NC(=O)N(CC(=O)NNC(=O)C3CCN(c4ncccn4)CC3)C2=O)cc1 728846263 WCDWZZBQWIJUPK-HSZRJFAPSA-N 481.513 0.316 50 20 JCGD CC(=O)N1CCN(c2ccccc2CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)CC1 729053125 CAWLHWLSEXFXJY-UHFFFAOYSA-N 480.573 0.892 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NC[C@H](C)N(C)C1CC1)N(S(C)(=O)=O)CC2 729617239 JTYXFXCDAQGWNS-KBXCAEBGSA-N 497.618 0.766 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)N[C@H]1CCC[C@H]1C)c(=O)n2Cc1ccccc1 729622949 BKIPQRXBKPLQLE-AEFFLSMTSA-N 497.556 0.573 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 913446134 RWYSKUFUKSSTHE-UHFFFAOYSA-N 465.484 0.361 50 20 JCGD O=C(NCCCN1CCCCCC1=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915905516 MTZGYZHNWCSGLA-UHFFFAOYSA-N 481.575 0.444 50 20 JCGD C[C@@H]1CN(c2ccc(CNC(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cn2)CCO1 916393241 VQMXSAHVYBNKFW-OAHLLOKOSA-N 476.559 0.701 50 20 JCGD CN(C)c1cccc(C(=O)NNC(=O)NCCS(=O)(=O)N2CCN(c3ccccn3)CC2)c1 916516250 HMPOQAWVRPESMJ-UHFFFAOYSA-N 475.575 0.244 50 20 JCGD O=C(NCCNS(=O)(=O)Cc1ccccc1)NNC(=O)c1nn(-c2ccccc2)cc1O 916516962 QLORYXYVNLPWDJ-UHFFFAOYSA-N 458.500 0.642 50 20 JCGD CC(C)(C)NS(=O)(=O)CCNC(=O)NNC(=O)COc1ccc(Br)cc1 916622462 SNSDZISKSMERBS-UHFFFAOYSA-N 451.343 0.876 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(Br)c[nH]2)cc1 916649345 KJAGDAMFTDCEHH-UHFFFAOYSA-N 474.337 0.846 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(Cl)nc1 917253398 IROUTTQASAVLDH-CQSZACIVSA-N 474.948 0.278 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN(C(=O)CCOc2ccccc2)C1)N[C@H]1CCS(=O)(=O)C1 919887936 IPDHJXDOFRMMNT-HOTGVXAUSA-N 452.533 0.212 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779394348 SZSTZFDPNJXVBS-TUVUNVSASA-N 482.545 0.103 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CC(=O)C1)C2)NC(=O)NCc1ccccc1 1780559276 IJIYYSCMSCRVBR-PXDATVDWSA-N 485.585 0.826 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1OC 1780656031 YSEIPDXOJBUFIW-HSZRJFAPSA-N 454.288 0.141 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780939802 JNVMJFGDUYRJAO-KPZWWZAWSA-N 471.377 0.505 50 20 JCGD CC(C)C(=O)Nc1nc(O)c2ncn(CC(=O)N3CC[C@@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)c2n1 1782885703 KLENDDRDQBDQRF-JLTOFOAXSA-N 497.915 0.491 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)CCO2 1783353434 OOYVHOHANSDZPK-JCGVRSQUSA-N 464.357 0.833 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(Cl)cnc3O)[C@H]2C1 1783403404 YMJLEVNHYHKSMV-RCBQFDQVSA-N 453.927 0.407 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)C1 1783461008 AELFHXMXXFFWFL-AYCKEJKLSA-N 499.373 0.067 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)C1 1784093086 PPZGKPQIKCPEGF-DQKQSUEQSA-N 477.961 0.915 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc(S(C)(=O)=O)c(F)c3)C2)C1 1785229137 QORNZUJUJAITQJ-KUHUBIRLSA-N 462.927 0.927 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3CNc4ccccc4O3)C[C@@H]21)c1cccc(B(O)O)c1 1786984241 TZRJFYRMVMQAHL-UDSSINMLSA-N 479.342 0.223 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC(F)F)cc3)C[C@@H]21)c1cccc(B(O)O)c1 1786984986 GNDLZYWZHVFTSC-VDGAXYAQSA-N 474.269 0.875 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncon3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726630 HCCYGKKWBIUTIK-BZSNNMDCSA-N 471.518 0.009 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnn4c3CCC4)[C@H]2C1 1790389980 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JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnc(Cl)nc1)CC2)c1ccc(B(O)O)cc1 1815335755 OLZCSVIHLJMJQM-CYBMUJFWSA-N 457.708 0.806 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cncn1-c1ccncc1)CC2)c1ccc(B(O)O)cc1 1815337197 OCVVZUMVRUKTFB-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD CC(C)n1nc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1C(=O)O 1815355574 WKDGUWKWDAXVQF-AWEZNQCLSA-N 497.342 0.838 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817473244 NKBVOCDQMNMNTC-KRWDZBQOSA-N 452.280 0.451 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)/C=C\C(=O)NC2CC2)[nH]n1 1819403293 CMCZTIMWTNFGGQ-TUYSUELWSA-N 466.502 0.549 50 20 JCGD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)N1CCN(C)CC1 1820784168 BFKIFGFUAVJDND-OXJNMPFZSA-N 468.367 0.031 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1825506577 PIPAANSICUXTNW-LLVKDONJSA-N 489.558 0.892 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CNCP(=O)(O)O)CC1 1827680664 CLPGPLHEDVVIIZ-LSPPGFKNSA-N 496.505 0.465 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)C#CC(=O)O)C2)C1 1829339743 ASEDRMJYPHZDKW-MBSDFSHPSA-N 491.928 0.780 50 20 JCGD Cc1c(C(=O)N2CCCC[C@H]2C2CCN(C(=O)CCC(=O)NN(C)C)CC2)cn2[nH]cnc(=O)c12 1829598784 AHPJSUVUFAQMKP-IBGZPJMESA-N 485.589 0.937 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccccc3=O)C2)C1 1830538960 WRGIKHMTSHGRQG-DNVCBOLYSA-N 456.337 0.336 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1831301321 PLVAXOUFNKFJLN-PPJWLVRDSA-N 494.353 0.249 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)CCl)C2)C1 1831318126 MZFQJIJALFXCLI-KDOFPFPSSA-N 453.989 0.036 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccnc2C(N)=O)CC1 1831872429 WHQSGOUQNVLQOF-GOSISDBHSA-N 458.563 0.787 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832080224 IRUCDPMAQRBEDJ-HYFFOGBASA-N 489.997 0.832 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3CCc4sccc4C3)CCO2)C1 1832590945 QRTUWHYRMIQWRW-LAUBAEHRSA-N 472.007 0.816 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nc4ccc(F)cn4n3)CC2)CC1)[C@@H](O)CCl 1833312124 KJIKJRLXIWPSSG-INIZCTEOSA-N 452.918 0.653 50 20 JCGD COc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(F)c1 1833634517 MGSRFQQLNZCQDA-YOEHRIQHSA-N 464.263 0.990 50 20 JCGD O=C(/C=C/c1ccccc1)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1835107127 JHPNHTNMUUCRMF-HBRDYDSTSA-N 450.300 0.150 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccoc34)C2)C1 1835932121 OTQOWSCNCAFJGH-XMMPIXPASA-N 464.283 0.496 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1 1835934016 KEBTUPIWNKYBIM-OAQYLSRUSA-N 466.290 0.262 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835940158 XDRJJDBAXZUAFS-AVRWGWEMSA-N 484.333 0.454 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n(C(F)F)n1 1836164853 ZPYCOTHCGFPPJX-UHFFFAOYSA-N 489.332 0.765 50 20 JCGD CC[S@](=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1837233978 BFZNJCHRDLVGRO-UVVOCLOQSA-N 453.399 0.633 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)n1)CCO2 1837905015 QRFBKLJMEWFFGU-WGLQLPMYSA-N 472.477 0.425 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(-c3ccccc3)no1)CCO2 1837996783 WBDIOOHKLIBADC-RUZDIDTESA-N 491.309 0.405 50 20 JCGD O=C(c1cc(=O)nc2sccn12)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1838418457 ADTHDLGDRRTDGO-SUMWQHHRSA-N 489.323 0.517 50 20 JCGD Cc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cn2[nH]cnc(=O)c12 1838472675 WONQIYIOLQRABJ-YJYMSZOUSA-N 482.335 0.184 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)nn1C 1838503980 WEPACLVZLZBENW-UHFFFAOYSA-N 462.595 0.968 50 20 JCGD CC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528044 BUWIIZBUQNMFEM-JOCHJYFZSA-N 477.470 0.959 50 20 JCGD COc1c(Cl)ccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838731133 LUSXYCVFYBQTFJ-NRFANRHFSA-N 483.953 0.187 50 20 JCGD Cc1c[nH]cc1C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054145 IRJCYRNPHOENRF-VWLOTQADSA-N 498.584 0.739 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)C1 1839151901 HYNWQQDMOQGZGB-QZTJIDSGSA-N 495.385 0.144 50 20 JCGD O=C(CSc1ncccn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199749 SWTYQHJKPDRSHH-CJNGLKHVSA-N 463.329 0.716 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)CCO2 1839636331 MDTRRNLEMDUXMW-LQBOVUBWSA-N 464.950 0.463 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)n3)C2)C1 1839964419 RASSXOARRDDSGL-GTNSWQLSSA-N 459.297 0.131 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1840059533 GLYSMJFTXAWJDU-IGMJJTELSA-N 479.933 0.348 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3CN(C(=O)OC(C)(C)C)C3)C2)C1 1840152242 BZKSVRGEAJEHDJ-KKSFZXQISA-N 475.970 0.564 50 20 JCGD COc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)c(F)c1 1840184462 OBDQCYOBRLSNSY-XMMPIXPASA-N 494.564 0.596 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)cn3)C2)C1 1840185587 PLQJOBJKVFUQNK-FQEVSTJZSA-N 453.927 0.178 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)C(F)(F)F)CCO2)C1 1840201713 ZHKAROINKBPHRK-ABAIWWIYSA-N 474.274 0.152 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1C 1840643592 SEQIFTSNSRBEED-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(C(N)=O)cc3)CCO2)C1 1840645837 PZEKNKKLAZSKJR-XOBRGWDASA-N 468.348 0.887 50 20 JCGD O=C([C@@H](O)CCl)N1CC2(CCCN2C(=O)CCNS(=O)(=O)c2ccc(Cl)cc2)C1 1846277322 SLYKAOYQFRXVQF-HNNXBMFYSA-N 464.371 0.812 50 20 JCGD CC(=O)NCCCC[C@@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H](O)CCl 1847562521 HLTTXLQPTKLCJP-ANULTFPQSA-N 493.004 0.893 50 20 JCGD COc1ccc(S(=O)(=O)N[C@@H](C)C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)cc1 10160042 MKDIZRLIRBZTRC-ZDUSSCGKSA-N 459.484 0.715 50 20 JCGD CNS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2cc(Cl)ccc2OC)ccc1OC 10793411 JZLGYOOMNZRXNN-UHFFFAOYSA-N 485.902 0.883 50 20 JCGD Cc1nnc(NNC(=O)COc2ccc(N(C)S(=O)(=O)c3cccs3)cc2)[nH]c1=O 11335326 JSRAEBQAYJCMBC-UHFFFAOYSA-N 450.502 0.882 50 20 JCGD COc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1S(=O)(=O)N(C)C 15314809 CYFBIKCPRSQJMT-UHFFFAOYSA-N 489.598 0.919 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H](C)N2C(=O)NC3(CCCC3)C2=O)c1 726521843 WKRXRWPLJRFTJK-CQSZACIVSA-N 479.559 0.731 50 20 JCGD COc1ccc(NC(=S)NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)cc1F 727498905 SZCNWTCIZXFVPJ-UHFFFAOYSA-N 481.531 0.586 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNc3nc(-c4cccnc4)no3)CC2)cc1 728077584 WOUVQASPYHVKNW-UHFFFAOYSA-N 457.516 0.890 50 20 JCGD COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728856218 JSZGEXMHOMDZAS-UHFFFAOYSA-N 477.499 0.276 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H](C)[C@H](C)N2CCOCC2)c1 729623363 KMPIDQFSERPBNP-HOTGVXAUSA-N 455.581 0.770 50 20 JCGD O=C(NNC(=O)c1ccc(NS(=O)(=O)c2ccc3nc(O)[nH]c3c2)cc1)C(=O)N1CCCC1 748247510 PBJSYEBWPZOFBE-UHFFFAOYSA-N 472.483 0.453 50 20 JCGD COc1cc(C(=O)NNC(=O)[C@@H](CC(N)=O)NC(=O)c2ccccc2Cl)cc(OC)c1OC 786054350 JHVJYYCGXFARSB-CQSZACIVSA-N 478.889 0.801 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=C(C)c1csc(N)n1)c(=O)n2Cc1ccccc1 812433123 IRSGVTJNEXSOSC-UHFFFAOYSA-N 496.553 0.634 50 20 JCGD CCOC(=O)N1CCC[C@@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 912895736 NVYRDANZGYPIKI-GOSISDBHSA-N 496.586 0.656 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1ccc2c(c1)OCO2 913415679 LELMSUGVAKJNTH-UHFFFAOYSA-N 456.274 0.917 50 20 JCGD CCN(CC)C(=O)Nc1ccc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1 914773657 OZHHDTCRUULRTG-UHFFFAOYSA-N 461.548 0.985 50 20 JCGD O=C(COc1ccc(I)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919886435 STBFBDVYFMPWJA-SNVBAGLBSA-N 453.258 0.188 50 20 JCGD Cc1ncc(CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)s1 920043758 MEWHCLKBAMAMQM-UHFFFAOYSA-N 467.573 0.936 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1cc(F)ccc1NS(C)(=O)=O 920425269 VPVNQLFSRLDSKE-UHFFFAOYSA-N 457.509 0.874 50 20 JCGD Cn1c(=O)n(CCC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc21 928973154 MKGYAOYPJNDXPP-GOSISDBHSA-N 454.439 0.261 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ncn(-c2ccccc2)n1 1778179848 JTHBVUJNGANAMG-PXDATVDWSA-N 489.341 0.388 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)Cn3ccccc3=O)CCO2)C1 1780097335 XWLLMPFZHCKKMK-QHCPKHFHSA-N 484.465 0.826 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CSCC(=O)O)CCO2)C1 1780098578 OYZBEQISPFYLEK-HXUWFJFHSA-N 481.483 0.781 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C2(N3CCN(C)CC3)CC2)C1 1780651878 SROVXALTHQORRM-WAOWUJCRSA-N 457.015 0.534 50 20 JCGD COc1cc(C)c(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1 1781921741 IMENOKKZGKVWKD-XMMPIXPASA-N 452.316 0.749 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1O 1782125886 GYMVFHZKXWOHJV-QHCPKHFHSA-N 482.497 0.106 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1 1782264936 XYHFZLNBVQNODN-HSZRJFAPSA-N 477.481 0.091 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](COC(C)=O)OC(C)=O)CCO2 1783349983 XRUCEDYGQHYPBK-DAYGRLMNSA-N 463.325 0.485 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3n[nH]cc3I)CCO2)C1 1783877745 ORRZBOIROSDULK-ZUZCIYMTSA-N 482.706 0.712 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3CCC(=O)N3C(=O)OC(C)(C)C)C2)C1 1784191241 XAZAGRHRBLLXRM-MWTRTKDXSA-N 495.577 0.115 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1 1785276442 YCWQBAMYWSRFOH-DEOSSOPVSA-N 466.299 0.219 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)CC1 1785317810 FKGNTNHMAMEPDE-VWLOTQADSA-N 499.373 0.377 50 20 JCGD Cc1ccc(OCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786984387 JPLJZHQZPWSTEO-NYVOZVTQSA-N 452.316 0.347 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@H]3COc4ccccc4O3)C[C@@H]21 1788607905 UKMLSMKHIDYMSR-ZLFOXAAKSA-N 495.536 0.509 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3)C[C@@H]21 1788610846 XTYYBNWCNPYQCG-YSSFQJQWSA-N 455.490 0.660 50 20 JCGD CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COCCOCCOCCOC)C[C@@H]21 1789864434 CKSQWTOGOUADIX-OKYOBFRVSA-N 464.987 0.680 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(CS(C)(=O)=O)nc3)C[C@@H]21 1791254075 KLNCAODIZRVJPM-DKIMLUQUSA-N 473.979 0.473 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2)[C@@H](O)CCl 1792984374 ZDMJLIZEFAYLRM-XXBVRILMSA-N 450.845 0.333 50 20 JCGD CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2)C(C)(C)C 1793194208 KKPYSJFVIGQYBB-KAQDRPSSSA-N 474.562 0.261 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc2ncccc12 1793328136 UKZJSTGIBRBJIZ-GPVSGQMNSA-N 474.521 0.679 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)c1ccccc1)NC(=O)NCc1ccccc1 1795380212 DULYEIYAICJUQT-DVKRWUGUSA-N 495.580 0.656 50 20 JCGD O=C(Cn1ccc2sccc2c1=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796188359 UNYLKHFCIAUSOW-BCDXTJNWSA-N 465.340 0.695 50 20 JCGD COc1cc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc(OC)c1OC 1796190115 WABFKCLKZHXMEO-ACDBMABISA-N 482.342 0.887 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2nc(Br)nn2c1)c1cccc(B(O)O)c1 1796379314 JJCNQGPNATWFDX-BJWYYQGGSA-N 498.146 0.737 50 20 JCGD COc1cncc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1 1796439602 PJMUAAYQGFZUMK-ZMQIZJGTSA-N 482.541 0.746 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2ccccc2n1 1796778045 LXCGWGMSMFCZAN-MABAGPRWSA-N 475.509 0.967 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(OC2CCOCC2)n1 1798375347 ULXMETTYLIEMJZ-GPVSGQMNSA-N 489.573 0.216 50 20 JCGD CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)C2 1799264861 ZIGPEHLOMFVHBE-UIVXKWKOSA-N 463.966 0.629 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn3nc(N4CCOCC4)ccc13)C2 1800974880 GPSDZNWVYKFGDY-RCJHGTSTSA-N 492.964 0.023 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(C)(C)CNC(=O)OC(C)(C)C)C2 1801014570 ZRBIOOVQMDAMAE-HGKCTWBKSA-N 483.610 0.500 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CCNC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1804464571 XWUIGBBGBZFHBC-MBSDFSHPSA-N 483.573 0.609 50 20 JCGD CN(C)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1805108555 LDERHVHMPPVGRG-AUSIDOKSSA-N 473.342 0.856 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1Cc2ccccc2CN1 1808239149 NMPOFVIYTZDJDG-PZUNEJSGSA-N 484.365 0.796 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)CC1 1809493863 ZWJRIICCJHPDLP-KSZLIROESA-N 472.995 0.359 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809967119 WKQGSYSVOCEXMM-NRFANRHFSA-N 450.348 0.176 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810234518 RFWQRWQRKLINKL-ALKREAHSSA-N 482.545 0.107 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810294356 JQYVLIRRBUEBPO-IOMROCGXSA-N 465.558 0.884 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CNC(=O)OC(C)(C)C)[C@@H]1c1cccnc1 1813074349 PSYXZFUUXIJTML-LAUBAEHRSA-N 476.578 0.985 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813407265 MKEKGCZURLTIPT-NYDSKATKSA-N 474.326 0.944 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815360564 JCKWKFQJFKXCDF-MRXNPFEDSA-N 476.327 0.334 50 20 JCGD O=C(CC(F)(F)C(=O)O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1817092178 ZHQPCOCOGGFOBD-NSHDSACASA-N 453.232 0.159 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnncc1C(=O)O)CC2 1817281796 PLULCKPWHRXVDX-PCMXRQBPSA-N 496.509 0.991 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCCNC3=O)[nH]n1)c1ccc(B(O)O)cc1 1817471328 FELKTIWMQTXYKS-SFHVURJKSA-N 491.317 0.039 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)[nH]n1 1818110634 LOJCLXXCUGCYBN-OXVLKEGXSA-N 494.512 0.851 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(N)=O)CC2 1821304214 CXASAJYPUIIZMO-JTQLQIEISA-N 476.471 0.871 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@@H]3CCc4nc[nH]c4C3)sc2C1)c1ccc(B(O)O)cc1 1826617507 UGCHNHOLVZOVCB-HIFRSBDPSA-N 465.344 0.577 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](O)CCl)CC2 1828308397 VVJBYTWXGBXBKS-ADEWGFFLSA-N 489.982 0.424 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)c2ccc3nncn3c2)CC1 1828641949 CCDJOPKXDKWQEC-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD O=C(Cn1nnc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1832208203 IKLVHTQWAADELW-WMZOPIPTSA-N 470.299 0.578 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3=COCC3)C2)C1 1832552078 XKEHSZBRZGVUJZ-HRAATJIYSA-N 473.954 0.879 50 20 JCGD CCc1oncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798017 VSOOUMSMZLAPPU-UHFFFAOYSA-N 454.336 0.416 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799337 YAVUQJAXVGRJJJ-IBGZPJMESA-N 478.402 0.825 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cn3cc(C)cn3)CC2)CC1 1834892867 QLWDQDLIRLBURW-MTDXEUNCSA-N 482.589 0.897 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cn(C)cn3)CC2)CC1 1835118397 YDZJGIOAZGHSQL-JVWAILMASA-N 468.562 0.739 50 20 JCGD CC(C)n1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1835204171 SBICSKQLCMLMBW-UHFFFAOYSA-N 468.367 0.038 50 20 JCGD Cn1nc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c2c1CCC2 1835397697 BNTGIJLDRZMQIB-UHFFFAOYSA-N 494.600 0.406 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)/C=C\C(=O)NC3CC3)CC2)CC1 1835658059 OCOUZRYOAUKEAK-OBQJUOPDSA-N 497.600 0.527 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2 1835682461 KQPJPJAARLWGJA-HNAYVOBHSA-N 459.385 0.898 50 20 JCGD CO[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1836343919 QKQRFMCNTFMPBJ-LJQANCHMSA-N 488.633 0.939 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)N1CCC(OC2CCN(C(=O)C(Cl)Cl)CC2)CC1 1837079574 RZGWUEVBYKNHJR-UHFFFAOYSA-N 470.419 0.519 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)CCO2 1837297655 YCQQNASTKRWKPX-PNHOKKKMSA-N 482.331 0.961 50 20 JCGD CSCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456319 KWJDHWZFMGZZNG-OAQYLSRUSA-N 465.576 0.144 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCC(F)(F)C3)C2)C1 1837456654 PGAPUMRDJKDWRJ-VLIAUNLRSA-N 467.473 0.191 50 20 JCGD Cc1ccc(NCCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(C)c1 1837541456 IJYCVLWBOIJMQN-AREMUKBSSA-N 495.385 0.555 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)CC2)CC1 1837921221 NQJVWZKDSPGPRZ-FPOVZHCZSA-N 497.401 0.380 50 20 JCGD Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)no1 1838395458 UAIBMADXRVGIHN-UHFFFAOYSA-N 470.530 0.836 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)ccn1 1838722646 GSKCPVHPPVTDJG-KKSFZXQISA-N 469.922 0.582 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2)C1 1839149333 CECJBAHUNUDXGC-VFCRVFHLSA-N 490.985 0.229 50 20 JCGD O=C(c1ccnc2c1OCO2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839201129 WTWMBXZKROIPKM-SUMWQHHRSA-N 460.256 0.571 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3C[C@@H](O)CN3C(=O)OC(C)(C)C)CCO2)C1 1840059684 MSLBQQPHTVJPQL-DBHNTLKXSA-N 489.997 0.831 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014523 SKZOPUNKQOVFKW-SFHVURJKSA-N 471.363 0.831 50 20 JCGD CSCC[C@@H](O)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845039303 CQODJLFIEZRWJS-GOSISDBHSA-N 463.604 0.650 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1846126712 RATOKAZTSVAHTH-MZNJEOGPSA-N 469.347 0.440 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)COc3cccc(C)c3)c2)CC1 16005430 HEDNABGNDHHBIL-UHFFFAOYSA-N 474.539 0.688 50 20 JCGD COC(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 24257171 MJFPTWKENMTVQE-UHFFFAOYSA-N 467.525 0.881 50 20 JCGD NC(=O)c1cn(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c2ccccc12 728330806 RYNMVHHPEMOWGQ-GOSISDBHSA-N 452.423 0.271 50 20 JCGD O=C(NNC(=O)[C@H]1CS[C@@H](Cc2ccccc2F)C(=O)N1)C1CCN(c2ncccn2)CC1 728889845 RPHPBHNBHYIXIA-MSOLQXFVSA-N 472.546 0.822 50 20 JCGD CN(C)S(=O)(=O)c1ccccc1CNC(=O)NNC(=O)C1CCN(c2ncccn2)CC1 728943123 HQGRABNNTWKEFJ-UHFFFAOYSA-N 461.548 0.474 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2ccccc2OCc2cn3ccccc3n2)c(=O)n(C)c1=O 748582844 KVULGLKUBKWULH-UHFFFAOYSA-N 479.522 0.948 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)CNS(=O)(=O)c2ccc(Br)s2)cc1 749837686 FYKPDSYQSNVDDD-UHFFFAOYSA-N 473.330 0.887 50 20 JCGD Cc1cccc(-n2cc(C(=O)NNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)nn2)c1 751048562 XFTJLYSDJFCGLJ-UHFFFAOYSA-N 498.565 0.990 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccc([N+](=O)[O-])n1C)N(S(C)(=O)=O)CC2 761418556 ZQYVEFSTIRLDKB-OAHLLOKOSA-N 495.514 0.661 50 20 JCGD CCN(CC(=O)N[C@H]1CCS(=O)(=O)C1)C(=O)/C(C#N)=C/c1cc(C)n(CCOC)c1C 790088087 ADMJKQFRZHUZDZ-MVDPLZLPSA-N 450.561 0.810 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)c1ccc2c(c1)OCO2 913415731 XXWUNAJHMIBZQB-UHFFFAOYSA-N 488.522 0.490 50 20 JCGD N#Cc1ccc(CS(=O)(=O)CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 915802977 YQSLFIMLYJCDMS-UHFFFAOYSA-N 490.563 0.719 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(C(=O)CCOc2ccccc2)C1)N[C@H]1CCS(=O)(=O)C1 919887935 IPDHJXDOFRMMNT-CVEARBPZSA-N 452.533 0.212 50 20 JCGD O=C(NNS(=O)(=O)c1cc2c(c(C(=O)O)c1)OCCO2)c1csc(N2CCOCC2)n1 919955206 CMMHPSVKWISFDG-UHFFFAOYSA-N 470.485 0.072 50 20 JCGD CCNC(=O)NNC(=O)CCCCCNS(=O)(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 920858901 UAXOCIIQEJFGJS-UHFFFAOYSA-N 489.620 0.660 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1Cc2ccccc2CN1 1777988261 TWBALDGYLYNYJK-PPJWLVRDSA-N 477.370 0.208 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1778165698 CRLSSWWYUNNJGW-YCRPNKLZSA-N 450.923 0.424 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)cc2C1 1778372456 AWLXTRHQOHYYOV-JTSKRJEESA-N 497.980 0.677 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032489 LKPDUKYAPVDCOA-OWJWWREXSA-N 498.515 0.086 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1[C@@H]3C=CS[C@@H]13)C2 1779374742 ZNJUMZACRPVAGT-CRAPNWAWSA-N 457.556 0.688 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1 1780118134 JRRPBIMFEJMENJ-QHCPKHFHSA-N 497.512 0.417 50 20 JCGD CCC(=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780559530 PVJGSDOLAFPRPA-HYBUGGRVSA-N 473.574 0.826 50 20 JCGD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c(O)c1OC 1781034044 HZMNTBGPAWYEMV-CJFMBICVSA-N 498.341 0.531 50 20 JCGD COc1cc(C)c(C(=O)N2CC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1 1781921737 IMENOKKZGKVWKD-DEOSSOPVSA-N 452.316 0.749 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1782424270 OSXXIHBRAWBVDH-ORAYPTAESA-N 454.936 0.823 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1COCCN1C(=O)OC(C)(C)C)CCO2 1783870627 DBHPLLUDLLALTE-MRUHUIDDSA-N 475.970 0.706 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)c1ccccc1 1783932979 NLXWTVLQDQEHNC-NFBKMPQASA-N 475.546 0.287 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCN(c3ccccn3)CC1)CCO2 1783935261 SAGBQZYLVQDNBF-XMMPIXPASA-N 472.590 0.501 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1 1784089416 BFTIOOHHVDBBMC-OWLYRPNTSA-N 458.964 0.348 50 20 JCGD O=C(CCc1cccc([N+](=O)[O-])c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784883425 BZAGJTVBHBONHS-NYVOZVTQSA-N 481.314 0.501 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CCO2)C1 1785445995 TZKSBAVEQXXYTI-BZMRFGKZSA-N 460.535 0.255 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(Cl)nc3Cl)C[C@@H]21)c1ccc(B(O)O)cc1 1786980882 CFOFJSXMSXOTSS-JQFCIGGWSA-N 478.141 0.975 50 20 JCGD COc1cc(F)ccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786986470 DLIFQCKOEUTWQB-ZRCAFCQKSA-N 456.279 0.421 50 20 JCGD CC(=O)O[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C[C@@H]21)C(C)C 1788477519 JBZGZPRRPTXBQR-QDGGXDBVSA-N 475.546 0.688 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C/N=C/c3ccco3)[C@H]2C1 1788678491 BTAZZCYTEIDYBL-RDHGHRJDSA-N 468.514 0.812 50 20 JCGD O=C(COc1ccccc1F)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790966528 BQAZGROTRIDFHN-MDKPJZGXSA-N 456.279 0.178 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C[C@@H]21 1791292162 BHZHEFQEJUFWGT-IHPCNDPISA-N 497.552 0.082 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCCNC(=O)OC(C)(C)C)C[C@@H]21 1791292422 QFYLQCGCZRIXQE-BZSNNMDCSA-N 483.610 0.644 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791651335 FNYYYQZIKDOORA-QBTDHISASA-N 468.514 0.141 50 20 JCGD COC(=O)c1ccc(OCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)cc1 1792340763 NRTIJBATMNLEEO-DKIMLUQUSA-N 454.907 0.431 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OCC(F)(F)F)n1)C2)[C@H](O)CCl 1792975880 BDYVZQIFSUJASA-NDPMZMCLSA-N 451.829 0.826 50 20 JCGD O=C(CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)Nc1ccccc1 1795732987 WRTXGIWUWUYBNS-NHKMSHSESA-N 479.342 0.379 50 20 JCGD N#Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)c(C(F)(F)F)n1 1795739114 WKKVEIZVCZQQHL-ZSBFGKGUSA-N 488.231 0.169 50 20 JCGD Cn1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(C(F)(F)F)n1 1796188808 RWFIKXGMDYRGIG-QDMKHBRRSA-N 450.226 0.684 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccn2c(O)nnc12 1796286037 POMZWGONGMZBFU-FMSGJZPZSA-N 452.309 0.669 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C=C/C(=O)NCc1ccccc1)C2 1798439635 QNXABEQZSGMRRX-JPRXPMQYSA-N 476.537 0.810 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1[nH]nnc1C)C2 1798522390 ULERVTRGFZZZHP-IVWMJMPLSA-N 458.431 0.464 50 20 JCGD CCS(=O)(=O)CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799865648 GHLJYQVMEALGFV-REPLKXPHSA-N 479.603 0.406 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1800801592 OGVVBYODHJLUTM-CUZKYEQNSA-N 465.906 0.567 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCc1ncccc1-3)C2 1801011790 DUOYPZHLOMWDCO-USGNIVHTSA-N 481.557 0.147 50 20 JCGD CC#C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)c1ccc(O)cc1 1801012188 MQZIYDWYWJYTOZ-MVOHMCPASA-N 470.570 0.852 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)NC[C@@H]1CCN(C(=O)C(Cl)Cl)[C@H]1c1cccnc1 1804195629 FYTDUCNJAMTUGY-HOCLYGCPSA-N 463.387 0.622 50 20 JCGD Cc1cc(C)n(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1804582867 WUKDQKGYGZZVIP-GCJKJVERSA-N 476.541 0.913 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807364255 DNEXZAWTUVDYPW-AUSIDOKSSA-N 464.331 0.094 50 20 JCGD CNC(=O)CC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808409538 NXXMQHAISBEUJC-CUVSIRLISA-N 453.503 0.358 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1)[C@H](F)Br 1808652570 YPUHUIUFHTXMOE-XIRDDKMYSA-N 491.383 0.508 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC2(CCCN(C(=O)CNCP(=O)(O)O)C2)CC1 1809660413 FOQQPCGNZPAEFX-HZHRSRAPSA-N 482.478 0.076 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc2n(n1)CCCC2 1809865232 PFPLCTYEQXLPEP-XXBNENTESA-N 473.342 0.928 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CCC4(CCCN(C(=O)c5ccc(B(O)O)cc5)C4)CC3)ccc21 1809971977 FNBBTRIARXOXMC-UHFFFAOYSA-N 490.369 0.715 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809973194 ZBONOYMQRYQDQF-UHFFFAOYSA-N 475.401 0.072 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCN2CCOC2=O)[C@@H]1c1cccnc1 1813070344 IVJXODQKZOYTJD-LAUBAEHRSA-N 460.535 0.303 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(Cl)ncn1)CC2)c1cccc(B(O)O)c1 1815361123 YFWIYEAOCRQVJM-LBPRGKRZSA-N 457.708 0.806 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CCN3CCOC3=O)sc2C1 1818697002 GKBRCPBQGLVSLZ-LBPRGKRZSA-N 452.537 0.270 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@@H]1CCc2nc[nH]c2C1 1822686335 BIYSEGQZJGRZAW-QRWLVFNGSA-N 462.319 0.924 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4c3CCC4)sc2C1 1824049767 HCQSJNJXQVPDIK-LLVKDONJSA-N 466.527 0.824 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1824466627 HMTXZZARQZGNBL-IBGZPJMESA-N 450.366 0.034 50 20 JCGD CCOc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)nn1 1826088996 SWOYKYWIVDRAHP-GFCCVEGCSA-N 461.548 0.931 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059809 JDIWXAAGKQNSJE-HXUWFJFHSA-N 451.332 0.821 50 20 JCGD COC(=O)CCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1828834611 KZXRQMHTLCMZPV-MBSDFSHPSA-N 495.960 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2C(=O)C=CC2=O)CC1 1828923743 WLTWPDJDPNMROK-LJQANCHMSA-N 482.541 0.234 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)CC1 1829621378 MKCJXVVDXPXZII-GOSISDBHSA-N 483.573 0.696 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CC1 1830737727 GTWINJSZNAAYRZ-VGOFRKELSA-N 487.981 0.610 50 20 JCGD Cn1cc(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)cn1 1832551511 PUJQEWBXDCABQM-HTAPYJJXSA-N 499.996 0.551 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)c1 1833308246 MBAQAOBIJKKTCJ-GOSISDBHSA-N 472.995 0.270 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncnc3)CCO2)C1 1834301226 VVJNKSVCFRINMY-HRAATJIYSA-N 483.953 0.679 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@@H](O)c1ccccc1 1834582154 GYBKKAGBGCGVEW-QHCPKHFHSA-N 465.359 0.285 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4c[nH]nc4c3)CC2)CC1)c1cccc(B(O)O)c1 1834799924 FIYBGWJBZYNNND-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc2c[nH]nc2c1 1835003050 DURXFEGCHTUEHU-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CSCC[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835118099 PMPIOHFKSBCDDY-RHKYMZEHSA-N 492.646 0.806 50 20 JCGD COc1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c(F)c1 1835737236 ZEPPWZUFJYTFER-UHFFFAOYSA-N 499.547 0.727 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737347 KQNBLHIHRGKKRF-QFIPXVFZSA-N 485.633 0.743 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCCC3(F)F)C2)C1 1835934115 OLASLWWUOPCFFC-RXVVDRJESA-N 466.290 0.262 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836121417 FYUSLSYGEJARLF-IFXJQAMLSA-N 472.336 0.497 50 20 JCGD O=C(c1cnc2cc(Cl)ccn12)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1836368169 ZSBUTEYMVRVXTR-HNAYVOBHSA-N 457.314 0.657 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1837221799 JOPHDGADWFCIAL-SFHVURJKSA-N 462.595 0.891 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccccc3F)C2)C1 1837460568 HFMLOMAZPNNQKN-XMMPIXPASA-N 485.516 0.527 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cc4cn[nH]c4cn3)CC2)CC1 1838354834 LDKQXXWZAAMTFB-UHFFFAOYSA-N 492.540 0.882 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(OC4CCOCC4)n3)CCO2)C1 1838355930 XAZXTBGIBKPUQA-MBSDFSHPSA-N 497.976 0.963 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838418313 XMNGPKRTQIEOTE-DJJJIMSYSA-N 470.935 0.080 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)ccn1 1838722643 GSKCPVHPPVTDJG-HRAATJIYSA-N 469.922 0.582 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3OCCC4)CCO2)C1 1839516132 BYIVQLMYYXVIKL-KUHUBIRLSA-N 471.352 0.767 50 20 JCGD CCN(C)[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1839638008 ABRAECUCLOTSBY-PNLZDCPESA-N 491.029 0.915 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(C)c(C)[nH]c3=O)C2)C1 1839962618 LRBWRHQIZBXPAV-IFXJQAMLSA-N 471.352 0.630 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1840038296 PBKSAHOIWLYCQD-ODYPEACGSA-N 477.945 0.607 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1840081798 ITYJUZRKYNEHAS-KNQAVFIVSA-N 495.013 0.547 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cncc(OC)c3)C2)C1 1840150976 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CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN2C(=O)COc3ccc(Cl)cc32)c1 23393185 XPVWZLCFSZEBTN-UHFFFAOYSA-N 466.903 0.777 50 20 JCGD C[C@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C[C@H](C)O1 725870215 DEGPRNSWNJUVJL-GJZGRUSLSA-N 457.487 0.789 50 20 JCGD CN(C)C(=O)[C@@H]1CCCN1CCCNC(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 726278002 UKGXTKWJFWCSQB-IBGZPJMESA-N 494.618 0.358 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccc([C@@]3(C)NC(=O)NC3=O)cc2)c1 726282775 SGOKLWFKQZAEMI-OAQYLSRUSA-N 488.526 0.136 50 20 JCGD O=C(COC(=O)CCC(=O)N1CCc2sccc2C1)NNC(=O)[C@H]1COc2ccccc2O1 728331210 FOVQEDRBYKFYFK-QGZVFWFLSA-N 473.507 0.944 50 20 JCGD CCCCOc1ccc(C(=O)NNS(=O)(=O)c2cnc3c(c2)c(O)nc(=O)n3C)cc1OC 728502592 NFPHPQMVWXLOCT-UHFFFAOYSA-N 477.499 0.845 50 20 JCGD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)CN(C)S(=O)(=O)c1ccc(C)cc1 729511559 MNCMGNBFGJJWPT-GOSISDBHSA-N 486.558 0.051 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)c1c(F)ccc(S(N)(=O)=O)c1F 747275787 OKTCGDAGIDCSJG-UHFFFAOYSA-N 477.829 0.892 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)N2CCCC2)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C 748245984 BQHZSWHWAPNCNH-GOEBONIOSA-N 466.560 0.936 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)cc1 751201025 YJPAOLYKVDDKTQ-UHFFFAOYSA-N 480.568 0.617 50 20 JCGD CC(C)CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 914748198 MSNCJIWCGCCBJU-UHFFFAOYSA-N 482.584 0.946 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1 920681437 KGBYXUCQKJNDIE-QHSLDKKCSA-N 464.478 0.794 50 20 JCGD Cn1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1C(F)(F)F 1778252195 HSWGLIFCXLXCPL-IIBYNOLFSA-N 494.279 0.560 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3csc(C(F)(F)F)n3)CCO2)C1 1779032418 JJKRNHILGASNMA-GOSISDBHSA-N 484.460 0.918 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3cc(-c4ccccc4)no3)C2)C1 1779578182 VNRFGBANFCRFPI-DEOSSOPVSA-N 461.283 0.779 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cccc(-c4cnco4)c3)C2)C1 1781792800 NEGKOBKQTWENNG-DEOSSOPVSA-N 461.283 0.779 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1783508679 BKNJNDPPNXVAIS-IQGLISFBSA-N 495.341 0.125 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784091307 ZUZMIEGZXKESEA-GVRJEKJASA-N 463.959 0.106 50 20 JCGD CCS(=O)(=O)CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1784446602 WDEUFHPPNBVGQH-VGWMRTNUSA-N 496.026 0.533 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(C)cn3)[C@H]2C1 1785986390 HSRLNOLQDSDVIA-TVHLAIKQSA-N 453.503 0.512 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21 1790958235 MVXFTVICTHNPMZ-MXAVVETBSA-N 458.313 0.945 50 20 JCGD CC(C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)N1Cc2ccccc2C1=O 1792974826 DWOVERMJDHBSPD-LHDHZVESSA-N 463.962 0.856 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CNC(=O)c1ccco1)C2 1793880765 FXURAFDBPUOZND-KRXQYRFLSA-N 498.964 0.731 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)cncc1Cl)C2)c1ccc(B(O)O)cc1 1795732675 KDWJSOWQCDBACD-IVWMJMPLSA-N 464.114 0.585 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737836 ZBAUNLXHUAARRP-HNJRGHQBSA-N 487.362 0.039 50 20 JCGD COc1cc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1OC 1795739739 IAQRAIILEUEDJA-FAQVEIGNSA-N 468.315 0.209 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)C1CCN(Cc2ccccn2)CC1 1796188279 KLCILSNZTUXGLJ-BKFWDETESA-N 476.386 0.925 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](C)Br)C3)n1 1796719084 FBWLCSYLDIYBBR-NJBDSQKTSA-N 457.281 0.985 50 20 JCGD Cc1nc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c(C)s1 1797749728 LTGFXSBZBNVYAD-HBCWATKFSA-N 458.544 0.204 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1CS(C)(=O)=O)C2 1797954412 HMHIAYYXBQRLNW-CCWDJLKJSA-N 469.636 0.681 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc3c(n1)OCCO3)C2 1798440209 HBPFMUFCVRWWFC-BTTYYORXSA-N 452.471 0.417 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1803587517 HDZLUEMXMQRYPL-OXFYSEKESA-N 467.592 0.141 50 20 JCGD CC(C)(C)OC(=O)CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1803897678 JEPIQJURQSFXDY-XMSQKQJNSA-N 467.331 0.813 50 20 JCGD O=C(CN1C(=O)CNC1=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1 1804090485 HUACPYAHZFMGTC-DYVFJYSZSA-N 452.309 0.424 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807365981 ZWJVMIFHCPNTKV-DENIHFKCSA-N 484.325 0.746 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CSc2ncccn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370821 KYHUDRMYSQCYKY-GHTZIAJQSA-N 477.355 0.663 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1808195408 FQIBAMGIDDZMKK-NXOAAHMSSA-N 470.954 0.573 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1 1810302244 GYYPLKJPBKBTTF-UZLBHIALSA-N 485.508 0.756 50 20 JCGD CNC(=S)NCCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1810306711 MZNSAVCPMSDWQZ-RBESNOOPSA-N 498.613 0.705 50 20 JCGD COCCOCCOCCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1812930768 BSDRAKQGNQCTNZ-XUZZJYLKSA-N 499.373 0.151 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1CCN(C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[C@H]1c1cccnc1 1813030488 HVMKKUCCJKERLH-YEWWUXTCSA-N 481.962 0.807 50 20 JCGD O=C(CCc1cnccn1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813443396 KMKNMJOGRAFKMV-CVDCTZTESA-N 459.315 0.504 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815344231 OWVVEBTYAWMHKH-WFASDCNBSA-N 466.332 0.339 50 20 JCGD CC(C)n1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815354513 GEVOPXNHFFQBRE-AWEZNQCLSA-N 454.321 0.535 50 20 JCGD COCCOCCOCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1831723464 WDDPPOSWFQRQCP-HSZRJFAPSA-N 490.406 0.669 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1COc3ccccc3O1)CCO2 1832499623 VLCVADGQNYLYDW-XERREHJYSA-N 454.907 0.537 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC(O)C3)C2)C1 1832549302 HHYKVFMSFBLBFG-SQDGQLNESA-N 475.970 0.346 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832881916 WANMVPAGGDOJGY-AUUYWEPGSA-N 471.352 0.374 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3ccnc3)CCO2)C1 1834381684 IZGNUIBSWYWYSD-KKSFZXQISA-N 485.969 0.472 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)CS(C)(=O)=O)CC2)CC1 1834572660 PKPIWIFUOYGCRM-OAHLLOKOSA-N 452.415 0.776 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cccc1C=O 1834797983 SPERZOFQPUPYGK-GOSISDBHSA-N 480.374 0.427 50 20 JCGD COc1ccc(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1F 1834800393 FTAIZHRBHZGLJG-UHFFFAOYSA-N 497.376 0.942 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cn3ccccc3=O)CC2)CC1 1834823949 ZEHNBGNEDJLKEV-MTDXEUNCSA-N 495.584 0.554 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(F)c3F)C2)C1 1835939147 GSKVIMVKDGMQPH-QFIPXVFZSA-N 460.242 0.028 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939994 RRLSOSZMSZTHBW-SBUREZEXSA-N 485.371 0.012 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(F)c3F)C2)C1 1835941185 KHRBAYDKPNKQER-JOCHJYFZSA-N 478.232 0.168 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCC(OC3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)no1 1836717490 WVCUDLKUZWANJN-KRWDZBQOSA-N 456.927 0.311 50 20 JCGD CC1CCN(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)CC1 1836802931 UJRORLFXVPLEAN-UHFFFAOYSA-N 471.407 0.711 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C#Cc3ccc(Cl)cc3)C2)C1 1837455739 FSVHUABOQZHJTE-XMMPIXPASA-N 497.939 0.460 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1csc(C(F)(F)F)n1)CCO2 1838189929 WLOPARNLWRWZJL-LJQANCHMSA-N 499.276 0.226 50 20 JCGD Cn1nc2c(c1C(=O)N1CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC1)CCC2 1838394490 BBHOSWPNOXONCV-UHFFFAOYSA-N 495.584 0.833 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838499019 LIMVIKZJOFJGKT-BTYIYWSLSA-N 463.922 0.567 50 20 JCGD COCCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839053998 BAUOMMJHCYERAB-DEOSSOPVSA-N 491.589 0.216 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)N(C)C(=O)OC(C)(C)C 1839075220 WSYWRBZLZBDJDZ-STXHMFSFSA-N 463.959 0.298 50 20 JCGD O=C(c1cc(Cl)ncn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200854 QYJFAPDTVUVWPC-DOMZBBRYSA-N 451.680 0.891 50 20 JCGD O=C(Cn1cncn1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802284 RAPWKVLCYJSYCJ-RXVVDRJESA-N 492.374 0.741 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)N3CCN(C)CC3)C2)C1 1839966182 WUPSKJUDUNBJPW-SQGPQFPESA-N 475.428 0.252 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c[nH]c4ccccc34)C2)C1 1840185119 JMPRJHZLQJAKTP-DEOSSOPVSA-N 471.558 0.540 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)cc3)C2)C1 1840185675 UXUNPMNSMVYDCE-OAQYLSRUSA-N 452.939 0.783 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C1)C3)CCO2)NC(=O)NCc1ccccc1 1840598847 CNFCFFMSLBKNNL-VZTJNBFISA-N 485.585 0.589 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840911483 FZSYNBASZHZHRU-YSVRDODPSA-N 487.981 0.440 50 20 JCGD O=C(c1ccoc1I)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843011065 LKOZMWOLHRLSMZ-UHFFFAOYSA-N 480.067 0.695 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC3(CCCN3C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)n1 1843415376 CVMWOEUUUGZSAU-VULFUBBASA-N 451.487 0.991 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)[C@@H](F)Cl)C2 1843428880 WIERAKANZNZTMY-DLBZAZTESA-N 497.760 0.540 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1844158602 DFJDKZHDTLZPJJ-INIZCTEOSA-N 464.431 0.402 50 20 JCGD CCNC(=S)NCC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1848098473 DLGCJYHAYKAGLM-IHRRRGAJSA-N 462.016 0.804 50 20 JCGD Cc1ccccc1NS(=O)(=O)c1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1 9931202 BGPARUTWOLKNGI-OAHLLOKOSA-N 451.526 0.992 50 20 JCGD COC(=O)c1ccc(C(=O)OC)c(S(=O)(=O)NNC(=O)c2csc(N3CCOCC3)n2)c1 16098552 OQQIKDHEDOPTHD-UHFFFAOYSA-N 484.512 0.176 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 16128106 UZXKEUJPPSBEHF-UHFFFAOYSA-N 455.514 0.339 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1c(C)c2c(C)nn(C)c2[nH]c1=O 105959635 GHSJLPLYQDOBOX-UHFFFAOYSA-N 473.559 0.874 50 20 JCGD Cc1cccc(N2C(=O)N[C@H](CCC(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)C2=O)c1 730868090 YUFZWNBLUHBJDU-APWZRJJASA-N 496.476 0.731 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 731051074 JMVJFYADPFRXIS-UHFFFAOYSA-N 454.848 0.843 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)Cc1ccccc1F 731344642 XUSKWYORQKNDTQ-VUVZNRFTSA-N 497.570 0.909 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)NC1CCCC1 744052636 MMNNDEBCSTWQAV-GWKQRERASA-N 472.589 0.653 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCCCC2)cc1)NNC(=O)CNC(=O)c1ccco1 751211707 JOYZHXPRKUZXCE-UHFFFAOYSA-N 462.528 0.964 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)c1 788273994 CSLIEFKBEQEKCD-UHFFFAOYSA-N 498.945 0.537 50 20 JCGD NS(=O)(=O)c1ccc(Br)c(C(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1 794419996 ASQKCSFIDHRSOX-UHFFFAOYSA-N 456.274 0.943 50 20 JCGD Cc1ccc(S(=O)(=O)NCCCC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cc1C 913155910 CGOFSUQRPPXLAU-UHFFFAOYSA-N 457.516 0.799 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)cc1 913455266 XMHATONXJFYDBP-GOSISDBHSA-N 458.496 0.856 50 20 JCGD Cc1ccc(C)c(OCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCNC(=O)C3)cc2)c1 914458217 IEFXPCOSMJHYSN-UHFFFAOYSA-N 460.512 0.264 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2CN(Cc3ccccc3)CCO2)cc1 915894458 KHIZFEURKDOKJI-HXUWFJFHSA-N 489.598 0.847 50 20 JCGD CCO[C@H]1C[C@H]1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC(C)C)n(Cc2ccccc2)c1=O 916147851 HAGLMKKRLQYBEY-MSOLQXFVSA-N 482.541 0.636 50 20 JCGD C[C@H](Cn1ccnc1)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 916623405 RDFVOLQUAPZWTP-MRXNPFEDSA-N 464.548 0.256 50 20 JCGD COC(=O)c1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)ccc1O 917719701 MKKQHBZONHTUOL-UHFFFAOYSA-N 457.486 0.052 50 20 JCGD CCOc1ccc(C(=O)NNS(=O)(=O)c2ccc(OC)c([C@]3(C)NC(=O)NC3=O)c2)cc1OC 917727124 CWIPBVFOPDZULA-NRFANRHFSA-N 492.510 0.780 50 20 JCGD NS(=O)(=O)c1ccc(OCCSCC(=O)NNC(=O)c2nnc(O)c3ccccc23)cc1 918548636 HRLPACZOBGRCPW-UHFFFAOYSA-N 477.524 0.556 50 20 JCGD COc1cccc(/C=C(/C(=O)NNC(=O)c2csc(N3CCOCC3)n2)n2nnnc2C)c1 920425132 RYPPMYJMDBIIOU-BOPFTXTBSA-N 470.515 0.743 50 20 JCGD COc1ccc(CC(=O)NNC(=O)NCCc2cccs2)cc1S(=O)(=O)N1CCOCC1 920860657 XCGPYEMPVPDIQL-UHFFFAOYSA-N 482.584 0.893 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1 1778947216 DHOBSKPCGCIVKY-FQEVSTJZSA-N 463.926 0.199 50 20 JCGD CCOc1ccc(CC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1OC 1779034677 SKQADUWZFJUXNX-RUZDIDTESA-N 497.552 0.779 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccnc(F)c1)C2 1779371352 RNXMCLKNJTZWDP-VGOFRKELSA-N 456.478 0.661 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncccc1F)C2 1779372690 XGLKKACBRLCAKL-VGOFRKELSA-N 456.478 0.661 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1781023696 NPWLXMIUONNJJP-NRFANRHFSA-N 455.556 0.103 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)C3(Br)CC3)C2)C1 1781345400 HJVGILJJHIAIGR-KRWDZBQOSA-N 452.309 0.056 50 20 JCGD COc1cc(Cl)ccc1CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1782900109 WNSMBKGRMJFZSB-QHCPKHFHSA-N 472.734 0.715 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1783193446 LHVYEIZDWLATCM-VLVHOKLOSA-N 483.968 0.987 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccnc3C(N)=O)C[C@@H]21 1783969207 JPNYKAYHVBQLDC-DHMWGJHJSA-N 453.337 0.805 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1785453846 WUTUPJYKJVWDAQ-LQWHRVPQSA-N 455.914 0.303 50 20 JCGD C[C@@H]1[C@H](C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)CCN1C(=O)OC(C)(C)C 1785744789 XESQAFWLTMSZQH-QZTZHPFYSA-N 495.621 0.835 50 20 JCGD NC(=O)[C@H](N)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)Cc3ccccc3)C[C@@H]21 1786892857 PYJFNPWEKBKMEG-QTMHVTGLSA-N 495.418 0.565 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981768 KLYHDISKLJXYJU-GKCIPKSASA-N 471.250 0.321 50 20 JCGD CN(C)[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)c1ccccc1Cl 1786982877 BVRWNVWVWSTMLB-RBQRNVLBSA-N 499.804 0.916 50 20 JCGD COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1C 1786986655 VOPMBXHKWFIQQK-XJABCFGWSA-N 452.316 0.591 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3csc4c3CCCO4)[C@H]2C1 1787259216 BKRXGQFRCITDPP-IXDGSTSKSA-N 485.566 0.979 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C[C@@H]32)nn1C 1789066747 LUTCNUQRENPFBU-AYOAJRLASA-N 469.546 0.710 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1790266655 LNFUSCJMXVJCLB-FRJURHEUSA-N 454.911 0.854 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Cl)C[C@@H]21 1791103214 QGMHWPKIJAXZJW-JHZZJYKESA-N 479.933 0.957 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cnc2ccccn12 1792931680 BMGVKORWEFOTOQ-HNAUYISWSA-N 477.525 0.600 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1C[C@H](F)CN1C(=O)OCc1ccccc1)C2)[C@@H](O)CCl 1792980089 LJTWEJOCNMDVAX-XSEPRYCASA-N 497.951 0.925 50 20 JCGD CC(=O)Nc1cccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)n1 1794279341 JXSKHTRUBTXJPJ-UIZNVDRRSA-N 481.513 0.377 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(F)(F)F)nc1)C2)c1cccc(B(O)O)c1 1795737403 DCTHGHYJFBNGMD-JLVBRIDZSA-N 463.221 0.297 50 20 JCGD CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Cl)CC1 1796365181 VJCLSWHUNBWCBO-LXTVHRRPSA-N 463.934 0.872 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2 1797785906 KVBRIZKESKJVHQ-LMXXTMHSSA-N 463.325 0.102 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C=C\C(=O)NC1CC1)NC(=O)NCc1ccccc1 1798297429 NAXXBSGJZNULPD-FJSXSUQBSA-N 482.585 0.806 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccco1)C2)NC(=O)NCc1ccccc1 1799094676 DNSVXDFFESZBRQ-RMFSNUHRSA-N 455.515 0.829 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1N1CCCCC1 1799782391 BKBGUUWOUFBBRB-IRJINJETSA-N 477.370 0.874 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)n(C)c(=O)n3C)C2 1800978651 YLYHWWYOOLXFOI-BASYENTBSA-N 450.923 0.334 50 20 JCGD Cc1nn(C)c(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1F 1805147426 SQUWKVMJSJMONV-XLIONFOSSA-N 465.294 0.576 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807370435 FANONGPJOMMKHW-WGGBDISSSA-N 473.342 0.977 50 20 JCGD CN1CCC[C@H](C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)C1 1807540706 JKNMEKZLKPOUPI-URVUXULASA-N 450.348 0.423 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@@H]3c3cccnc3)nc2N1 1807935706 AMEJNVFXDQVRTE-WMZHIEFXSA-N 499.336 0.675 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc(O)n1 1808334424 XUVUZVWFISIUTB-AVRDEDQJSA-N 460.299 0.804 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H](F)Br 1808662138 WLGREJOQECTKLK-USXIJHARSA-N 464.100 0.772 50 20 JCGD C[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1 1810493408 KIHQTBYFMKXOPJ-NSHDSACASA-N 452.313 0.441 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1 1814870352 PSTSFQMZCYJCLO-BFHYXJOUSA-N 459.931 0.887 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cc3ncccn3n1)CC2)c1cccc(B(O)O)c1 1815356499 IBHOASXYYMWTHQ-CQSZACIVSA-N 462.300 0.405 50 20 JCGD O=C(CNC(=O)c1ccco1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1817605075 UDKIFNRDVWROSY-QGZVFWFLSA-N 465.275 0.418 50 20 JCGD CC(C)n1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819796750 DIGKJWJLSFDXOI-LLVKDONJSA-N 469.531 0.854 50 20 JCGD N=C(N)SCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551706 TUELMJIWNOGSQT-HRAATJIYSA-N 498.005 0.665 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN(CCO)CCO)CC1 1831484196 ZWMJHWGGOATELT-FUHWJXTLSA-N 462.429 0.924 50 20 JCGD CN[C@H](CC(=O)NC1CCN(C2CCN(C(=O)[C@@H](C)CBr)CC2)CC1)C(=O)O 1834738584 HHEUWZBFBIBTOP-XJKSGUPXSA-N 461.401 0.652 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C[C@H](N)c3cccnc3)CC2)CC1 1834763117 TVEHSQOVODDSPL-QFIPXVFZSA-N 494.600 0.355 50 20 JCGD CC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1834864205 CBZIDTBANZTYHH-KKSFZXQISA-N 475.970 0.944 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3cnccn3)CC2)CC1 1835118175 DBZDIVFRQSAZEF-LQKURTRISA-N 466.546 0.796 50 20 JCGD COc1ccccc1CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835927247 NAELJAANTJHRPV-RUZDIDTESA-N 482.342 0.078 50 20 JCGD N#Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(Cl)c1 1835931936 HSXZNLGMYGAEET-HSZRJFAPSA-N 483.717 0.275 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc4occc4c3O)C2)C1 1835939747 ZUQZBBITFNMPNO-DEOSSOPVSA-N 480.282 0.202 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cc(CO)on3)CC2)CC1 1836188287 DKLMQLDSFYCNSK-CVKSISIWSA-N 485.545 0.486 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cc(F)ccc3[nH]1)CCO2 1836803465 NPRNSPGWXIMQGN-XMMPIXPASA-N 481.289 0.371 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cc3n(n1)CCCO3)CCO2 1836967948 FFMYSFJQNNPAPW-SFHVURJKSA-N 457.325 0.521 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc4c3NC(=O)C4=O)CCO2)C1 1837140112 PKZMILWEOHWVTN-FKIZINRSSA-N 480.315 0.675 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1 1837459329 CUAHBYMFQXPHFO-QHCPKHFHSA-N 469.498 0.078 50 20 JCGD COc1cc(C)ccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460361 DFVIYVCVJRJOTI-DEOSSOPVSA-N 483.525 0.386 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)n1nc(C)ccc1=O)CCO2 1837658990 JMKBAPJAQACEQO-IERDGZPVSA-N 454.955 0.761 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3csnn3)C2)C1 1838527324 NWHLCFRTFOZVBK-HXUWFJFHSA-N 491.482 0.755 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)C)C2)C1 1838528060 CDXQHFFDYBQPJX-NRFANRHFSA-N 464.475 0.152 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1838549146 CJKYGPHFECXOHU-MGPUTAFESA-N 460.886 0.513 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C2)C1 1840035503 UKVHHLFNQJVWRH-KLHJMIIUSA-N 479.375 0.992 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1 1840183653 RIIVVYJQCPYFNV-HXUWFJFHSA-N 453.927 0.178 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1N(C)C 1840185667 UVVXAVFZAYCESG-DEOSSOPVSA-N 491.589 0.204 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N3CC4(CCCN4C(=O)[C@H](O)CCl)C3)=NO2)C1 1841353637 HSNLICUPDZKWES-CQSZACIVSA-N 456.927 0.555 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1O 1844264952 CEKYOMCCLUZWKZ-UHFFFAOYSA-N 452.471 0.480 50 20 JCGD O=C(c1ncn2c1CNS(=O)(=O)c1ccccc1-2)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847566275 RVNYSKJXYDYQRX-HEHGZKQESA-N 479.946 0.079 50 20 JCGD Cn1nc(C(=O)NNC(=O)C2CCN(S(=O)(=O)c3ccc(C#N)cc3)CC2)c2ccccc2c1=O 15856959 SNFQWEFECFXRIO-UHFFFAOYSA-N 494.533 0.667 50 20 JCGD O=C(NNS(=O)(=O)c1cc(F)cc(F)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1 16128116 FOVIOJKOQXYIBB-UHFFFAOYSA-N 461.468 0.609 50 20 JCGD CC(C)CC(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 24608414 GHWHTSBEGDYCLK-CQSZACIVSA-N 453.970 0.615 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC(NS(=O)(=O)c2ccc(F)cc2)CC1 725873847 REWVLELIITYUIH-UHFFFAOYSA-N 483.547 0.801 50 20 JCGD COCC[C@@H](C)NC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 726261947 XWRAUWQYIYMZSR-CZUORRHYSA-N 472.564 0.708 50 20 JCGD O=C(NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1)c1csc(N2CCOCC2)n1 726522201 FVLAIDGXOPAWOV-UHFFFAOYSA-N 485.501 0.914 50 20 JCGD O=C(CSCC(=O)NNC(=O)Cc1ccccc1F)NNC(=O)Cc1ccccc1F 731328654 AIWMICJDZDAOEX-UHFFFAOYSA-N 450.467 0.778 50 20 JCGD O=C(COC(=O)COc1ccc(N2CCCC2=O)cc1)NNC(=O)[C@H]1COc2ccccc2O1 757016796 VSHCRLMSTRTOMW-LJQANCHMSA-N 469.450 0.723 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)COc2ccc(F)cc2)c1 910825361 IIKSSRJCBIQZIL-UHFFFAOYSA-N 480.518 0.753 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)C1CCN(c2ccc3nncn3n2)CC1 914084168 WFEORVDVTRITBZ-UHFFFAOYSA-N 477.573 0.700 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccccc2Cl)c1 915077267 ZUBMHCGLXDKJQM-UHFFFAOYSA-N 459.933 0.873 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCCNC(=O)C(C)C)N(S(C)(=O)=O)CC2 915906987 WKSOJDZMVWYUEW-MRXNPFEDSA-N 499.590 0.055 50 20 JCGD Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 916278253 KSGQMBNBMVGTGP-UHFFFAOYSA-N 458.500 0.164 50 20 JCGD O=C(NCCS(=O)(=O)N1CCN(c2ccccn2)CC1)NNC(=O)c1ccccc1F 916516275 IXTXCLYOWDKBKG-UHFFFAOYSA-N 450.496 0.317 50 20 JCGD CCC(=O)N[C@H](C)C(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 920436372 ICZSWHYCJUWDJU-IUODEOHRSA-N 470.548 0.015 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H](C)n1ccnc1)c(=O)n2Cc1ccccc1 1317999528 XEIVXDUJMAQPRY-HNNXBMFYSA-N 464.486 0.033 50 20 JCGD COc1ccc(CCC(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779030783 IDJOCOXNXMHRTK-XMMPIXPASA-N 467.526 0.770 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1779316817 FFTYWGAUDYMXSX-CNNODRBYSA-N 496.402 0.974 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)C(C)C 1779372497 KAEUKNWOUIENBX-DNVFCKCGSA-N 475.546 0.400 50 20 JCGD COc1ccnc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)c1OC 1780448485 KZXOSVPCPDFUIU-OJLHXUGZSA-N 484.513 0.676 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969378 YXYZIOOTXDGTRV-GCJKJVERSA-N 481.981 0.416 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1N(C)C 1781129049 ZWECPOJWFWJUBO-QHCPKHFHSA-N 461.563 0.578 50 20 JCGD O=C(/C=C/C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)NCc1ccco1 1781331198 GJQSGDWIEYVSOS-CMDLKFMISA-N 458.284 0.972 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C2)C1 1781552188 WXVWTXVKSPDXDC-NRFANRHFSA-N 457.223 0.171 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1C 1781913368 CNYAPGLZSXTERS-HSZRJFAPSA-N 459.547 0.770 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)ccn1 1782211967 KUIVGJTWWMJIRE-WZONZLPQSA-N 474.562 0.541 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC(c3ccccc3)=NN1)C2 1782213282 LKJOHEBNZWTBCU-BPYKYCOYSA-N 484.601 0.640 50 20 JCGD O=C(CNC(=O)C(F)(F)F)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1782236368 SUKKKQAQEUIUAP-GLXFQSAKSA-N 462.238 0.869 50 20 JCGD CC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1783141767 NMVOVMJSVIUJDO-FXAWDEMLSA-N 452.349 0.959 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCOc3ccc(F)cc3)CCO2)C1 1783933415 YDXDGJBIDMEINV-QFIPXVFZSA-N 450.511 0.798 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@H]1CC(c2ccccc2)=NO1 1784404360 FUEYMIJLORLCAY-MHADKKCISA-N 477.326 0.153 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610479 AYJUMGMIFUEWQL-SLUIBLPYSA-N 467.530 0.174 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)NC(=O)OC(C)(C)C)[C@H]2C1 1790176717 CZYZMVUHUXZQAK-MCZMQQNQSA-N 464.357 0.593 50 20 JCGD CC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COCCOCCOCCOC)[C@H]2C1 1791142939 ANLBFBGEJDOTKW-OKYOBFRVSA-N 464.987 0.680 50 20 JCGD COc1cncc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1 1791287918 DBHXYTKXDISNTF-IHPCNDPISA-N 461.563 0.376 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CC(F)(F)C1)NC(=O)NCc1ccccc1 1792600692 CGJJMYZXNSLVBX-OPVJXMOQSA-N 479.528 0.968 50 20 JCGD Cc1onc(-c2ccccc2)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1794612544 TURNNIKXVAWULB-HATOLVCRSA-N 475.310 0.847 50 20 JCGD CCOC(=O)/C=C/C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1795088663 CSJGRWAYFSFXGJ-IVUUIMBCSA-N 487.557 0.042 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCCC1=O 1795448459 DPOWJHXFRQACFI-KRXQYRFLSA-N 472.970 0.331 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3sc(N)nc3c1)C2 1797750694 OYMDQCGYAFJAIB-IVWMJMPLSA-N 481.538 0.394 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797956272 NIPGNKBEONXZOI-YYAJDYIMSA-N 473.643 0.703 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F 1800333419 QYFMMOPERGRNIE-WWKBNMOASA-N 478.452 0.526 50 20 JCGD COc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)ccc1[N+](=O)[O-] 1801012647 UQLQXSLMLUXRLS-MFKICJERSA-N 477.518 0.109 50 20 JCGD CC#C[C@@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(O)cc1 1801054195 NSCJGMARMNTVKI-MGPQRACWSA-N 476.338 0.472 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)c1 1801342245 NWUFOOBJGQXZKF-DXKRWKNPSA-N 497.600 0.688 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2csnn2)[C@@H]1c1cccnc1 1803749610 DQKQWFCCCSCXJC-GUYCJALGSA-N 452.500 0.565 50 20 JCGD CCOC(=O)N1CCC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)CC1 1804119045 LIIYQHGMUGFYLT-ACDBMABISA-N 457.336 0.487 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365418 JSGDQPLLTKXPQZ-FPOVZHCZSA-N 496.373 0.994 50 20 JCGD CC1CCN(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1807367088 XEUJGQUYZTXSSH-ZJSXRUAMSA-N 464.375 0.813 50 20 JCGD CC(=O)c1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n[nH]1 1807369361 HSJBQDANEUINDU-UWJYYQICSA-N 461.287 0.321 50 20 JCGD COc1ncc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1F 1807369861 XJTWJQYCFAMFKK-UTKZUKDTSA-N 478.289 0.938 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)Cc2ccc3ncnn3c2)[C@H]1c1cccnc1 1807408355 KQXCDFLETCVLQG-WZONZLPQSA-N 499.535 0.685 50 20 JCGD CCc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n(C)n1 1810926313 VHNNCQOIOBQTKW-PGRDOPGGSA-N 461.331 0.691 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)C#CC(=O)O)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1812877605 MHHSPHHQRHQEJP-RDPSFJRHSA-N 492.536 0.522 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1813065616 KWXJFENOBLVGSJ-UYGSHGSRSA-N 484.513 0.016 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1813091091 LDFSXQOSEWNMLO-HOJAQTOUSA-N 457.361 0.195 50 20 JCGD CSCC[C@H](O)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813095890 PFLWKSKUJVCJJW-UWVAXJGDSA-N 451.593 0.574 50 20 JCGD COc1ncc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1F 1815355123 NMFYVBUZFFNSIM-CQSZACIVSA-N 470.291 0.905 50 20 JCGD COC(=O)CSCC(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828923315 DLFCECLMDHHIHZ-GOSISDBHSA-N 477.587 0.825 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924505 VMENSTVPOCNLBO-HNAYVOBHSA-N 456.547 0.609 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828926919 UGIDIFRCWALUBR-MGPUTAFESA-N 458.563 0.785 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H]1c1ccc(F)cc1)CCO2 1830429274 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COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)CC2)CC1 1833833568 QAIZAKNBDHXUKG-KDOFPFPSSA-N 496.008 0.818 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3nccs3)CC2)CC1 1834283871 LPYDBMWMNBUZTD-UHFFFAOYSA-N 457.560 0.641 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1)N1CCN(C)CC1 1834423369 QUIMFCARLVWSRL-QGZVFWFLSA-N 472.472 0.979 50 20 JCGD C[C@](O)(C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)C(F)(F)F 1835737159 QEGCKMQROASTKW-FQEVSTJZSA-N 486.495 0.184 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cc3cc(C)[nH]n3)CC2)CC1 1835786667 AOUHUJQRRNOOIK-OGLMXYFKSA-N 482.589 0.966 50 20 JCGD Cc1ccc(F)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835926529 QLAOWNROOWEMDF-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4cccs4)on3)C2)C1 1835931218 IRSMJMKIWAWWTI-HSZRJFAPSA-N 497.338 0.467 50 20 JCGD CCc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n(C)n1 1835956422 RWCSAECPZQADHV-UHFFFAOYSA-N 482.589 0.480 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836776827 PXAPDWLQXYPKGC-VFNWGFHPSA-N 467.954 0.494 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457005 VRELZPSUILLLHP-OXJNMPFZSA-N 453.927 0.163 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2 1837715803 KIOJFWPPHKEMFD-FQEVSTJZSA-N 459.616 0.819 50 20 JCGD CN1CCCn2nc(C(=O)N3CCOC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)cc2C1 1837715935 SHPMPJRYHLQHJZ-JOCHJYFZSA-N 479.654 0.640 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3Cl)CCO2)C1 1837777385 VLSADBBYWNPYCO-NRFANRHFSA-N 474.905 0.117 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3c(F)cncc3F)CC2)CC1 1837919166 LVJDCHGKRGPAJT-UHFFFAOYSA-N 473.285 0.966 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919216 QZHSERJBHCGIAX-KRWDZBQOSA-N 481.362 0.269 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(C)C)C2)C1 1838528090 DWBHIEYDSMXFDO-HSZRJFAPSA-N 492.529 0.978 50 20 JCGD CC[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)NC(=O)OC(C)(C)C 1839210977 INDCHTSEKOJIBE-XFQAVAEZSA-N 477.986 0.736 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)NCCC#N)C2)C1 1839963841 YEYGRSBQUPEDDB-BEFAXECRSA-N 459.385 0.898 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc[nH]c3[N+](=O)[O-])C2)C1 1839964079 FQOLCTFZLHHZKS-MEDUHNTESA-N 460.285 0.561 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc(F)cc1F)CCO2 1839980007 SLRKJSHAAYLLAT-JOCHJYFZSA-N 468.501 0.337 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H](N)c3cccnc3)C2)C1 1840031724 AHDNJVYXCNSLAC-ZSZQSSIHSA-N 455.353 0.711 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1 1840033283 ZWSDEFDITMBDJN-KPZWWZAWSA-N 452.309 0.811 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccc4sccc4c3=O)C2)C1 1840151139 WCPOUYQJOLHDRE-HRAATJIYSA-N 483.974 0.773 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)OCCO4)C2)C1 1840152724 RBLZRPHPLGEYLI-KKSFZXQISA-N 454.907 0.782 50 20 JCGD COc1c(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc(F)c1F 1840185384 PNWXJMUVQCREIL-QFIPXVFZSA-N 484.500 0.416 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3ccccc31)CCO2 1840258894 QUFQHVXPLQNJGU-CPJSRVTESA-N 479.537 0.485 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1840857167 LIGPNQLLHUZOAT-LVCYWYKZSA-N 473.904 0.864 50 20 JCGD CC(C)(C)OC(=O)N1[C@@H](C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)C[C@H]2C[C@H]21 1844263298 OIRZSKSSFQOWMP-ZTFGCOKTSA-N 484.557 0.900 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc2c(c1)CCCC2)NNC(=O)c1csc(N2CCOCC2)n1 24704414 LSLBWBFVRGMMGR-UHFFFAOYSA-N 493.611 0.988 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1cccc(N2CCNC2=O)c1 117276547 CZHMDEOMHRFVGX-UHFFFAOYSA-N 473.511 0.312 50 20 JCGD COc1cc(OC)cc([C@@H](NC(=O)NNC(=O)CNC(=O)c2ccco2)c2nccn2C)c1 725873419 YQEVUYKPMZBFAQ-GOSISDBHSA-N 456.459 0.880 50 20 JCGD COC(=O)CCCN1CCC(=NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 727057762 HOYGHVBOKRQVAT-UHFFFAOYSA-N 466.560 0.842 50 20 JCGD CN(C)N(C(=O)c1ccc(Cl)c(S(=O)(=O)N2CCOCC2)c1)[C@H]1CCS(=O)(=O)C1 728176305 SGYILEYIVILGHB-AWEZNQCLSA-N 465.981 0.467 50 20 JCGD O=C(Cc1cccnc1)NNC(=O)c1cc(O)nc2ccc(S(=O)(=O)N3CCOCC3)cc12 728852540 FHQKFFSUPYSIEQ-UHFFFAOYSA-N 471.495 0.360 50 20 JCGD CS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)c1nn(Cc2ccccc2)c(=O)c2ccccc12 733038059 CFKGJCJQTYIDDW-SFHVURJKSA-N 469.523 0.630 50 20 JCGD CN(CCCOc1cccc(S(C)(=O)=O)c1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 747101559 WFKICFORUKQJRS-UHFFFAOYSA-N 473.515 0.821 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccon1)c(=O)n2Cc1ccccc1 747149416 IJJAOKLOLOQCIR-UHFFFAOYSA-N 465.470 0.513 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 789076683 GFAVKWCVRFLRJC-LJQANCHMSA-N 491.522 0.861 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CCNS(=O)(=O)c2ccc(OC(F)(F)F)cc2)C[C@H](C)O1 912918649 AIRRVXJIZCZVJS-KBPBESRZSA-N 496.508 0.900 50 20 JCGD CNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)o1 915062761 DJDFHZAVXGQHFQ-UHFFFAOYSA-N 470.529 0.437 50 20 JCGD Cc1ccc(C(=O)NCCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1F 916274582 PTQHSRDLTPDDSN-UHFFFAOYSA-N 493.565 0.521 50 20 JCGD Cc1ccc([C@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)N2CCOCC2)cc1 918099123 KWFNWJNJNMXOIN-FQEVSTJZSA-N 450.503 0.988 50 20 JCGD Cc1ccc(C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)c(O)c1 918337414 LWKJRCRKZDSGEG-UHFFFAOYSA-N 462.528 0.862 50 20 JCGD CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)CCN3C[C@@H](C)O[C@H](C)C3)cc2[N+](=O)[O-])CC1 920279610 JBPWAKIJVGDMSJ-HZPDHXFCSA-N 476.534 0.524 50 20 JCGD O=C(NCC(=O)N1CCCC1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 1261295919 LVZZOXQFYTXBMV-UHFFFAOYSA-N 459.528 0.732 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnc(N)s1)C2 1778090991 BCJGOYKRQPFIFK-BYAFEARCSA-N 473.559 0.987 50 20 JCGD O=C(C1=NO[C@@H](c2ccccc2)C1)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1778174464 ZZZLFFWHKRMFJI-ZJSXRUAMSA-N 463.299 0.328 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2snnc2C2CC2)C1 1778366864 YQTGGMQVGPTHBA-OPAMFIHVSA-N 485.570 0.855 50 20 JCGD COc1ccc2oc(C(=O)N3CC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)cc2c1 1778420325 LDBBITAEUMGCFN-DEOSSOPVSA-N 464.283 0.879 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CSc3ccncc3)CCO2)C1 1779028684 NSDVCXXBDQWSPD-OAQYLSRUSA-N 456.528 0.316 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)no1 1779120702 RGJONRQRBNGLQA-KZULUSFZSA-N 457.325 0.574 50 20 JCGD C[C@@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780770471 OWDHOTNBQVGDFA-RSUWNVLCSA-N 457.362 0.872 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1780852569 QKYYROHAXYCWPG-HSZRJFAPSA-N 453.499 0.841 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781172154 VSBLHKJLYGWMBD-ZJSXRUAMSA-N 497.313 0.730 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334638 YVHAEJUMNSEQHN-LXIYXOSZSA-N 482.347 0.783 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@]3(O)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1784011183 ONIWDNPCWIACLS-RVHYNSKXSA-N 475.970 0.442 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCNC(N)=O)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](F)Cl)CCO2)C1 1785623839 PAJQZUOOPFRQNX-MNVSYLFESA-N 493.964 0.693 50 20 JCGD O=C(CS(=O)(=O)N1CCCC1)NC1(c2ccc(NC(=O)c3cccc(B(O)O)c3)cc2)CCC1 1788143804 NAJPGLLGYCCELN-UHFFFAOYSA-N 485.371 0.540 50 20 JCGD COc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1C 1788609921 SQAZGNLFIDNUPP-XJABCFGWSA-N 481.553 0.838 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nnsc3C3CC3)C[C@@H]21 1788610498 WMDFFKNYGJNLFC-RCBQFDQVSA-N 471.543 0.321 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(Cl)nc1Cl 1788828652 CMJYKYHJQHFKQV-JQFCIGGWSA-N 478.141 0.975 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CNC(=O)C3)[C@H]2C1 1790855436 NQXHYBRZKWGSJP-QRJUGERDSA-N 472.970 0.234 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@]3(NC(=O)OC(C)(C)C)CCOC3)C[C@@H]21 1791253814 KAMMOONAKWJUQP-YSVRDODPSA-N 489.997 0.904 50 20 JCGD COc1cc(F)ccc1CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1792304891 QBUHPRFHOAGNLL-XJABCFGWSA-N 470.306 0.350 50 20 JCGD CC(C)(C)c1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cn1 1792392426 BXSWPOMHMHRBBB-CWPLJXCYSA-N 466.542 0.895 50 20 JCGD CN(C)C(=O)NCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1792630318 BRKUKEHPVFZELA-SFNKJDCFSA-N 481.391 0.853 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCCN1C(=O)c2ccccc2C1=O 1793869372 VJVNDZBBANRJNN-BAAGSCJXSA-N 477.945 0.906 50 20 JCGD O=C(CC[C@@H]1CNc2ccccc2C1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1795648133 GTAGWKDRDPIIHJ-OTQUPPRASA-N 477.370 0.634 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cn1)C2)c1ccc(B(O)O)cc1 1795734377 NDSFTSILGFQIMN-ZSBFGKGUSA-N 474.120 0.041 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(Cl)c(Cl)c1)C2)c1cccc(B(O)O)c1 1795740200 DBRVLPSTAIROAG-XOIINTDNSA-N 464.114 0.585 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c1 1796189412 KQYSXICSDWJZMA-BJWYYQGGSA-N 474.319 0.475 50 20 JCGD CSCC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1796294417 MITQWKFIWPYDBF-NPJQDHAYSA-N 480.027 0.822 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc([N+](=O)[O-])c1)C2 1796440246 OAFYLTLOAXALKU-QCIWSRGXSA-N 482.497 0.861 50 20 JCGD Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)ccc1C(F)(F)F 1796710099 IEEYDKDOUPZXNX-ZSBFGKGUSA-N 465.237 0.241 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1NC(=O)C2=O 1797539840 BWAUZRBTVXFKGG-DYNIEEOBSA-N 450.289 0.808 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(Cl)cncc1Cl)C2 1797748094 HYFJKQOOGDPOFV-YQYWCBKUSA-N 479.324 0.904 50 20 JCGD C[C@@H]1C[C@@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1799164348 NNGAXYIZTUHNTB-AOBCARNWSA-N 457.575 0.968 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2 1800761730 GBBNUCVAGIMYJH-CWFFCZEZSA-N 480.403 0.995 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C2 1800764010 SIEZLSRHERWAPR-DGMCESFYSA-N 491.383 0.128 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)Cc1ccccc1NC3=O)C2 1800978797 KELLBPXFEUHAKI-UIVXKWKOSA-N 487.944 0.954 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1801906088 XVIOJJQCSIEZCH-VPTLXERWSA-N 485.733 0.495 50 20 JCGD CN(CCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)C(=O)OC(C)(C)C 1802133371 ZYBIZKLPPFRKDA-RMFSNUHRSA-N 489.378 0.217 50 20 JCGD CC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCN(C(=O)OC(C)(C)C)CC1=O 1802187634 DUNGYHLUBGIQEJ-YYAJDYIMSA-N 486.997 0.673 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCN1C(=O)c3ccccc3C1=O)C2 1802333050 LHNAPDRYLKADNC-BJWYYQGGSA-N 469.542 0.684 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CN2CCSCC2)[C@H]1c1cccnc1 1802448027 GPASVLJVKATDFM-XMSQKQJNSA-N 462.620 0.509 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n(C)n1 1804924952 PEIGEUOEYHOWSB-UTKZUKDTSA-N 463.303 0.137 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)cc1 1807362150 ZTUUMUMLCWJLBG-HUVFLSCGSA-N 489.337 0.823 50 20 JCGD CCn1nc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1C 1807374422 HFCXEJNYXNCQQJ-UGKGYDQZSA-N 461.331 0.920 50 20 JCGD Cc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc(O)n1 1808334547 XZYAZSGRIWFFEM-XMSQKQJNSA-N 460.299 0.804 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)/C=C\C(=O)NC2CC2)[C@H]1c1cccnc1 1810134396 PCZUNQMYEFLBFK-GLXXVIDCSA-N 456.547 0.295 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1 1810293533 FSYYKKBURZDEOQ-LAUBAEHRSA-N 483.598 0.449 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C(=O)Nc1cccnc1 1810462685 LOOGMWXMTVRKST-GHTZIAJQSA-N 473.298 0.115 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)CCNC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1813071883 ZGIHRHAPCJXJEN-WZONZLPQSA-N 483.573 0.609 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@@H]1c1cccnc1 1813072672 IOTUDFPBDPKLAP-SUMWQHHRSA-N 482.467 0.911 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C1CCC(O)CC1 1813194313 PKRFXFCDTBLYPG-ZIVFUPILSA-N 451.332 0.632 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CSc2ncccn2)[nH]n1)c1ccc(B(O)O)cc1 1817471483 PHUSIWWDDWGSFO-KRWDZBQOSA-N 466.332 0.978 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCc3nc[nH]c3C2)[nH]n1)c1ccc(B(O)O)cc1 1817475658 QLTGOXOOJTWRPK-MGPUTAFESA-N 462.319 0.924 50 20 JCGD Cc1cc2nnc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)CCC(=O)NN(C)C)CC4)c(C)n2n1 1818251108 NQLUFFRSWOWBNX-CYBMUJFWSA-N 485.574 0.796 50 20 JCGD CNC(=S)NCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1819409308 ZXWLIWYDFDLTMW-CQSZACIVSA-N 452.585 0.259 50 20 JCGD COC(=O)C1(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)CC1 1821999945 KRLULMANSMEIRR-HNNXBMFYSA-N 455.475 0.667 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn3cccnc3n1)CC2 1826086027 KZYLSVBQZPJNRM-GFCCVEGCSA-N 456.532 0.785 50 20 JCGD O=C(c1cn2ncccc2n1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052249 QWYCDEQDKQBJMB-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830735800 NDCFSCXJUNVTOF-CVDCTZTESA-N 497.976 0.148 50 20 JCGD CN(C)[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1Cl 1830736045 QEUGNMJSTVYUHU-LQWHRVPQSA-N 474.385 0.999 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1C)CCO2 1832472880 UPPXKOMEZZLTNN-JTAQYXEDSA-N 465.978 0.753 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(=O)O)ncn3)CCO2)C1 1833489507 XWRMKJPMXJCRQI-KZULUSFZSA-N 471.308 0.276 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)COc3cccnc3)CC2)CC1 1835737198 VWPQLEJRDSMGHO-UHFFFAOYSA-N 481.557 0.344 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(Cl)cc3)C2)C1 1835930189 AROFUXABSJGTBY-TZBSWOFLSA-N 498.772 0.894 50 20 JCGD Cc1nc(F)ccc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836029276 CLCRMVMJJXRFOZ-UHFFFAOYSA-N 468.338 0.708 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836679440 BHRZSXKRISZLDB-SANMLTNESA-N 494.353 0.004 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)n1nc(C)ccc1=O)CCO2 1837659279 YDQWTXWWNPTUNO-IIBYNOLFSA-N 499.406 0.917 50 20 JCGD CCOc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nn1 1837919271 WFEJDFFEVYOPGS-UHFFFAOYSA-N 482.346 0.481 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838399060 TUZPXYHRWPFSLI-KRWDZBQOSA-N 475.594 0.649 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nccc(OC)c3OC)CCO2)C1 1838841885 UTJQGRYCNPMSSL-VLIAUNLRSA-N 457.911 0.423 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccccc1C(F)(F)F)CCO2 1838895454 ABFWBGADIMOETD-QFIPXVFZSA-N 492.259 0.769 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](CCN)NC(=O)OC(C)(C)C)C2)C1 1839144324 VJFFTOFQBKDVLU-GCKMJXCFSA-N 477.002 0.702 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)no1 1839154037 ZKUKNCIZAOYLSO-RTBURBONSA-N 477.345 0.406 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)n1 1839200129 FZHNYALKTQYFDY-HNAYVOBHSA-N 489.342 0.434 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(O)ccc1O)CCO2 1839447040 HDPFQWBUINXFLI-XTVKVDEJSA-N 485.497 0.302 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)COc1ccccc1F)CCO2 1839970282 NXSIBFGBSBAZPG-JOCHJYFZSA-N 466.510 0.034 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ncccn3)C2)C1 1840031958 HUUQHSIJQWDEFZ-DYVFJYSZSA-N 459.366 0.809 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)CC[C@H]3CCOC3)CCO2)C1 1840587513 XDAGYXKNRRVIPW-KTDDNLLNSA-N 475.546 0.394 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC2(CCCN2C(=O)CS(=O)(=O)N2CCCC2)C1 1843413414 YOTQTZPRYYBNRG-HNNXBMFYSA-N 493.026 0.748 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@]1(C)CCN(C(=O)OC(C)(C)C)C[C@H]1O)C2 1846385128 VDCVELVBEXILIB-UZUQRXQVSA-N 495.621 0.571 50 20 JCGD C=C[C@@H]1C[C@]1(NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1847080859 JFRHUDBKEYTWPP-MZNJEOGPSA-N 469.347 0.653 50 20 JCGD C[C@H](CBr)C(=O)N1CC2(CCCN2C(=O)[C@H](CC(N)=O)NC(=O)OC(C)(C)C)C1 1847090030 IHAXKMQDNWPVID-OLZOCXBDSA-N 475.384 0.990 50 20 JCGD C=CCn1c(=O)c2ccccc2n2c(SCC(=O)NNC(=O)CNC(=O)c3ccco3)nnc12 725739255 AYCUFRCHIONTGN-UHFFFAOYSA-N 481.494 0.493 50 20 JCGD Cc1c(NC(=O)CSCC(=O)NNC(=O)c2cccn2C)c(=O)n(-c2ccccc2)n1C 726540302 DINXCYLAIAJNAV-UHFFFAOYSA-N 456.528 0.956 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=S)N[C@@H](C)C1CC1)c(=O)n2Cc1ccccc1 727270375 HNZWHNWYZAUHAE-HNNXBMFYSA-N 499.597 0.348 50 20 JCGD O=C(NCC(F)(F)F)c1cccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728853829 CLIUIPXPRGMGJQ-UHFFFAOYSA-N 486.476 0.995 50 20 JCGD COC(=O)Cc1cc(=O)n(-c2ccc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)cc2)[nH]1 728890594 XBOZDRJRDRKYDH-UHFFFAOYSA-N 479.497 0.349 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)COc1ccccc1O 730778820 WLBLMZKUVZYBAR-UHFFFAOYSA-N 465.484 0.448 50 20 JCGD CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)CNC(=O)c3ccco3)cc2[N+](=O)[O-])CC1 751204995 UQJBJEPESPKFJN-UHFFFAOYSA-N 458.431 0.047 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)C2CCN(S(=O)(=O)c3c(C)noc3C)CC2)n1 763077151 KZIIEEBOBPOUCN-UHFFFAOYSA-N 499.571 0.390 50 20 JCGD O=C(COC(=O)COc1cccc(N2CCCC2=O)c1)NNC(=O)[C@@H]1COc2ccccc2O1 792322498 OSFQNIPCXJHJMI-IBGZPJMESA-N 469.450 0.723 50 20 JCGD O=C1CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3cc(-c4ccccc4)on3)c2)CCN1 910782375 PEDUIUHSEZEGPM-UHFFFAOYSA-N 469.479 0.537 50 20 JCGD Cc1nnnn1[C@@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 916136625 UIXOSYMKGRNSJI-INIZCTEOSA-N 460.495 0.659 50 20 JCGD C[C@H](CN1CCOCC1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 916469561 AQLNMDQVQPSMGH-QGZVFWFLSA-N 475.571 0.830 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccc(F)cc2)cc1 916649154 KEWHKGPBXPYEGY-UHFFFAOYSA-N 454.480 0.660 50 20 JCGD O=C(COC(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O)NNC(=O)c1ccccc1 919649870 SPECAIUMTRXXSE-MRXNPFEDSA-N 487.490 0.628 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C2)C1 1778169926 GROZCRIQUIDBQW-RDPSFJRHSA-N 478.509 0.646 50 20 JCGD C[C@@H]1CCc2c(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)n[nH]c21 1778600334 DNECQCIZUYXCCJ-ZCLJVBCSSA-N 466.347 0.581 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1778784904 AFIDGBYZHRHVLY-LAUBAEHRSA-N 494.457 0.028 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c2c1 1779032381 PECATMMWHDYRAP-XMMPIXPASA-N 478.509 0.932 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@](C)(Cl)CCl)CCO2 1779072820 MVLLTWADRYTYGR-BMGDILEWSA-N 453.319 0.547 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779375018 KIHXZIFDDZQLQG-ZDWFVDTJSA-N 469.546 0.345 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CC23CCCN2CCC3)C1 1780664721 HCIYGDKOXVVYNP-AUSIDOKSSA-N 463.623 0.892 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1cccc(Cl)c1 1780930210 OLODBZQQHKCYFL-ZJSXRUAMSA-N 499.760 0.341 50 20 JCGD CC(C)N[C@@H](C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CCC(=O)NN(C)C)C1)C(C)C 1782210920 ZPBTWPDDPABBPL-JMUQELJHSA-N 453.628 0.896 50 20 JCGD Cc1cn(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCBr)C3)c(=O)nc1O 1783116228 KOCSMCOJHKHHHF-AUUYWEPGSA-N 471.352 0.556 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@H](C(=O)N3CC[C@@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)[C@H]2C1 1783475711 XQFDAPBFKMFMPV-LIXITEDJSA-N 487.981 0.298 50 20 JCGD O=C(COCCOCCOCc1ccccc1)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1783684393 ZFBBZNDOLCIAQS-OFNKIYASSA-N 484.977 0.666 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C)CCO2 1783874345 DBHPLLUDLLALTE-QYWGDWMGSA-N 475.970 0.706 50 20 JCGD CC(C)(C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1)c1ccccn1 1786986697 ZSTHDXPNSGWYAD-IHPCNDPISA-N 451.332 0.333 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1)C(C)C 1787508817 VUJKCQTXUFDEGU-QDGGXDBVSA-N 475.546 0.688 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610292 WAZNUPNMNVQKSU-TZMKYKESSA-N 458.346 0.515 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(-c4ccncc4)[nH]n3)[C@H]2C1 1788925291 OVHHRBXJOFWGCP-XERREHJYSA-N 490.524 0.377 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1789231923 LUGCSZJWCVMMGX-BUKVSMQUSA-N 496.329 0.248 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)Cc3ccccc3)[C@H]2C1 1790954821 JAKSFMRTWMBOLD-LDKGODNJSA-N 481.553 0.704 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(O)cc2)CC1 1793025547 AWALHEMDRCOJNS-YVWYUNDQSA-N 465.510 0.326 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(-c2cccc(F)c2)n1 1794288974 KYFSPFNAFBFXBJ-RMHZUWNSSA-N 451.886 0.863 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CS(=O)(=O)N1CCCC1 1796886627 LPTOGWZHQDPWAK-MOINTJSASA-N 478.575 0.184 50 20 JCGD Cn1ncc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)cccc21 1797750526 DQWDKMDISARKDJ-VTEUUUEMSA-N 463.498 0.089 50 20 JCGD Cc1n[nH]c(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1798016868 XSWMKAZEHNODED-HATOLVCRSA-N 483.573 0.576 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1c(F)cncc1F 1798239838 OJJRLIAQHYIGSQ-CGKUBJGISA-N 460.441 0.697 50 20 JCGD CC(=O)C(C)(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799094884 GSZPYSSAEBRMRD-CEQLMSFQSA-N 473.574 0.537 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1n[nH]cc1[N+](=O)[O-])C2)NC(=O)NCc1ccccc1 1799869297 HBCIGEYHVAQEMI-BJWYYQGGSA-N 484.517 0.916 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(Cl)Cl 1801019239 JFQWFXYDLRSVBW-NOHGZBONSA-N 467.350 0.148 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc(O)n3c2CCCC3)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807359736 DFHUNVYYMWQBEN-GCJKJVERSA-N 489.341 0.633 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccn(C(F)F)n2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360789 LXVXITJSEFQBGD-APWZRJJASA-N 469.257 0.986 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCc2cncnc2)[C@H]1c1cccnc1 1807502237 CUMDCBQQKKOLEK-PGRDOPGGSA-N 474.525 0.823 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnsn2)[C@H]1c1cccnc1 1810297370 BTERLRMXNBRBKA-DYVFJYSZSA-N 452.500 0.565 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1 1812299997 SOFDKKSTKSPQGL-IERDGZPVSA-N 485.508 0.985 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@@H](CNC(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812714015 YXUIKCZXOBDSOE-AYBZRNKSSA-N 471.396 0.405 50 20 JCGD CCCNC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813068255 KGOPWOPDZHXHOB-WZONZLPQSA-N 460.579 0.767 50 20 JCGD C[C@@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1 1814779996 CXXBIISEVNTEDK-CABZTGNLSA-N 478.311 0.873 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347628 HPPAYWAXVUZUOP-AEFFLSMTSA-N 456.377 0.922 50 20 JCGD Cc1cc(CC(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nn1C 1815350388 UGUHCNFRRNKQPS-OAHLLOKOSA-N 453.333 0.333 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472423 SKLUKKNJNQUSGZ-KSSFIOAISA-N 463.307 0.686 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817476333 QHWZDVMFRVUTMS-KBXCAEBGSA-N 455.324 0.700 50 20 JCGD C[Si](C)(C)OCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2 1820162439 IGUOYDLZJLPDEG-VIFPVBQESA-N 462.568 0.346 50 20 JCGD CN(CC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H]2CNC(=O)O2)[nH]n1)NC(=O)NCc1ccccc1 1820710536 VXAKUBQFVLVYKW-MSOLQXFVSA-N 498.544 0.856 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1 1826086506 XAUOCQPOVARYEB-ZDUSSCGKSA-N 474.543 0.924 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCCC[C@@H]1C1CCN(C(=O)C(F)(F)C(F)(F)C(=O)O)CC1 1827056414 YLFRKJYFRHTBFB-MRXNPFEDSA-N 488.243 0.955 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CCOC[C@@]4(CN(C(=O)[C@@H](O)CCl)CCO4)C3)CC2=O)c1 1830719806 LEVHAGAZCMICQL-ICPLQIHGSA-N 495.960 0.104 50 20 JCGD CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830733081 DWJZHWCPPDXBGY-FSBGXSNOSA-N 492.013 0.982 50 20 JCGD COC(=O)N(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)Cc1ccccc1 1830739046 XBWJWWHFPWLKRE-PGRDOPGGSA-N 483.949 0.311 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)n[nH]3)C2)C1 1832549612 VHFOVDFPGLGWKX-XOBRGWDASA-N 487.941 0.317 50 20 JCGD C[C@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CCN3C(=O)C=CC3=O)CC2)CC1 1833264541 DSQXMRGAVOGRCE-OAHLLOKOSA-N 483.407 0.904 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4cn[nH]c4cn3)CC2)CC1)c1ccc(B(O)O)cc1 1834798570 LVZXLWBEKYDWHH-UHFFFAOYSA-N 476.346 0.137 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCN(C)CC3)CCO2)C1 1835400008 HPTCURFWHHQRIY-FXAWDEMLSA-N 475.428 0.111 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H](N)c3cccnc3)CCO2)C1 1835823784 AMJWPEFJTMCVBG-OXFYSEKESA-N 469.380 0.959 50 20 JCGD Cc1oc(C(C)(C)C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835929143 BVRHBCWLKOCMMZ-RUZDIDTESA-N 484.358 0.949 50 20 JCGD Cc1nnc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)s1 1836081768 XOHVFYJXCYUTEG-UKRRQHHQSA-N 451.318 0.536 50 20 JCGD CCC(=O)N[C@H](C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836818262 PVJZDRVNCHPMEU-OAHLLOKOSA-N 474.562 0.212 50 20 JCGD Cc1nn(C)cc1C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1836966145 ZNTMELKTJFFVNA-UHFFFAOYSA-N 454.336 0.334 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1 1836972577 DICKCDGCMBBDTA-LIRRHRJNSA-N 471.352 0.909 50 20 JCGD Cc1ccccc1NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837457547 IXELXQDQYSNAEW-XMMPIXPASA-N 482.541 0.176 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)ccc(F)c1F 1837461378 VGONDFFFJBJBJO-QHCPKHFHSA-N 489.479 0.656 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3[nH]nc4ncccc34)CC2)CC1 1837920406 VAULHDXGJBESSK-UHFFFAOYSA-N 477.330 0.564 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@@H]3[C@H]4C=CS[C@H]43)CC2)CC1 1837921545 LHEGDFJFNHIFSO-NJDAHSKKSA-N 456.373 0.854 50 20 JCGD O=C1CC(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)=Cc2ccccc2N1 1838443268 GXEZIGXLWZICTJ-PGRDOPGGSA-N 463.918 0.468 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1c[nH]c(=O)cn1)CCO2 1838641667 RZZSHYPKVSOEDI-YLLUOSTHSA-N 485.447 0.725 50 20 JCGD CNc1nsnc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839197228 NHTAHPQANSIKRH-QMTHXVAHSA-N 452.306 0.340 50 20 JCGD CC(=O)NCCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1839886194 NJRQPIPYTWJWNH-SCVJVIIRSA-N 476.480 0.854 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1839965262 SAIRIYOVBSROIK-DNVCBOLYSA-N 466.336 0.973 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1840077711 HHGYCRJLBQCDMS-VQTJNVASSA-N 485.405 0.749 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(cnn4C)c3)C2)C1 1840152472 JKNPWDKOHPLHSN-LAUBAEHRSA-N 450.923 0.897 50 20 JCGD C=CCOC(=O)NC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841354382 WAZRTSXXHZALQL-GJZGRUSLSA-N 488.969 0.595 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(=N)N)C(=O)N1CC2(CCCN2C(=O)[C@@H](F)Cl)C1 1843363370 YRWBZEXRGJQSSX-CHWSQXEVSA-N 462.954 0.881 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c([N+](=O)[O-])c1 1845535996 MHIXLWVIKVXJMO-UHFFFAOYSA-N 467.243 0.192 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CC2(CCCN2C(=O)[C@H](Br)Cc2ccccc2)C1 1845941172 IVSNTDKRMDTTFA-HZPDHXFCSA-N 451.365 0.789 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)CCC(=O)NN(C)C)CC2=O)c1 1847218724 AFTHGNNKKCWUFP-UXPWSPDFSA-N 471.558 0.623 50 20 JCGD CCn1c(=O)nc(O)c2c(C(=O)NNC(=O)CNC(=O)c3cccs3)cc(C3CC3)nc21 725742108 ZYSLNSZENJAQLR-UHFFFAOYSA-N 456.484 0.647 50 20 JCGD C=CCNS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)Cc2nc(C)cs2)ccc1F 728722278 CMLSAKMODTYVIP-UHFFFAOYSA-N 470.504 0.602 50 20 JCGD O=C(O)COc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1F 728854030 JYUIICBYCLLPHZ-UHFFFAOYSA-N 453.452 0.305 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)NCc2cccs2)cc1)N[C@@H]1CCS(=O)(=O)C1 743884753 JYZUKLGEVWGYNJ-CYBMUJFWSA-N 472.570 0.358 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)[C@@H]1CCCCN1S(=O)(=O)c1cccs1 751206076 BAAKVGPHYQODKG-LBPRGKRZSA-N 456.571 0.930 50 20 JCGD COCCc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 914845611 CXNLDFMHBUURLX-UHFFFAOYSA-N 483.568 0.520 50 20 JCGD COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc3c(c2)OCO3)cc1 916034342 DKIIETKADSVHIU-UHFFFAOYSA-N 479.511 0.774 50 20 JCGD O=C(CN1CCCS1(=O)=O)NNC(=O)c1cccc(S(=O)(=O)Nc2ccccc2Cl)c1 916096339 FZLLTZHBNPAYTB-UHFFFAOYSA-N 486.959 0.937 50 20 JCGD CC(C)[C@H](CNC(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1)N1CCN(C)CC1 916258383 VSESHIKUEHGDDA-QFIPXVFZSA-N 459.639 0.801 50 20 JCGD N#Cc1ccccc1OCC(=O)NNC(=O)NCCNS(=O)(=O)c1cccc(Cl)c1 916295162 LFPIBKPMWTZMSF-UHFFFAOYSA-N 451.892 0.899 50 20 JCGD Cc1cc(/C=C(/C#N)C(=O)OCC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)c(C)n1C[C@@H]1CCCO1 916437948 RERCKLJDJFMPNC-XBHWDRPYSA-N 492.554 0.747 50 20 JCGD CC(C)(C)n1cc(C(=O)C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cn1 916719717 GRCBZIWVFORRBB-UHFFFAOYSA-N 491.570 0.622 50 20 JCGD CCc1noc2ncc(C(=O)NNC(=O)c3cccc(S(=O)(=O)N4CCOCC4)c3)cc12 918397343 GKTFVDPTYSCKRV-UHFFFAOYSA-N 459.484 0.881 50 20 JCGD COc1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)Nc1ccc(C)cc1 919885912 POXSWPGTZFZKIG-INIZCTEOSA-N 496.567 0.936 50 20 JCGD CCO[C@@H](CC)C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 919979468 UJLJLKSQKJRCIH-INIZCTEOSA-N 456.503 0.390 50 20 JCGD Cc1cc(C)n2ncc(C(=O)NNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)c2n1 1317825436 CAIQFYMDZBTHSR-UHFFFAOYSA-N 486.554 0.761 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CC(=O)N(c4ccc(C#N)cc4)C3)cc2)CC1 1318258694 CHDMCEUVJPBLSD-GOSISDBHSA-N 482.566 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)CCc3ccc(F)cc3)CCO2)C1 1779033950 FZPVKYCOMDJJBL-HSZRJFAPSA-N 455.490 0.901 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1780132106 SQAMUWQYPFZHGX-HSZRJFAPSA-N 472.278 0.280 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C1=COCCC1)CCO2)NC(=O)NCc1ccccc1 1780967876 AJKQUJQVYLIPPU-DEOSSOPVSA-N 471.558 0.857 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)C(F)(F)F)C2 1782002996 ZSKXFUPYUSQKRL-FIXISWKDSA-N 458.275 0.962 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2 1782166246 CBDQPTTVIAJRTE-VNXYZTLMSA-N 496.004 0.934 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1782781345 VJLMHGWSRRFGJZ-GCJKJVERSA-N 467.950 0.521 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)C1 1783348969 OYLWVXMEWQODKJ-QNFHRHJVSA-N 489.997 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(F)nc3F)[C@H]2C1 1783383615 BGNLTKFMCVSIKF-UVBJJODRSA-N 460.441 0.265 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(Cl)cnc1O 1783399212 BGJWLRWXGGFTGX-KKXDTOCCSA-N 459.695 0.028 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C[C@@H]21 1783969380 LSFPGXYRRQUDOR-JURCDPSOSA-N 458.313 0.802 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C[C@@H]21)[C@H](O)CCl 1784096122 SIEPBKNTFJRJFJ-OWLYRPNTSA-N 461.902 0.309 50 20 JCGD Cc1ccncc1CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1785317311 ZPMMFPAAPPSCLH-YYWHXJBOSA-N 466.542 0.615 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3OCCc4ccccc43)C[C@@H]21 1788607854 PAQIQJDNRGCPIU-ZMVGRULKSA-N 493.564 0.983 50 20 JCGD C=CCO[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724656 IKNDSBOPIRSBPQ-QESAQDPVSA-N 487.601 0.903 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCN3C(C)C)[C@H]2C1 1791809245 PHDBBOVMOTZIND-LNQUCMTBSA-N 472.590 0.973 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1792127270 OOPWIIFIHYXPLR-LEAZDLGRSA-N 489.378 0.263 50 20 JCGD CCc1nn(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)c1Cl 1794424877 DAYZVYLMROBAME-IVWMJMPLSA-N 454.959 0.212 50 20 JCGD N#Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(C(F)(F)F)n1 1795734810 SPLSEORXPZCIAO-ZSBFGKGUSA-N 488.231 0.169 50 20 JCGD COc1cccc(/C=C/C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1 1795736855 OBXUZODFLWSEIW-OOYNOFMQSA-N 450.300 0.292 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)c1cc(Cl)cc2nn[nH]c12 1796191933 RHSHSNMABGTHHQ-MUJYYYPQSA-N 453.695 0.857 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3CN1C)C2 1796439629 SXLLDRUDVNULDP-GMFHNFPSSA-N 492.580 0.767 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3cccnn3n1)C2 1796441501 LRESEJLKBGKORD-DHMDNZFNSA-N 464.486 0.067 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807362135 DUXZZOYQESOPBM-XTQVGHSUSA-N 473.342 0.977 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)Cn2nnc3ccccc32)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807366986 WPYIPKKJLVRAAG-DVECYGJZSA-N 484.325 0.526 50 20 JCGD O=C(CCC(=O)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1)N1CCCC1 1809975210 XRTSGIDTJYIACA-UHFFFAOYSA-N 455.364 0.614 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnsn2)[C@@H]1c1cccnc1 1810297367 BTERLRMXNBRBKA-CXAGYDPISA-N 452.500 0.565 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)no2)[C@H]1c1cccnc1 1810303540 UVPCBZONGNSBOO-UGSOOPFHSA-N 451.443 0.407 50 20 JCGD COCc1c[nH]c(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1811350727 XBASARKOVZAPFN-DENIHFKCSA-N 462.315 0.869 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CN2CCCCC2=O)[C@@H]1c1cccnc1 1812976371 DLDXXXJEKJQSKX-MBSDFSHPSA-N 458.563 0.473 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@H](O)CCl)n[nH]1 1814863684 AALGYFKASKNGAS-MJBXVCDLSA-N 459.931 0.887 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)Cc2ccccc2)[nH]n1)c1ccc(B(O)O)cc1 1817474983 KQBQZABIYSPQBC-NHCUHLMSSA-N 462.315 0.999 50 20 JCGD CN1CCCC[C@H]1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1822592625 ACKQFYAFWKKVFN-LRDDRELGSA-N 457.560 0.852 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC2)N1CCN(C)CC1 1822696735 FYKGLLPDCFWYCL-CABCVRRESA-N 465.624 0.064 50 20 JCGD CC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1823790108 VYGIOFGTRGCISB-WOJBJXKFSA-N 458.563 0.833 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@](C)(Cl)CCl)CC2)C(=O)C(=O)O 1824673181 BFLSDMKBKTUSTK-BCTVWOGZSA-N 451.332 0.834 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826825879 OSNLIMUSBHSCBP-CZUORRHYSA-N 453.333 0.582 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1830352964 WZWAQEVNCFEYMZ-IVZHQMGZSA-N 488.368 0.426 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1830544269 SVCWSVSEPWSMHN-HRAATJIYSA-N 498.422 0.820 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cnn3c2OCCC3)CC1 1830879138 KGXRPLNSTLIFLF-NRFANRHFSA-N 466.347 0.893 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(O)C(F)(F)F)CCO2 1832148665 CAUNFYHXLPNQGT-KCPJHIHWSA-N 461.275 0.787 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3nnc4ccccc43)CCO2)C1 1832209185 OFBYRXUIIYFUMV-QRWLVFNGSA-N 451.911 0.142 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)CNC(=O)N(C)C)CC2)CC1 1833261729 WSRMEGUQNYYAGT-AWEZNQCLSA-N 460.417 0.860 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCC(N3CCC(NC(=O)[C@H](O)CCl)CC3)CC2)cc1 1833306730 ZZLNQWGJXVOHCE-WOJBJXKFSA-N 453.967 0.900 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CN3C(=O)CNC3=O)CC2)CC1 1833676103 RJVMRFHJIUTTAK-ZDUSSCGKSA-N 472.384 0.141 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCC=CO3)CC2)CC1 1835738018 QFWONABAVBDTFA-HXUWFJFHSA-N 456.547 0.563 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1 1835927874 ZEZMTFNPUBXVJC-OAQYLSRUSA-N 466.290 0.262 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C(F)(F)F)o1 1835936922 JYLLGFFSQXRNIV-FQEVSTJZSA-N 497.235 0.065 50 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CC(C)(C)OC(=O)N1[C@H]2CC[C@@H](C2)[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014795 CJAPGDSWMBWNOM-FFZOFVMBSA-N 483.374 0.971 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CC4(CCCN4C(=O)[C@H](F)Br)C3)n2)CCCN1 1845216869 QFYNXCBHPHBBSL-INIZCTEOSA-N 468.327 0.915 50 20 JCGD N#Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2)cc1 15427059 NTKBZFGRUJSMSD-HXUWFJFHSA-N 470.507 0.946 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CC1 22138577 TYIBTYMJLSKITB-UHFFFAOYSA-N 494.595 0.598 50 20 JCGD O=C(COC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O)NNC(=O)[C@H]1COc2ccccc2O1 730620420 IJXJGEMEGDYLSA-FOIQADDNSA-N 497.460 0.341 50 20 JCGD O=C(CNC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccccc1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 745868047 VWAJNHCESIGYJU-OXJNMPFZSA-N 499.549 0.017 50 20 JCGD Cc1ccc(OCC(=O)N2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 748807696 RTDLRAMZZUWJHG-UHFFFAOYSA-N 455.471 0.887 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNS(=O)(=O)c2c(C)c(C)cc(C)c2C)n1 759903347 LVXNLMJWDIHXDX-UHFFFAOYSA-N 482.584 0.897 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc3c(=O)n4c(nc3c2)CCC4)cc1OC 849182490 GIIDPGBYLHEETL-UHFFFAOYSA-N 466.450 0.978 50 20 JCGD COc1ccc(CCNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1OC 890476605 QVHXDUXCUXIQOU-UHFFFAOYSA-N 478.575 0.904 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=S)Nc1ccc(S(=O)(=O)N2CCOCC2)cc1 913444439 UPKGSQPUVGHLME-UHFFFAOYSA-N 467.529 0.048 50 20 JCGD CN(C)c1cccc(C(=O)NNC(=O)CSCC(=O)NNC(=O)c2cccc(N(C)C)c2)c1 915808268 AMPBSPVFRXOIOF-UHFFFAOYSA-N 472.571 0.774 50 20 JCGD C[C@H](NS(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)c1)c1ccccc1 919885408 OYSXEYOJAHRSIM-WMLDXEAASA-N 480.568 0.857 50 20 JCGD Cn1cc(C=NNC(=O)C(=O)NN=Cc2cn(C)nc2-c2ccncc2)c(-c2ccncc2)n1 920358180 MHTIXYUCAPLJKD-UHFFFAOYSA-N 456.470 0.878 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H]3Cc4ccccc4O3)C2)C1 1778245208 JSASPKRIBWNGPP-AUSIDOKSSA-N 451.483 0.132 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)CC(=O)N4)C2)C1 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NC[C@H](N)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Br)Cc2ccccc2)C1 1781684199 GJQRJHGJGNZPLB-LXGFNABISA-N 467.408 0.793 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H](O)Cc1ccccc1 1781894856 PMUXJUBIVZPBMB-SGIRGMQISA-N 466.343 0.098 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ncn(C)c1C(F)(F)F)C2 1782211914 FVEZDUOMXLSSJI-JLTOFOAXSA-N 488.511 0.939 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)CCO2)C1 1783531957 GJRJWSSPQPHZIZ-YCRPNKLZSA-N 494.390 0.635 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](C)NS(=O)(=O)c1ccc(C)cc1)CCO2 1783870883 IFUUZGIVCMZNND-DJPFJPOOSA-N 488.006 0.746 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1 1783880835 GBRQATRDVMKUOM-QRWLVFNGSA-N 465.894 0.376 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(C(F)(F)F)n1)CCO2 1783935095 NTVKUUGHTOMZHC-LJQANCHMSA-N 457.453 0.917 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)cc1NC(C)=O 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498.584 0.501 50 20 JCGD Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)sc1C 1788609914 CJPSWRZEHUFQBT-JQFCIGGWSA-N 458.544 0.666 50 20 JCGD O=C1CSc2ncc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)[C@H](O)CCl)C[C@@H]43)cc2N1 1790452951 OBJHYDPFDQUSDE-FATJJJSSSA-N 454.936 0.319 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2C1 1791290883 QRABRUFJLNXUFY-FHWLQOOXSA-N 473.574 0.595 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl)C1CC1 1792975297 QFNRESDIMLNUNI-RIUYPTKQSA-N 459.971 0.869 50 20 JCGD COc1ccccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1793150696 XCGRKHGYDQIPKY-BBIADKPPSA-N 452.316 0.211 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cc(C)cn1 1795886743 KZKZEELMUZDGDY-VPTLXERWSA-N 471.470 0.928 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@@H]1CC(=O)N(Cc2ccccc2)C1 1796188040 WZVXRXYHXJVCTF-XBYSBRQOSA-N 475.354 0.667 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)Nc1cnccn1)C2 1796441861 AWJCASUREXDCPE-NGHKGNDKSA-N 468.518 0.001 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCCCC1=O)C2 1798523098 RQGBQJWZXRQTGD-MFKICJERSA-N 488.497 0.736 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2c(c1)NC(=O)[C@H](C)O2 1798584144 DJVJFLWPPXHWIO-HMZURLEKSA-N 451.907 0.863 50 20 JCGD O=C(CN1C(=O)C2(CCOCC2)c2ccccc21)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1799073406 GNBGZRZXVAWAAP-MNDZRTMASA-N 491.972 0.271 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(C#N)CCC1)C2)NC(=O)NCc1ccccc1 1799098261 GDGQHBZGQVDCFF-CEQLMSFQSA-N 468.558 0.616 50 20 JCGD CS(=O)(=O)Nc1ccc(Cl)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1799780465 YGQWEVPHTFSREE-OXUXUCFPSA-N 480.370 0.514 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1ccncc1=O)C2)NC(=O)NCc1ccccc1 1799869161 JLVPINVKEPYNND-ACDBMABISA-N 481.557 0.228 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1ccco1)C2)NC(=O)NCc1ccccc1 1799871717 YULZOBDMGRSQJD-ACDBMABISA-N 496.568 0.994 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)nc2ccc(Cl)cn12 1800087696 YLNBNQWRDCZFTA-VPTLXERWSA-N 482.733 0.493 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)[C@@H]1CCc2cccc(Cl)c21 1800327413 DKUXTYMMJAHLEB-ZRAXVTTISA-N 468.746 0.953 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOCCOCCOC 1800839749 ZOZQUYWFIAIQSG-DFGXFYAUSA-N 465.385 0.819 50 20 JCGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)[S@@](=O)c1ccccc1 1801012651 DNZRHUBVTRYPTM-MULAWHFUSA-N 464.588 0.145 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(Cl)cccn13)C2 1801012891 BJIIKELMXHIBCP-HBCWATKFSA-N 462.938 0.564 50 20 JCGD CCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1802131906 ZHHLWFXHAGMMLU-AXVVYFOYSA-N 483.610 0.642 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnc3[nH]ncc3c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361130 HKZAUPBCIQRQGA-LAUBAEHRSA-N 470.298 0.666 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cn2cc(Cl)cn2)[C@@H]1c1cccnc1 1807412544 HVFYCQVORTYLNF-YWZLYKJASA-N 482.932 0.950 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCc2cnn(C)c2)[C@H]1c1cccnc1 1807432276 UZEFNTULXKXJCI-AUSIDOKSSA-N 455.563 0.827 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1 1810292451 UPHDTLUCZFAUJV-UEENNCTQSA-N 478.557 0.871 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810299585 SMZXTNLCIIXKSS-KYNLDRKZSA-N 466.498 0.519 50 20 JCGD CC(C)NCCC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303750 VMFVNMWKNBWWOZ-DYESRHJHSA-N 453.547 0.788 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1 1811270932 PYRRARQGKCZUOW-KKSFZXQISA-N 485.508 0.756 50 20 JCGD COc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1OC 1811644109 ITWZWGFAPGXRHA-AVRDEDQJSA-N 490.325 0.807 50 20 JCGD COCCOCCOCCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813075101 XLILNRRXMIFZBY-GBXCKJPGSA-N 493.605 0.530 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H]2[C@H]3COC[C@H]32)[C@H]1c1cccnc1 1813658010 GKHJELMVNJIUGW-JIKAWYKTSA-N 450.499 0.292 50 20 JCGD CCN1CCC(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1814241905 FRKSQCNOCJULNZ-FYYLOGMGSA-N 464.375 0.813 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347765 NWXVCTVNSXOUJL-WBMJQRKESA-N 453.333 0.815 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347950 YZKMTSGATMBNOE-CZUORRHYSA-N 453.333 0.582 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361841 SLQQAOGPCNZPQU-BRWVUGGUSA-N 483.355 0.804 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCO4)sc2C1)c1ccc(B(O)O)cc1 1819116086 UFTIKXWPTMBWOI-AWEZNQCLSA-N 467.316 0.342 50 20 JCGD CC(C)n1cnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n1 1819796751 DIGKJWJLSFDXOI-NSHDSACASA-N 469.531 0.854 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(CO)on3)sc2C1 1821699713 CZMYLFPLFROVRM-VIFPVBQESA-N 457.472 0.162 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](O)CCl)[nH]n1 1823530567 OPNAFGWAZLAXNT-MJBXVCDLSA-N 486.957 0.770 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1c(=O)n(C)c3ccccc31)CC2 1826085960 HJJMPVRBUMUCBW-CQSZACIVSA-N 499.597 0.782 50 20 JCGD O=C(Cc1ccc2ncnn2c1)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052342 GKMIZULYMBADMR-JOCHJYFZSA-N 475.358 0.885 50 20 JCGD O=C(CC(F)(F)C(=O)O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059500 RGGWNSCZPHBWMR-QGZVFWFLSA-N 452.263 0.710 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1828128860 YPQKAIYEYSFYQY-WBVHZDCISA-N 458.349 0.354 50 20 JCGD C[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)N1C[C@H]2C[C@H]2C1 1828809495 NPNWRFOLCHAJJH-CPDIYIAASA-N 453.392 0.940 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCN2CCOC2=O)CC1 1828924066 IHHRUSFVIXIMFQ-LJQANCHMSA-N 472.546 0.761 50 20 JCGD COCCn1nccc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830538580 KDPCAYOCGOLAOD-DNVCBOLYSA-N 473.368 0.631 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1830573681 BYZLQFHUCJIOJU-VEVIJQCQSA-N 498.346 0.019 50 20 JCGD Cn1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc2c[nH]c3nccc-3c21 1830730917 GFTBBQUHDVZDFE-VGOFRKELSA-N 475.933 0.676 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1832074705 FZNWNHAOCFPGDN-WQTXXOFMSA-N 489.997 0.832 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551649 RCTHBSHEBPLVNJ-IVZHQMGZSA-N 490.985 0.100 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Br)CC2)CC1 1833452074 VFKKVQVGOXGZBM-DOMZBBRYSA-N 485.420 0.576 50 20 JCGD COc1cnc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)c(F)c1 1833634516 MGSRFQQLNZCQDA-WMLDXEAASA-N 464.263 0.990 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1csnc1C)CCO2 1833745083 DOWYUQIAQMYVEN-VQYZLWMVSA-N 474.543 0.656 50 20 JCGD COc1cccc(CC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)n1 1833779759 JZVXAGYCMYYYFV-UHFFFAOYSA-N 474.606 0.577 50 20 JCGD COC(=O)[C@H]1CCC[C@H](C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1 1834798945 IIBVVKWWJWMZCD-PMACEKPBSA-N 499.417 0.531 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3nc(O)n4c3CCCC4)CC2)CC1)c1cccc(B(O)O)c1 1834801246 TVWINYKTRQKAFU-UHFFFAOYSA-N 495.389 0.104 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ncon3)CC2)CC1 1835117832 OPFDSFMVCINEAE-AFUMVMLFSA-N 456.507 0.389 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(F)c(F)c3)CCO2)C1 1835140017 NENYCLWRDYWQPD-HSZRJFAPSA-N 489.479 0.276 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc2c(c1)OCCO2 1835282539 JTGORCLGSDFNKV-UHFFFAOYSA-N 493.369 0.637 50 20 JCGD NC[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1)c1ccccc1 1835811330 DKTJRPUVYVJRSP-FXAWDEMLSA-N 454.365 0.970 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1835926614 VBDCNOSQERPMMH-CJAUYULYSA-N 482.342 0.249 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cccnc34)C2)C1 1835928444 QILYRZCZIAHFAK-VWLOTQADSA-N 475.310 0.298 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1835930210 BZDAYSWAPLDQSZ-HXUWFJFHSA-N 481.236 0.097 50 20 JCGD Cn1c(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc2ccccc21 1835934298 UMEOBERHZAUFMN-SANMLTNESA-N 491.353 0.171 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)CSc1ncccn1)CCO2 1836111236 LYVYJWVAHSPHEF-QGZVFWFLSA-N 459.366 0.810 50 20 JCGD O=C(CSc1ncccn1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1836115063 LBEAMOWFFMRTJQ-CZUORRHYSA-N 463.329 0.716 50 20 JCGD O=C(C1=NN(c2ccccc2)C(=O)C1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1836525909 CYUBQHFAPRGJHN-XLIONFOSSA-N 452.870 0.770 50 20 JCGD Cc1cccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)n1 1837455955 GWBUFPUQESYQFO-ZFTMLNQLSA-N 480.525 0.172 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)c1 1837460072 RYSVCOKZPGHXJL-XMMPIXPASA-N 467.526 0.686 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(F)CCCC=C3F)C2)C1 1837461777 AZZHKEUKGFJRKJ-FCHUYYIVSA-N 479.484 0.501 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nc(O)n4c3CCCC4)C2)C1 1837715174 ARWKQHMPBOVVPI-OAQYLSRUSA-N 466.611 0.847 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(Cl)ccn3)CCO2)C1 1837864605 WJHBJUPGVCXKKG-NRFANRHFSA-N 474.905 0.117 50 20 JCGD CCn1nc(C(C)C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838812849 XFRADCOABTUROG-DEOSSOPVSA-N 499.572 0.409 50 20 JCGD O=C1NCc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)ccc21 1839200674 PFCSTOGPPDNCPP-BEFAXECRSA-N 470.295 0.691 50 20 JCGD CN(C)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn1 1839201147 XMYXFRSAJKOTLD-MAUKXSAKSA-N 459.316 0.908 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1O 1839308337 XCRLAMRVDZAJAM-HSZRJFAPSA-N 469.498 0.083 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)CCO2 1839388243 LLCLKNJJWBUSES-ZJNRKIDTSA-N 480.356 0.069 50 20 JCGD O=C(c1nc2ccc(F)cn2n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839624482 JUUDCKRTJJKYIJ-DYVFJYSZSA-N 474.262 0.629 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)CCO2)C1 1839914315 YYSXOWYQIWZHDQ-NDBKNAECSA-N 471.558 0.581 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](COC)NC(=O)OC(C)(C)C)C2)C1 1840152583 MRKDXRHYBXSWGR-WHSLLNHNSA-N 493.985 0.236 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(-c4ccncn4)noc3C)C2)C1 1840154060 JVYFVRUBYIUSJI-YCRPNKLZSA-N 479.921 0.764 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(Cc3ccccc3)C(=O)OC)C2)C1 1840156441 SGKQXWGUINYFNY-XXBNENTESA-N 497.976 0.965 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)ccc1C 1840184925 FQMNUKZQSBEELJ-DEOSSOPVSA-N 489.573 0.396 50 20 JCGD NC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1840921548 DUEGXNIMFMLUQX-UZLBHIALSA-N 483.363 0.117 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CNC(=O)c2ccco2)C1)NC(=O)NCc1ccccc1 1843078800 DWGFIGGPCYDMLD-UHFFFAOYSA-N 482.541 0.559 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2csc(Br)n2)C1 1843568975 IYCXWXFHWYBXEL-UHFFFAOYSA-N 450.123 0.716 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CC2(CCCN2C(=O)C23CC(C2)C3)C1 1846735349 CCDWPGMBLZQQFB-PSWPWZSKSA-N 497.401 0.806 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCC(=O)NC1)NC(=O)NCc1ccccc1 1847321071 KIOYSNTYDSSSIX-QYZOEREBSA-N 456.547 0.061 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(OC)cc3)C2=O)cc1 725906818 GKEHNMVDNIGSIO-JOCHJYFZSA-N 455.471 0.730 50 20 JCGD C[C@@]1(c2ccc(CNC(=O)NNC(=O)c3csc(N4CCOCC4)n3)cc2)NC(=O)NC1=O 726281713 CHZSEKDCSDJTGF-FQEVSTJZSA-N 473.515 0.179 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)Nc1nnc(C2CC2)s1 726871448 SHLCTHMRMMBVLS-UHFFFAOYSA-N 452.518 0.903 50 20 JCGD NS(=O)(=O)c1ccc2c(c1)oc(=O)n2CC(=O)NNC(=O)c1cccc(OC(F)F)c1 728545414 HGHKNXAUTKZICP-UHFFFAOYSA-N 456.383 0.305 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1 729276177 YLQPHLZKBAFKMT-LLVKDONJSA-N 458.493 0.325 50 20 JCGD CN(CC(=O)NNC(=O)COc1ccc(-c2ccc(C#N)cc2)cc1)[C@H]1CCS(=O)(=O)C1 729511722 UQASZFGNNGXYFD-IBGZPJMESA-N 456.524 0.870 50 20 JCGD CN(C)c1ccc(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)cc1 729689526 ZRCWLZGJXNUFPA-UHFFFAOYSA-N 476.584 0.505 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)NCc3cccc(C(F)(F)F)c3)cc2)CCN1 742452842 HWFYIDJDPCQWFL-UHFFFAOYSA-N 499.471 0.970 50 20 JCGD CC(C)(C)OC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C\c1ccccc1 822204940 HCYGUCOOWMDGQA-WVUXNXBLSA-N 461.562 0.936 50 20 JCGD O=C(COC(=O)CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)c1cccs1 848373592 FOUIAOGSGWIACD-UHFFFAOYSA-N 476.330 0.793 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C/c1cnn(C)c1)c(=O)n2Cc1ccccc1 901387798 RFJKAFCAEGAORW-MDZDMXLPSA-N 476.497 0.022 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccc3c[nH]nc13)c(=O)n2Cc1ccccc1 901392252 IMFSKDZQRIQOFY-UHFFFAOYSA-N 486.492 0.765 50 20 JCGD C[C@@H]1CN(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C[C@@H](C)O1 916249606 BUVBNOVPOCHZHF-IAGOWNOFSA-N 483.591 0.151 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@H](C(C)C)N2CCOCC2)cc1 916254257 SGNJTTRKFQOKKD-GOSISDBHSA-N 455.581 0.303 50 20 JCGD CCc1c(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC)n(Cc3ccccc3)c2=O)cnn1C 918016380 HOHSUAJBDYGIRM-UHFFFAOYSA-N 478.513 0.185 50 20 JCGD CN(C)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)ccc1F 919445531 TUYNGOYFPLRYQZ-UHFFFAOYSA-N 468.419 0.602 50 20 JCGD CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)cc(C3CC3)nc21 919886788 VBVLEEFRCBFSRQ-GFCCVEGCSA-N 478.531 0.162 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1)N[C@@H]1CCS(=O)(=O)C1 919889891 WFLGNNOKYSVTRX-LLVKDONJSA-N 450.564 0.054 50 20 JCGD CS(=O)(=O)N1CCC[C@@H](NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)C1 920238915 MZEVGQIOQTWGSU-LJQANCHMSA-N 498.569 0.756 50 20 JCGD Cc1ccn2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)c2c1 1777942636 DDPDWFRWOUGPET-RCZVLFRGSA-N 476.342 0.764 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779335017 DGESCJMPOGEFDW-PMAPCBKXSA-N 459.547 0.386 50 20 JCGD CC(C)(C)OC(=O)N1CCn2c(C(=O)N3CC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)cnc2C1 1779950234 ZCHWPDNWKQBBJX-OPAMFIHVSA-N 497.980 0.677 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780058207 QNOCCAVQJMIWMQ-DJJJIMSYSA-N 464.320 0.564 50 20 JCGD Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c(O)n1 1780138070 ZFJYSAXTBJJDJZ-AUSIDOKSSA-N 453.304 0.217 50 20 JCGD CN1CCC[C@@H](C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)C1 1781001375 MWPRJGFHMVZMIE-PXDATVDWSA-N 486.617 0.504 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cccn3nccc23)C1 1781297900 QEDNGKHMIZAHBU-AUSIDOKSSA-N 456.547 0.835 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](COC)NC(C)=O)C2 1781901488 OZDFLVYXOGOXOA-YKTARERQSA-N 462.385 0.825 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1783252406 DIGLUKUFKXUCHT-DMJCMNNJSA-N 487.601 0.692 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@](C)(O)CN1C(=O)OC(C)(C)C)CCO2 1783878688 IUSZQZMFOAKLPQ-FRMGNDQPSA-N 489.997 0.831 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1783881862 NNTYRMSEFUELKI-GCJKJVERSA-N 481.981 0.416 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cn3c(Cl)cccc3n1)CCO2 1783934691 KKXLPARTZWUCRO-OAQYLSRUSA-N 462.938 0.804 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)C2)C1 1784373498 OSQDBPAZJFWCBP-MDZRGWNJSA-N 470.368 0.460 50 20 JCGD Cc1cccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1784908693 BYTOBUBWLKVIRZ-PMVMPFDFSA-N 450.344 0.901 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(O)n(C)n3)[C@H]2C1 1785595639 RZLQWIPLURAWPK-AXHNFQJDSA-N 487.469 0.866 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3F)C[C@@H]21)c1ccc(B(O)O)cc1 1786982896 CIKLEHSIESCXKQ-LRQRDZAKSA-N 485.277 0.250 50 20 JCGD COc1cc(C#N)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786984824 NOZWTYWZMWFIKO-HSQYWUDLSA-N 463.299 0.154 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](N)Cc3cccnc3)[C@H]2C1 1787472882 KGKKPCUEUXCYCY-QSGXVVIFSA-N 453.381 0.962 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3O)C[C@@H]21 1787508488 KONPBJIPXIGCLA-WILUMGJWSA-N 454.487 0.515 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nc4ncccn4n3)[C@H]2C1 1787940331 TYLOMHIVJGUFDT-FQUUOJAGSA-N 451.325 0.891 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788611350 WAUSNKQSUPQUJR-LNMJFAINSA-N 455.519 0.045 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)NC(=O)OC(C)(C)C)[C@H]2C1 1790176730 DNEFLLCHJHMVCE-JHZZJYKESA-N 478.384 0.983 50 20 JCGD CC(=O)N[C@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21 1790866219 SYKPDBRNQLYIGS-NRQLVOTRSA-N 476.486 0.638 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3C(=O)c4ccccc4C3=O)C[C@@H]21 1791252419 LISNKGRUBOSGLT-FZDIXFNVSA-N 477.945 0.906 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)C1 1791287952 HJRCBZJUUWSBLG-WPVAHCMFSA-N 480.606 0.709 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4c[nH]c5nccc-5c4n3C)C[C@@H]21 1791290700 MMOIETXBSKQZCY-QSFXBCCZSA-N 495.584 0.973 50 20 JCGD COc1ccc([C@H](C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1792830009 NDANMBHVSPXQAW-WGVRVLLMSA-N 467.526 0.701 50 20 JCGD O=C(Cc1ccc(Cl)cc1[N+](=O)[O-])N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1792943181 GDIBJHAQJSJEQI-VPTLXERWSA-N 487.705 0.374 50 20 JCGD CC(=O)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)n[nH]1 1794557192 KWSRVIVRHZXSNS-RMHZUWNSSA-N 483.953 0.948 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1CCOCC1)NC(=O)NCc1ccccc1 1795457108 KRZSRWHCKHIUJJ-RUMRUAAYSA-N 487.601 0.739 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1cc(F)c(F)c(F)c1)C2)c1ccc(B(O)O)cc1 1795736952 RYBMJDAFHVVXNS-SKYBWYAESA-N 474.244 0.700 50 20 JCGD CCN(CC)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1)c1ccccc1 1795736955 RYJRTDJNWPKZJM-CBJLPSGESA-N 479.386 0.653 50 20 JCGD Cc1nc(Br)sc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1796742573 ZDVDDMVXEIGNHP-AGGWBTHJSA-N 494.176 0.411 50 20 JCGD COc1ccc([N+](=O)[O-])c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)n1 1797211849 HWGIDTAZJOZPAU-CLLJXQQHSA-N 469.458 0.563 50 20 JCGD 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Cn1ccc2c(O)ncc(C(=O)N3CC[C@H](CNC(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)c21 1807373420 AWOIRUYPFQMAJB-GCJKJVERSA-N 499.336 0.987 50 20 JCGD CCS(=O)(=O)CC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808408199 HEWAFNBNFHQZLB-MFWRVWTKSA-N 488.570 0.656 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810309094 OZOGJCAGXVNJLL-JXFKEZNVSA-N 475.509 0.621 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1810514653 OCGDBTVHPQXTMU-CDMIOBSGSA-N 460.579 0.765 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CC(F)(F)C(=O)O)[C@H]1c1cccnc1 1813071621 UWUJFCLCOQLZNP-KSSFIOAISA-N 455.462 0.570 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H]1Cc3ccccc3CN1)CC2)c1ccc(B(O)O)cc1 1815340608 NEXLJQAHKPCEIU-ICSRJNTNSA-N 476.367 0.763 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cn3cccnc3n1)CC2)c1ccc(B(O)O)cc1 1815344090 HFDGPJSAGOUBJK-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD Cn1ncc(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1Cl 1815344377 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC=CCC1)CCO2 1830562988 XASFRWVRBAOHNH-UAZFOLIYSA-N 457.531 0.933 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]1C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830726898 VSIWHQGDJLETBQ-SXGZJXTBSA-N 461.943 0.052 50 20 JCGD O=C(c1cc(-c2cc[nH]n2)n2ccccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830732426 XWHLUMWMHRWBFK-OFNKIYASSA-N 487.944 0.999 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)n1 1832770423 YKJONSOUHIRORL-WMZOPIPTSA-N 460.300 0.780 50 20 JCGD CC[C@H](NC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1833094898 IQKXMYSXYIBJKX-MEAKTTDOSA-N 487.605 0.607 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833312489 OJJIRDVLJYCDQE-HXUWFJFHSA-N 481.977 0.621 50 20 JCGD NC[C@@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccc1 1834759632 QSORXMWWDKREPR-XMMPIXPASA-N 478.402 0.294 50 20 JCGD NC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1)c1ccccc1 1834822227 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O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3ccn4ccnc4c3)CC2)CC1 1837919162 LGFIXYIMLJPGIY-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838114977 WFRIQQZWMIOAHX-JOCHJYFZSA-N 497.980 0.577 50 20 JCGD O=C(c1ccc(OCCCO)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838545846 ZEPDSPSGMVEXFO-NQIIRXRSSA-N 456.923 0.118 50 20 JCGD O=C(c1cc(Cl)cc2nn[nH]c12)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838617824 JFLGDIMWEYSEPW-RDTXWAMCSA-N 458.302 0.281 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839109014 WNNUMUKCLXJRQY-QFBILLFUSA-N 473.412 0.006 50 20 JCGD O=C(COCCO)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839195294 MPNSMDUUPRCZOQ-RXVVDRJESA-N 485.375 0.458 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)CCO2)C1 1839210461 PZSDOIKFGOVYKY-CKJXQJPGSA-N 477.986 0.736 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(F)c1Cl)CCO2 1839323582 VMUJAEBSORGRKS-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(O)c(O)c(Cl)c1)CCO2 1839433184 OLLMUAFBNXXKIU-NRFANRHFSA-N 484.937 0.194 50 20 JCGD CCOC(=O)C1(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Br)CC)C3)C2)CC1 1839762427 LNPCLNOALIYKHY-KSSFIOAISA-N 461.353 0.960 50 20 JCGD CN(C)C(=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2 1839802041 KJVODNGQNKCIQQ-UWJYYQICSA-N 482.375 0.537 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(C(F)F)c3)C2)C1 1840183624 PWPYXKNOVWFDQE-NRFANRHFSA-N 469.489 0.462 50 20 JCGD Cc1cc(C)cc(CCC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840306249 NKSVBIBBJPXIKV-SANMLTNESA-N 480.370 0.686 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3C#N)CCO2)C1 1840820372 MCLFGYIYKVOSSA-UWJYYQICSA-N 451.907 0.647 50 20 JCGD O=C(/C=C/c1ccc(O)c(O)c1O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840881195 IAKNJWMZBUBNOX-CCJIBRKGSA-N 489.294 0.964 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1846534439 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458.548 0.534 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NN=Cc1c(C)noc1C)c(=O)n2Cc1ccccc1 916333730 RZHWXUCYUYTAJH-UHFFFAOYSA-N 479.497 0.810 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)Cc2ccccc2OC)c1 919822839 NNUREIPTEBUILW-UHFFFAOYSA-N 476.555 0.846 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc(CC(=O)O)ccc2OC)c1 919954944 XGAKXTBWLCBKGM-UHFFFAOYSA-N 499.567 0.976 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCC(=O)N2CCCc3ccccc32)cc1 920045712 UTDDBNWJZIWEMZ-UHFFFAOYSA-N 473.555 0.925 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3c(C)nc4ncccn34)C2)C1 1777897662 SMDVCSBDZZLVIA-JEWPKMHUSA-N 478.513 0.615 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2 1777993566 QVWLEIPAIWORQT-PEOGOYOCSA-N 489.997 0.736 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c2C1 1778368168 DWOAZZFOFDPXDF-BTYIYWSLSA-N 498.968 0.072 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cncc(C(F)(F)F)c3)CCO2)C1 1779032866 YVZFEZWEAJQNKU-FQEVSTJZSA-N 478.431 0.856 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)[S@](=O)c1ccccc1 1779037365 XVIORKGKOPLWMJ-ULVZBFQNSA-N 485.566 0.325 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccnc1S)C2 1779371291 MGXPZLXHICHKAG-VGOFRKELSA-N 470.555 0.810 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3n[nH]c4cc(Cl)ccc34)C2)C1 1780946171 UWTGZYDFPBYNIH-HSZRJFAPSA-N 497.943 0.901 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(CS(C)(=O)=O)nc3)CCO2)C1 1783535031 VWDCQDCDEJESFA-UGSOOPFHSA-N 474.377 0.853 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1 1784237535 UGYLTLOUQLDBFD-OZXSUGGESA-N 477.370 0.475 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Nc3cccnc3)[C@H]2C1 1786863840 RUIFNMZMHIXJCB-YILCDIOZSA-N 481.557 0.996 50 20 JCGD Cc1cccc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5ccc(B(O)O)cc5)[C@H]4C3)n[nH]c12 1786982970 DMVKOJZRDTWRDQ-VDGAXYAQSA-N 462.315 0.458 50 20 JCGD O=C(Cc1noc2ccccc12)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1787006077 NJEWQHBZQQGDBM-BPXKWBHBSA-N 463.299 0.344 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Oc3ccccn3)C[C@@H]21 1787508124 HLRBETQLSJLLAB-QATFAZCYSA-N 482.541 0.963 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3csc(N)n3)C[C@@H]21 1787508958 NXCGVQGTEFZCBB-OCCUQACQSA-N 459.532 0.453 50 20 JCGD CC(C)(C)OC(=O)N1CC(C)(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1788222165 DKSQWCQTAJACGV-JONQDZQNSA-N 459.971 0.823 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607793 HWIXVBULBNFYGQ-USJZOSNVSA-N 490.561 0.192 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3Cc4ccccc4CN3)C[C@@H]21 1791291352 SBMTZWREFQWUNC-BURNTYAHSA-N 457.575 0.054 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(c4ccccc4)=NN3)C[C@@H]21 1791293773 IVBNCKBRUNMLND-MMKMLUHNSA-N 470.574 0.105 50 20 JCGD 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O=C(Cn1cccc([N+](=O)[O-])c1=O)NC1(c2ccc(NC(=O)c3ccc(B(O)O)cc3)cc2)CCC1 1788143554 MUJPRWOSKSRJAV-UHFFFAOYSA-N 490.281 0.884 50 20 JCGD Cc1cccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788610624 MVPZALOCWVMUCI-YYWHXJBOSA-N 451.527 0.830 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nnc(Br)n3c1)C2)[C@@H](O)CCl 1792976755 MRMFLYQRIUYCJF-OPDFLTKYSA-N 472.727 0.295 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792982691 MCMQNDNCVWKUJF-RDZLJWOHSA-N 457.955 0.575 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncc(Cl)cc1Cl)C2)c1ccc(B(O)O)cc1 1795732805 MWFAJTNLZQJVIZ-FVCICTRLSA-N 464.114 0.585 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3)no1)C2)c1ccc(B(O)O)cc1 1795734134 FFIQVUIQKQWGQE-OPMZPASUSA-N 461.283 0.538 50 20 JCGD O=Cc1ccccc1-c1cncc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1 1795737136 WIEFEBYWPGBULK-BRTYFSMRSA-N 499.332 0.758 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccnc1)NC(=O)NCc1ccccc1 1795866114 VYBOVFFLZAEUHW-RUMRUAAYSA-N 480.569 0.560 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[C@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1796190357 QNFKCPPVIDOAES-DMRZNYOFSA-N 476.264 0.775 50 20 JCGD C[Si](C)(C)OCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(S(C)(=O)=O)CC1 1797139409 YOEMKJMEPXQJKI-ALXJQNPVSA-N 461.657 0.099 50 20 JCGD Cc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)cnn1C 1799094797 LDDCSSFATGOVLR-HATOLVCRSA-N 483.573 0.278 50 20 JCGD CC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799098011 YXSCLUBAQPEBJM-DMUMMCEESA-N 465.982 0.940 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCBr)C2 1799256054 NIYXEXYBTXDCOC-XOIINTDNSA-N 478.384 0.902 50 20 JCGD CN(C)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(Cl)cc1 1800304828 BVHHBXTXJGQXTQ-UDKICSLYSA-N 485.777 0.526 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc3c1NC(=O)C3=O)C2 1800759087 HBQDRGFQUAGKFF-NJBDSQKTSA-N 450.289 0.808 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C(=O)c1ccc(C)cc1 1800884472 NVQJTIHOBCMQPD-TWKZMHJBSA-N 465.510 0.901 50 20 JCGD CC(C)(C)[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803074844 XFZBZGMYJRDNDA-KFKAGJAMSA-N 454.531 0.807 50 20 JCGD CC(=O)N[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(C)(C)C 1803387078 ZOFWYCDUKYFTBR-DUXKGJEZSA-N 495.584 0.951 50 20 JCGD COC(=O)CSCC(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1803581290 WCLZJPYYUJKRPF-IIBYNOLFSA-N 465.576 0.367 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnn(-c2cccnc2)c1 1805073301 GMFZCYSTSIADCF-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)C[C@@](C)(O)CC(=O)O)[C@@H]1c1cccnc1 1808416182 GKBCUGVLOLHHLO-YMVHLNNGSA-N 498.540 0.837 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2nc3ncccn3n2)[C@H]1c1cccnc1 1809234815 CJSPKYKHKPKZOM-VQIMIIECSA-N 465.518 0.212 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1n[nH]cc1[N+](=O)[O-] 1810632899 LBDUJVLWTHZSSH-DNVCBOLYSA-N 464.247 0.026 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1814122713 DIQGGRQSEAAPMW-BVSLBCMMSA-N 466.347 0.386 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1818113071 BCYBABWKEXSQHD-NFXIUMSZSA-N 485.549 0.909 50 20 JCGD N#Cc1c[nH]c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)c1 1819797771 JNZZVZGEZOTUPD-LLVKDONJSA-N 450.484 0.881 50 20 JCGD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)N1CCN(C)CC1 1820784169 BFKIFGFUAVJDND-OXQOHEQNSA-N 468.367 0.031 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1cc(O)cc([N+](=O)[O-])c1 1823643999 VQEGQJBTOJTJQE-CQSZACIVSA-N 482.283 0.976 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1cnc2c(c1)CCNCC2 1824639763 GIAXJKGSTVSFCT-GOSISDBHSA-N 491.382 0.446 50 20 JCGD CC(=O)c1cc(C(=O)N2CCCC[C@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n[nH]1 1825702905 HVJUCERGOFIROH-NRFANRHFSA-N 452.320 0.839 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1 1830534496 AORANWNPDSMWLE-AUUYWEPGSA-N 462.385 0.636 50 20 JCGD Nc1nc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc2s1 1830723555 PNNRPLCWQLSXIL-KUHUBIRLSA-N 454.936 0.548 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](C)CNC(=O)OC(C)(C)C)CCO2)C1 1830742372 ALSSOTHTLHEGNL-QYWGDWMGSA-N 477.986 0.857 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830996681 NTNNWJXWFGGTGX-QNFHRHJVSA-N 489.997 0.736 50 20 JCGD COc1nccnc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1833502205 JWZSZXPBKOXFLS-UGSOOPFHSA-N 457.325 0.586 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(OCF)cn1)CCO2 1833569964 KQGKNTSSTUMQFW-IBGZPJMESA-N 456.547 0.704 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)C3=NN(C)C(=O)CC3)CC2)CC1 1833690999 DOFYQRVXFFYNKL-CYBMUJFWSA-N 456.385 0.950 50 20 JCGD Cn1cncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1834322517 VVRJBYPMBJQSAI-BTYIYWSLSA-N 485.969 0.622 50 20 JCGD C[C@@H](Nc1cccnc1)C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1834720805 GBBUNIUQWXLLSV-GOSISDBHSA-N 473.622 0.827 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3CCc4ccoc4C3)CC2)CC1)c1ccc(B(O)O)cc1 1834797726 ABCJQDLEQBSYBE-HXUWFJFHSA-N 479.386 0.950 50 20 JCGD N[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cccc(Cl)c1 1834797997 UOLKGGJPQTZLCH-QHCPKHFHSA-N 498.820 0.905 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnccc3Cl)CC2)CC1)c1cccc(B(O)O)c1 1834801293 XCDZKTCCYAIYHP-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cccc(N4CCOCC4)n3)C2)C1 1834821199 BBMRYXPUMAUGGK-OAQYLSRUSA-N 497.390 0.773 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1 1834823305 NFJHNZJPSYMWIV-SFHVURJKSA-N 452.309 0.584 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)COCc1ccccc1)CCO2 1835370109 HASFBZQEBIVKRM-HSZRJFAPSA-N 462.547 0.033 50 20 JCGD CC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835929213 HSRDBZAIXXKSGV-RDGATRHJSA-N 466.343 0.630 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@@H]3c3ccc(F)cc3)C2)C1 1835934033 KQMPTPPYVATWJN-TZBSWOFLSA-N 482.317 0.379 50 20 JCGD O=C(/C=C/c1cccs1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935822 UAUSANMPFAEKBG-WMWRJIBUSA-N 456.329 0.211 50 20 JCGD Cc1n[nH]cc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836155263 HVEMNFBDCGSDIM-UHFFFAOYSA-N 454.535 0.216 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)CCO2)C1 1836472619 OXTQFBXHCLYNOR-VWKPWSFCSA-N 477.986 0.736 50 20 JCGD COC(=O)C12CCC(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](O)CCl)C4)C3)(CC1)CC2 1836705976 FTKHTQRIYOLDEN-PDQWDRGOSA-N 472.966 0.556 50 20 JCGD Cc1cccc2[nH]c(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)cc12 1836914824 MGRJWTKMBDWTFL-VWLOTQADSA-N 477.326 0.540 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1ccccc1=O)CCO2 1837681398 ZAGCTVXTCWOCTF-GUXCAODWSA-N 470.364 0.897 50 20 JCGD O=C(NCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccco1 1837919356 IKPLRBYAWCOPIQ-UHFFFAOYSA-N 483.330 0.002 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)ccn3C)CCO2)C1 1838536007 HQHRPQLOXFKZTL-BEFAXECRSA-N 456.337 0.629 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cccc1Cl)CCO2 1838870520 YJYKCNFEBACFSL-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1C 1838943164 SBGULGYUTZGZGF-XMMPIXPASA-N 452.316 0.367 50 20 JCGD O=C([C@H](F)Br)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CC[C@H]3CCC(=O)N3C1)CCO2 1839084078 QTYBSVZZMIQOQX-PGSNGQOISA-N 476.343 0.534 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1 1839139062 NBDFBEZXFQGFTA-KXBFYZLASA-N 467.922 0.519 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1839153483 ZLAKPIOWJGDBDK-WOJBJXKFSA-N 488.372 0.323 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3CCCS3(=O)=O)CCO2)C1 1839783916 OKCQSCSVWXRNRY-RRQGHBQHSA-N 457.376 0.256 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](NC(=O)OC(C)(C)C)C3CC3)C2)C1 1840152689 PVUBLSMCHAXHOV-HOIFWPIMSA-N 489.997 1.000 50 20 JCGD Cc1cc(F)cc(CC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1840240152 HHHSIQHBGLWSLT-XMMPIXPASA-N 485.516 0.445 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1840297925 DOKNSRUOPFAVHD-KBMIEXCESA-N 466.343 0.315 50 20 JCGD O=C(c1ccc(Br)nc1F)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010582 GYTIUCFMJQIDJU-UHFFFAOYSA-N 462.084 0.794 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)CC1=O 1843013043 BCWLXYUAMSIQRL-HXUWFJFHSA-N 475.354 0.853 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)Nc2ccc(F)cc2)cc1 9931194 KQDQGTYCALISCZ-CYBMUJFWSA-N 455.489 0.822 50 20 JCGD COC(=O)CCc1c(C)nn(-c2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)cc2)c1C 16786251 VDNZOWATOFZVQY-INIZCTEOSA-N 462.528 0.790 50 20 JCGD CC(C)CC(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 24608418 GHWHTSBEGDYCLK-AWEZNQCLSA-N 453.970 0.615 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)c1c[nH]n2c1nc(=O)c1ccccc12 117348167 WGBUDVGEBKEUCG-UHFFFAOYSA-N 453.484 0.852 50 20 JCGD CCCCN1CCC(NC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)CC1 749211974 FYACASQPQWWNET-UHFFFAOYSA-N 453.613 0.908 50 20 JCGD COC(=O)c1sc(S(=O)(=O)NNC(=O)CNC(=O)c2cccs2)c(C(=O)OC)c1C 751280734 UOOJAWVIUCNASV-UHFFFAOYSA-N 475.526 0.431 50 20 JCGD Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 914881635 OPRSVNNKVPLEEA-IJEWVQPXSA-N 471.963 0.907 50 20 JCGD O=C(NC[C@@H]1CCN(C2CC2)C1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 916577932 MQZNXBFJJCVOGZ-HNNXBMFYSA-N 451.549 0.136 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCS(=O)(=O)NC(C)(C)C)c1 916622243 BVSKUIAZFACLIB-UHFFFAOYSA-N 477.609 0.379 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)NCc1nccs1)N(S(C)(=O)=O)CC2 918219564 QPWHHCVLTXIMPL-CQSZACIVSA-N 483.572 0.940 50 20 JCGD Cc1cc(N2C[C@H](C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)CC2=O)ccc1Br 919884052 DPTPEHAKGNHVSH-NEPJUHHUSA-N 473.349 0.628 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC[C@@H]1CCCCO1)N(S(C)(=O)=O)CC2 920344172 OKGXBYYFZSRFRD-RDJZCZTQSA-N 484.575 0.852 50 20 JCGD NC(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2C(=O)OCC(=O)NNC(=O)c2ccccc2)cc1 920681440 KGBYXUCQKJNDIE-QTJNJRLBSA-N 464.478 0.794 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnn4cc(C)cnc34)C2)C1 1778523797 PWNGBAYTEQNQGR-PVPASAESSA-N 478.513 0.615 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1nc(Cl)ccc1F)CCO2 1779028076 BWMCLVTZPBVVEA-FQEVSTJZSA-N 462.869 0.630 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Nc2cnccn2)C1 1779389584 KKBLYKAFEWIPMM-GNJWOMSCSA-N 496.572 0.925 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cc(-c3ccncc3)[nH]n2)C1 1779742867 BSPMUJVEAKPSAY-HYBUGGRVSA-N 483.573 0.972 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CSCC(=O)O)CCO2)C1 1780098577 OYZBEQISPFYLEK-FQEVSTJZSA-N 481.483 0.781 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@H](F)Br 1780771209 HGDNIVIYJXLLRJ-RVKKMQEKSA-N 457.105 0.184 50 20 JCGD Cc1n[nH]c(C)c1C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969073 UVPPNLCPPYWGIY-DEOSSOPVSA-N 483.573 0.816 50 20 JCGD CCN1CCC(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)CC1 1783300520 GXVDWKZBDGJLJL-AUSIDOKSSA-N 451.612 0.605 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ncccc1Br)CCO2 1783935400 PZQYNKBJLHCANW-LJQANCHMSA-N 468.352 0.661 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CS(C)(=O)=O)C[C@@H]21 1783964072 JCZYPVDDFMWKEX-MRLBHPIUSA-N 453.399 0.678 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)c1ccc(F)cc1 1784092325 HNPRDYWQOLEYLC-GBBGEASQSA-N 455.914 0.582 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)CCCn3ccnc3C)C2)C1 1784410262 SFQMIAGAJMHPIM-OINMWHHXSA-N 469.546 0.936 50 20 JCGD Cc1csc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1785298659 ZJAVTVJXYPFAHL-YYWHXJBOSA-N 456.373 0.962 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1nnc(-c2ccccc2)o1 1788662617 ROSJOTINCWIGQS-IHPCNDPISA-N 476.298 0.324 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)c3cnccn3)[C@H]2C1 1788705908 BQYYZCVJFSZPFJ-YGJAXBLXSA-N 468.352 0.358 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cnc(Cl)c(Cl)c1 1788872488 MIHOHQKOUOVEGX-OWQGQXMQSA-N 478.141 0.975 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](O)CCl)C[C@@H]32)c1 1789232224 ZBQSAEMVGKJBJV-FRJURHEUSA-N 454.911 0.854 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1792872281 WCBMMAJSCLLOAM-NFFDBFGFSA-N 471.308 0.377 50 20 JCGD C[S@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCl)C2 1792892430 OBGOCTKHOXPEAX-KCLRRUQNSA-N 480.027 0.886 50 20 JCGD CC(C)(C)OC(=O)NCc1ccnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)c1 1792976460 UUKSWVVZUOAETG-MVJTYMMSSA-N 482.965 0.909 50 20 JCGD Cc1noc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)n1 1793880753 FMPNKZVPVLPAHM-LOUJCGABSA-N 471.942 0.642 50 20 JCGD CN(C)c1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1 1795740550 ATIIFAHNTAAXGQ-IRJINJETSA-N 465.359 0.268 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccncn1 1796519841 SURCCKKEBUAOQK-XRGAULLZSA-N 453.927 0.812 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](N)Cc1cscn1 1796745231 ISEKLASUAKTXDQ-JLOQOIBHSA-N 457.560 0.785 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(Cl)nc3n[nH]cc13)C2 1797750833 VANDZPUVJHBRIL-YQYWCBKUSA-N 484.904 0.127 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)C1 1797900680 SIYNLBQUWMNADS-NRAIQUKZSA-N 489.353 0.967 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC(=O)Nc1ccc(F)cc1 1799034502 FBTWWGSSPDKEMX-YEZVWNJWSA-N 463.510 0.117 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cncc(C(F)(F)F)c1)C2 1801011820 IIACAJNILOYTMQ-ZSBFGKGUSA-N 457.453 0.677 50 20 JCGD O=C([C@H](O)CCl)N1CCCC2(CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)CC2)C1 1805517323 BHKVKYZCXHEEKB-XJKSGUPXSA-N 452.939 0.824 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)n1cccc1C=O 1807371327 SRLGAWDQFSBTSS-DHJUGAMNSA-N 474.326 0.956 50 20 JCGD Cc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c(O)n1 1807373966 FCYUAKXPXZGDNR-WIYYLYMNSA-N 460.299 0.804 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375094 LPFSKMPRQZWZQI-PGRDOPGGSA-N 459.315 0.538 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1808727191 MWHLPCQCXIEXSI-FAJBIJEISA-N 484.981 0.963 50 20 JCGD Cc1cc2nnc(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)c(C)n2n1 1809184352 AJTKFVJQDONJNA-AUSIDOKSSA-N 499.340 0.449 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1 1810299442 QJLSFTTUEWVEFR-YWZLYKJASA-N 494.487 0.809 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccccc2C(N)=O)[C@H]1c1cccnc1 1811283073 LWUQEDPIXUMFFP-IIBYNOLFSA-N 487.520 0.812 50 20 JCGD CC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1812616861 BVQPLHXKIYPOOZ-ZNNHERQJSA-N 453.503 0.358 50 20 JCGD Cc1nnc(CCC(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)s1 1815337991 YWHHHVUHWQTBLF-CQSZACIVSA-N 471.373 0.841 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCc2nc(NC(=O)Cn3cnnn3)sc2C1 1815686385 RPILLWPIPJYORQ-LLVKDONJSA-N 486.470 0.889 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cnccc1C(=O)NN)CC2 1817303201 YGTAWERUMNFXQD-ZYHUDNBSSA-N 459.532 0.234 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)no1 1817472468 UAEGAWPQRVZYBO-SFHVURJKSA-N 480.290 0.122 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](C)n2cnnn2)[nH]n1 1818113249 HNIDDXOBUKAYPA-YARHMNOQSA-N 467.494 0.784 50 20 JCGD C[C@@](Cl)(CCl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2 1822863987 WRSAMIFFSCJPDV-HYORBCNSSA-N 471.330 0.731 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC([C@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)CC1 1824977145 ZPVFPSHIITZKOK-ZWKOTPCHSA-N 464.028 0.590 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2c[nH]c(=O)cn2)CC1 1829715875 DKGWHJAQGCHWLI-GOSISDBHSA-N 453.503 0.316 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)COC3CCCCC3)CCO2)C1 1830379691 WMIBPEFQTYYTLW-HSZRJFAPSA-N 475.546 0.104 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)c(=O)[nH]c1C 1830534939 FHTLNYQHUFMESM-HXPMCKFVSA-N 471.352 0.488 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](C)CBr)CCO3)C2)n1 1830539189 FDMUHCFBPLFQBW-VFNWGFHPSA-N 499.406 0.774 50 20 JCGD O=C(c1ccc(CCN2CCCC2)nc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830728956 ZITHGLFQRJJYQF-NFBKMPQASA-N 480.993 0.390 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3[C@@H]1O)CCO2 1830827014 CVFLUUZNQVNUAN-QTDGGUCWSA-N 466.962 0.993 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)NC(=O)OC(C)(C)C)C2)C1 1831654160 RENFFYVJRPBBMU-AVYPCKFXSA-N 463.959 0.693 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1833262270 LXIJPNPRJROALX-BBRMVZONSA-N 460.417 0.182 50 20 JCGD CN(C)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)nc1 1833648061 NNNKVUKZNGGYPJ-MAUKXSAKSA-N 459.316 0.908 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CCN3CCN(C)CC3)CC2)CC1 1834623336 HQZJVRUKAZWONM-HXUWFJFHSA-N 458.047 0.449 50 20 JCGD Cn1ncc2c(C(=O)N3CCC(N4CCC(NC(=O)c5cccc(B(O)O)c5)CC4)CC3)cccc21 1834799908 CQQWQBDBEPJQDT-UHFFFAOYSA-N 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CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc[nH]n3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724946 SBYJEMVHQAMOOX-BJLQDIEVSA-N 469.546 0.349 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1790684597 UNUIXMAVXOODRA-TZANDKBRSA-N 464.872 0.723 50 20 JCGD Cc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)c(C)n1 1791498353 BGMOSLWBHKQFFO-ACRUOGEOSA-N 459.591 0.984 50 20 JCGD CC(C)(C)OC(=O)NC12CC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)(C1)C2 1792983729 MLMWEOJHLVHQCY-BJEBVQOXSA-N 457.955 0.623 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccnc(C(F)(F)F)c1 1794543871 FFHQFCDFZLURJC-JLVBRIDZSA-N 463.221 0.297 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1ccccc1=O 1795775480 GRPHXDRVBXKDPD-MFKICJERSA-N 484.465 0.585 50 20 JCGD CCc1c(Br)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)nn1C 1796408408 FWVALICJWBRVQP-MUJYYYPQSA-N 489.179 0.990 50 20 JCGD Cc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c2cc(O)ccc2n1 1797750844 SDGRUGUAPALPEL-YEZVWNJWSA-N 490.520 0.764 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)ccc1C 1797753227 ZWEZEDFWZWXEJH-CWPLJXCYSA-N 453.499 0.519 50 20 JCGD CC#CC[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccccc1 1797876548 IFQZAPZCIGNVJH-DVKRWUGUSA-N 460.339 0.767 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ncccc1C(F)(F)F 1798226085 ZGLNZZXEUUBWBW-XOIINTDNSA-N 463.221 0.297 50 20 JCGD CSCC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097600 QCOPRVDVKASKBT-JTJHWIPRSA-N 493.630 0.036 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccncc1)C2)NC(=O)NCc1ccccc1 1799097681 TXHMZESKRUSXLF-RUMRUAAYSA-N 480.569 0.560 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=C2c3ccccc3C(=O)N2CC1)c1ccc(B(O)O)cc1 1799138815 BMTKQUIWHCJURD-REPLKXPHSA-N 471.322 0.889 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799347537 PQHMRVPEQAZLMD-NDKCEZKHSA-N 482.347 0.806 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)CBr)C2 1800201058 DYMAJPLQPQGASL-JGFGOLAASA-N 467.364 0.821 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccnn1)C2)[C@@H](Br)Cc1ccccc1 1800436052 PMPVTHYPGUGLFI-ZMMAXQRCSA-N 462.348 0.874 50 20 JCGD O=C1C[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)Cc2ccccc2)C3)CN1 1800529343 HWLJKLVFXCDCTF-NRUGXNMXSA-N 464.360 0.718 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)[C@@H]2C1 1800717925 ZVLOGFMBSODBNV-ZJZYOEKZSA-N 457.955 0.289 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)C[C@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CO[Si](C)(C)C)C2 1800806707 VSXFICQLORJUEH-OYNZLANYSA-N 485.654 0.798 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801013251 YPSMGEXPJJDOSE-YVWYUNDQSA-N 460.510 0.358 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CS(=O)(=O)N2CCCC2)[C@@H]1c1cccnc1)[C@H](O)CCl 1803138805 FHMLNNGEHVWSRM-LZLYRXPVSA-N 458.968 0.113 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(Cl)ncn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361478 QFBKHLSMMCGPNG-UZLBHIALSA-N 465.706 0.838 50 20 JCGD Nc1ncc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)s1 1807371503 VQVVSSREASDABM-MAUKXSAKSA-N 451.317 0.434 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ccc2nc(CO)[nH]c2c1 1809113981 VCIILVPGEVJRIP-DVECYGJZSA-N 499.336 0.763 50 20 JCGD Cc1cc2nnc(C(=O)N3CCC4(CCCN(C(=O)c5ccc(B(O)O)cc5)C4)CC3)c(C)n2n1 1809972045 LBSYAUPMGPAKKN-UHFFFAOYSA-N 476.346 0.580 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc2c(c1)CNC2=O 1810037439 SHORKEMRQCNTHH-WMZHIEFXSA-N 484.321 0.638 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCN2CCCC2)[C@H]1c1cccnc1 1814266159 LBWMABUPTPSXDK-PGRDOPGGSA-N 465.558 0.886 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cc3cccnn3n2)[nH]n1)c1ccc(B(O)O)cc1 1817471977 AFNYDUZADLMSJQ-LJQANCHMSA-N 459.275 0.752 50 20 JCGD CN1CCN(C2(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)c4ccc(B(O)O)cc4)n[nH]3)CC2)CC1 1817472333 GDXICYYGXUOYCI-HXUWFJFHSA-N 480.378 0.175 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817472803 YLOPGUQOKSICMP-LJQANCHMSA-N 461.287 0.808 50 20 JCGD CC(C)n1cnc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n1 1817475621 WGLHSULOUKBQKQ-QGZVFWFLSA-N 451.296 0.882 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc[n+]([O-])cc2)[nH]n1 1819403587 VOXGOBKMYMBSGP-QGZVFWFLSA-N 450.459 0.661 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)C2CCN(S(C)(=O)=O)CC2)[nH]n1 1822416072 MGHQDYFGHUMBET-QGZVFWFLSA-N 497.622 0.446 50 20 JCGD COC(=O)CSCC(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826083027 IMCGDIFWVJERNT-LLVKDONJSA-N 457.578 0.334 50 20 JCGD Cn1cccc1C(=O)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1826995521 GNZKYHJKXZTIMF-CQSZACIVSA-N 452.301 0.270 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827055016 NVVKLVSKZFDLKP-FGZHOGPDSA-N 457.380 0.905 50 20 JCGD Cn1cc(CCC(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)cn1 1827055170 UNUVPFXUTWSJOT-JOCHJYFZSA-N 452.364 0.966 50 20 JCGD C[C@@H](Cn1cncn1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1829052827 BNUWWKXRHBXMIB-JXFKEZNVSA-N 468.562 0.846 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C13CC(C(F)(F)F)(C1)C3)CCO2 1831706029 QXLIJQIWDWWXDJ-CBNMVNINSA-N 497.474 0.488 50 20 JCGD Cc1nn2cc(CC(=O)N3CCC(N4CCC(NC(=O)[C@H](O)CCl)CC4)CC3)nc2s1 1833308599 WLQHVSHHPOPEQH-QGZVFWFLSA-N 469.011 0.813 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3ON=C(c4ccccc4)O3)CC2)CC1)[C@H](O)CCl 1833310091 HVJLLVATSRGDPU-GCJKJVERSA-N 464.950 0.892 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccnn1C)CCO2 1834236333 WDTXOEGKWWREJQ-QFIPXVFZSA-N 487.469 0.637 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCc4nc[nH]c4C3)C2)C1 1834826736 UUMHIUOIDMLFMJ-LIRRHRJNSA-N 455.353 0.756 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3c(F)ccc(Cl)c3F)C2)C1 1835934140 MFZIPDDAMMLTKZ-JOCHJYFZSA-N 494.687 0.682 50 20 JCGD O=C(C[C@H]1C[C@@H]2CC[C@H]1C2)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939976 RIPSRFXMTCXNRO-DUFJIPPSSA-N 456.348 0.263 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939990 RPMRGCSXCBARJU-KBMIEXCESA-N 466.343 0.315 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1837459812 XKQZJEXZLQRZBS-HXUWFJFHSA-N 496.446 0.416 50 20 JCGD Cc1ccc(F)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459918 OXYNFEAUFTWATD-HSZRJFAPSA-N 471.489 0.516 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3CC4(CCC4)C3)C2)C1 1837461290 SPAJJQIYMNTQFF-HSZRJFAPSA-N 457.531 0.335 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CCOC[C@@]4(CN(C(=O)CO[Si](C)(C)C)CCO4)C3)ccc21 1837713312 VKPXYACZHOMSGP-HSZRJFAPSA-N 490.633 0.799 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](C)CBr)C3)C2)nn1C 1838831885 KXNZTOQBYKWRIK-FZKQIMNGSA-N 459.341 0.530 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccncc3=O)C2)C1 1839744081 NUYQCMZXVOXQHX-CIOPSUNISA-N 499.474 0.585 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](C)Br)CCO2)C1 1840037392 ZDPJKXONMOGWTG-MFCZKXCZSA-N 473.364 0.982 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)[S@](=O)c3ccccc3)C2)C1 1840155555 DZKLBLSOFSIDPK-ZGTQFASQSA-N 472.991 0.893 50 20 JCGD C[C@@H](Cc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185229 MQIPDGHZIQDHDT-MBSDFSHPSA-N 461.563 0.090 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)cc(F)c3)C2)C1 1840185754 WUXXNLRVPMEQJI-OAQYLSRUSA-N 454.474 0.408 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1840890053 UUJWWRAGCGUTGU-KOSHJBKYSA-N 452.316 0.240 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012596 FDPIYDUFECBJBA-SFHVURJKSA-N 459.352 0.877 50 20 JCGD O=C1NC(=O)[C@H](CC(=O)N2CC3(CCCN3C(=O)[C@@H](Br)Cc3ccccc3)C2)N1 1845940287 GZHVDVDXDSNTFY-GJZGRUSLSA-N 463.332 0.794 50 20 JCGD COC(=O)N(CC(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1)Cc1ccccc1 1846385824 AYIWTHMTKWGOQY-UHFFFAOYSA-N 459.547 0.831 50 20 JCGD CCS(=O)(=O)CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1847786915 GZQXQCCXIXLNFI-HOTGVXAUSA-N 453.473 0.770 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)c1 10158739 PZQYQBPVFJXZHK-UHFFFAOYSA-N 488.526 0.231 50 20 JCGD CCOc1cc(C(=O)NNC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)cc(OCC)c1OCC 15792967 WNBGWOUUWCBOLG-UHFFFAOYSA-N 488.501 0.091 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc3c(c2)OCCO3)C1 728203658 ZRKXDPXBYLTSOS-OAHLLOKOSA-N 463.516 0.660 50 20 JCGD Cc1sc2nc(CS[C@H](C)C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)nc(O)c2c1C 729276363 DEDGEIPHTOXREI-WCBMZHEXSA-N 461.591 0.721 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)C2(S(=O)(=O)c3ccccc3)CC2)c1 731341689 PVTNALWPDKBRQE-UHFFFAOYSA-N 451.526 0.704 50 20 JCGD O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NNC(=O)[C@@H]1CCS(=O)(=O)C1 743844943 BPQBXQWHVICPSO-CQSZACIVSA-N 458.562 0.001 50 20 JCGD COc1ccc2c(c1)OC[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)C2 747366925 JIVLNVLCLHAXNB-QGZVFWFLSA-N 475.523 0.728 50 20 JCGD O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)C(=O)N1CCCC1 748247381 MXGKPMCAGMGPIF-UHFFFAOYSA-N 450.439 0.534 50 20 JCGD O=C(NNC(=O)[C@H]1CCCN1C(=O)c1ccc(Br)cc1)N[C@@H]1CCS(=O)(=O)C1 749583666 SWUGCMLBDVNCGU-ZIAGYGMSSA-N 473.349 0.571 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)c(Br)c1 751283514 XEDRKKMVCUSDRL-UHFFFAOYSA-N 474.289 0.958 50 20 JCGD Cc1c(/C=C(/C#N)C(=O)OCC(=O)c2c(N)n(CC(C)C)c(=O)n(C)c2=O)cc(C#N)n1C 809301223 FTUCGABWLWUDEV-UUASQNMZSA-N 452.471 0.637 50 20 JCGD CSCC[C@H](NC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)C(=O)NNc1ncccn1 913044243 DLYBDJPHVRCHIK-KRWDZBQOSA-N 494.599 0.492 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 913416681 ODZZUDHRKIDLND-HNNXBMFYSA-N 470.301 0.715 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCN(Cc3ccccc3)CC2)c1 915902521 WITADBFISUWZHM-UHFFFAOYSA-N 459.572 0.852 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCNc3ccc(C#N)cn3)nc2)CC1 916520367 HJNSSLCVOKPMBJ-UHFFFAOYSA-N 459.536 0.023 50 20 JCGD COc1cc(CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)ccc1OCCO 918228068 GCYWOTBMGBIOAM-UHFFFAOYSA-N 492.554 0.995 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCc3ccc([N+](=O)[O-])cc3)nc2)CC1 919780836 QBIAXZFJYBCIGL-UHFFFAOYSA-N 463.520 0.795 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)[C@@H]3[C@H]4Sc5ccccc5[C@@H]43)C2)C1 1779045510 FZJLAVVARLHDHF-XBJMDHIQSA-N 464.352 0.698 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)nc2nccn12 1779374146 DHGPQTBKOFYVMA-NTKDMRAZSA-N 492.540 0.478 50 20 JCGD COC(=O)C1(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)CC1 1780969403 ZTJLUKPGKNLMAI-QHCPKHFHSA-N 487.557 0.116 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969454 MMGYEOKKVRIZGC-GBXCKJPGSA-N 488.589 0.077 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCO[C@@]4(CCN(C(=O)[C@H](F)Br)C4)C3)cc21 1781329881 MMVKFMPVZQMXMV-SUMWQHHRSA-N 458.288 0.151 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)C1 1782468662 BFDHPNSUKIWFEV-XKGFGPFHSA-N 453.971 0.988 50 20 JCGD O=C(Cn1cnnn1)N1CCO[C@@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783021728 AFHZGDRWSJLHAV-APWZRJJASA-N 463.336 0.509 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1783355141 LEYDZYIBGAOBLR-XLIONFOSSA-N 495.411 0.686 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(OC3CCOCC3)n1)CCO2 1783934456 AIFRWBWFKIWPJP-XMMPIXPASA-N 489.573 0.456 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@]13C[C@@H]1CCN3C(=O)OC(C)(C)C)CCO2 1783937618 WDFRBARZUZXDMU-DPSWKAHMSA-N 493.605 0.589 50 20 JCGD CC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C[C@@H]21 1783959091 SENZHGZEVCQQFV-HAGHYFMRSA-N 461.563 0.083 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnc(F)c3)[C@H]2C1 1784737009 KZXNPLZALNYAPE-JZKQFEGJSA-N 456.478 0.948 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1787489609 VWVDNWQWFVSIGA-UGUYLWEFSA-N 452.581 0.296 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccncc3O)[C@H]2C1)NC(=O)NCc1ccccc1 1788825347 GOJOKBUKTFHJGQ-VCOUNFBDSA-N 496.568 0.727 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc(Cl)cc(Cl)n1 1789050682 WSBGDBOPJBJCJW-OWQGQXMQSA-N 478.141 0.975 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccccc3=O)C[C@@H]21 1789222285 NXOKDFOKYGSTCG-LRQRDZAKSA-N 498.492 0.975 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnn(C)c3)C[C@@H]21)NC(=O)NCc1ccccc1 1789726599 CSOBBIMIYUZJAY-FKBYEOEOSA-N 497.600 0.289 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(F)(F)c3ccco3)[C@H]2C1 1790615672 IRCUVRYSEKOWGZ-RCBQFDQVSA-N 463.441 0.663 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C[C@@H]21 1790961411 JYXCRVSIQJDLSM-MEDZGJRSSA-N 489.392 0.605 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CC(=O)N(C4CCCC4)C3)C[C@@H]21 1791287922 DEWVRNLNKRZZFU-ZULIPRJHSA-N 477.606 0.130 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]4C3)cnc2s1 1791291092 LUIMXGJKJQEWBT-XIRDDKMYSA-N 490.586 0.031 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(F)cc3F)C[C@@H]21 1791293365 ZNRJVPKYRWVSHE-IEZWGBDMSA-N 452.502 0.860 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1[C@@H](O)CCN1C(=O)OCc1ccccc1)C2)[C@H](F)Cl 1796368528 LXCHEMDFRZGAAU-QSMSVPEVSA-N 483.924 0.882 50 20 JCGD Cc1cn2c(=O)c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Br)C4)cnc2s1 1797063743 YDYVAKDRLCPEBH-LFSVMHDDSA-N 473.324 0.958 50 20 JCGD Cc1csc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797749787 SMLZUFRKSNMTMR-YVWYUNDQSA-N 457.556 0.891 50 20 JCGD COC(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798523128 SKBRRRRWEFEABA-IVWMJMPLSA-N 464.431 0.079 50 20 JCGD Cn1c(=O)n(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)c2ccccc21 1799347339 NEWRFKXSWICFKR-LZDSYCOUSA-N 469.311 0.620 50 20 JCGD N#Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)ccc1Br 1799708341 SKMOWKIDCNPZNM-XEMDLRDOSA-N 498.142 0.518 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(O)c([N+](=O)[O-])c1 1800342930 VDIKVVJFLPQWGU-BTTYYORXSA-N 454.443 0.865 50 20 JCGD COc1ccc(COCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1801107190 BVJFDBOQBQAGDU-FAQVEIGNSA-N 483.525 0.114 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)CCN2CCN(C)CC2)[C@@H]1c1cccnc1 1806918205 ZRGKJUXTTQMJMR-ZJOUEHCJSA-N 451.999 0.979 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373933 VHWFBCHQKLMGRY-OZOXKJRCSA-N 452.320 0.882 50 20 JCGD Cc1n[nH]c(C)c1CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807374033 WMPMPQUORAAEKW-XXBNENTESA-N 461.331 0.664 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc2nc(CO)[nH]c2c1 1809113988 VCIILVPGEVJRIP-YADARESESA-N 499.336 0.763 50 20 JCGD Cn1nc2c(c1C(=O)N1CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]1c1cccnc1)CCC2 1810306075 SIFUJPZYDJZCHG-IERDGZPVSA-N 488.552 0.936 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@H]1CCN(C(=O)c3cnccc3C(=O)NN)[C@H]1c1cccnc1)CCC2 1812225599 JUIOJLFDDADNCV-IERDGZPVSA-N 488.552 0.936 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(C(N)=O)cc2)[C@@H]1c1cccnc1 1813738126 NWPDPAAJZQIJRN-NQIIRXRSSA-N 487.520 0.812 50 20 JCGD O=C(CCc1cncnc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1815528853 DHHAUCVIGJEBMM-INIZCTEOSA-N 451.317 0.472 50 20 JCGD O=C(CNCP(=O)(O)O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1 1817235445 APAMHFWSMZKFSB-BXKDBHETSA-N 456.209 0.817 50 20 JCGD N[C@@H](CC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)c1cccnc1 1817471106 DTEDMWBCGCGPJQ-AZUAARDMSA-N 462.319 0.881 50 20 JCGD Cn1nc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)c2c1CCC2 1818471422 LTQIPUSFQBSTCV-CQSZACIVSA-N 465.344 0.585 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cn4cccnc4n3)sc2C1 1819025836 QONYMZOFBQGGBE-LLVKDONJSA-N 477.510 0.724 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc2cn[nH]c2cn1 1819232887 LKCBFNLTDQXLFE-LJQANCHMSA-N 459.275 0.981 50 20 JCGD Cc1cc(C(=O)NCC(=O)Nc2cc([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)[nH]n2)no1 1819468412 IKGTYAGNLGJPQR-MRXNPFEDSA-N 474.522 0.501 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1822415543 AEORMFAZOMMPSZ-MRXNPFEDSA-N 471.522 0.087 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnn4c3OCCC4)sc2C1 1824000367 YUPGVPSIGJOZKG-LLVKDONJSA-N 482.526 0.660 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)[C@H]1SC(=N)NC1=O 1827669978 XKCCORIPJDUPSC-GDIGMMSISA-N 486.403 0.402 50 20 JCGD CC(=O)N(C)[C@@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828926924 UGIDIFRCWALUBR-YWZLYKJASA-N 458.563 0.785 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(=O)n3O)C2)C1 1830535039 HFGGFKYONMXCAA-SCLBCKFNSA-N 458.309 0.187 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)C(=O)c3ccccc3)CCO2)C1 1831151321 ZQWKZWKQWOKDOA-GCJKJVERSA-N 467.950 0.469 50 20 JCGD O=C(CCn1c(=O)oc2ccccc21)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1832760261 GKDACLOIHVLYOS-XLIONFOSSA-N 455.870 0.975 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)C[C@@H]3CCCCO3)CC2)CC1 1833683486 QCVWKFLXQMSTEB-FQEVSTJZSA-N 451.612 0.890 50 20 JCGD Cc1nc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cs1 1834798041 XRGOXLMCDGNUOR-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H]3C[C@@]3(F)Cl)CC2)CC1)c1ccc(B(O)O)cc1 1834799027 KYJVHXOUXPQXFR-NQIIRXRSSA-N 451.735 0.476 50 20 JCGD COCCn1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCBr)CCO3)C2)n1 1834821371 GIQWFPPLKOOMAY-SFHVURJKSA-N 459.341 0.385 50 20 JCGD O=C(CCc1ccccc1)N1CCO[C@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1834837626 ZZHQTJCBBTYMGT-XMMPIXPASA-N 452.316 0.069 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(F)c3)CCO2)C1 1835024242 XXYROIDSTSGXOF-QHCPKHFHSA-N 471.489 0.137 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@@H](O)C(C)C)CC2)CC1 1835116453 PDVZXYRAPAVJJO-NTRYICDMSA-N 460.579 0.709 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccnc(Cl)n3)CC2)CC1 1835911715 IVTXHEOPCMXQRR-UHFFFAOYSA-N 465.986 0.688 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cnc4cc(Cl)ccn34)C2)C1 1835928415 OHLZSGOEWWSEGD-HSZRJFAPSA-N 498.732 0.051 50 20 JCGD Cc1nc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)c3ccc(B(O)O)cc3)CCO4)ccc2s1 1835930778 ZEJCMOLBEWVKKR-DEOSSOPVSA-N 495.366 0.668 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1F 1835931388 PVEUNNRLBJZKMV-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD O=C(/C=C/C1CCCCC1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939561 SWLFIHBKLGUQSR-HBRDYDSTSA-N 456.348 0.573 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939624 VXZJZRFABRJXDQ-RUZDIDTESA-N 482.342 0.376 50 20 JCGD O=C(C[C@@H]1C[C@@H]2CC[C@H]1C2)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835939974 RIPSRFXMTCXNRO-ARZBDZIHSA-N 456.348 0.263 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1 1836866976 TZOFVBHUOIISMD-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1csc3c1CCCC3)CCO2 1836898151 BTQMPLFAHXGTDM-DEOSSOPVSA-N 484.383 0.691 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1837627354 SPWCVAFISTWIIK-LIRRHRJNSA-N 469.336 0.508 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)CN(CCO)CCO)CC2)CC1 1838638889 PGRPTIIGZHWWCG-FQEVSTJZSA-N 468.422 0.508 50 20 JCGD Cc1n[nH]cc1C(=O)N1CCOC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1839054076 GCPSHPDONYUGEZ-DEOSSOPVSA-N 499.572 0.134 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c(=O)[nH]c1C 1839197801 ISZAPTFBZKCGOZ-DYVFJYSZSA-N 461.288 0.147 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839683334 YRSVCXZTEHPFAX-QKDGVTOWSA-N 493.517 0.138 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1839964950 JTXKKISTMCAUPK-IFXJQAMLSA-N 466.336 0.973 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Br)CC)CCO2)C1 1839965496 ZSWBLWDKYGTGCC-QWQRMKEZSA-N 463.373 0.324 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](NC(C)=O)c3ccc(F)cc3)C2)C1 1840154275 RHCKMJDFMSMLAN-IPJJNNNSSA-N 485.940 0.713 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@H]3c3ccc(F)cc3)C2)C1 1840183286 XDRBFRZGAODQPT-MZLICYQSSA-N 476.549 0.759 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC[C@H](C(F)(F)F)CC1)CCO2 1840821865 UWEFNMKSUUJYNI-ZJBJCVSYSA-N 498.307 0.805 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCCC34CN(C(=O)[C@H](F)Br)C4)n2)CCCN1 1842305181 WPPQKIBFGVCNKC-INIZCTEOSA-N 468.327 0.915 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C1 1843325365 RPDVZAGVTGLVTP-MMDHUZEPSA-N 476.534 0.209 50 20 JCGD CC(=O)N(C)[C@H](C)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038757 PXPYCLNZCYJIHQ-QGZVFWFLSA-N 458.563 0.403 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cn[nH]c1)NC(=O)NCc1ccccc1 1848193179 YNPFRIHUNGFSQV-PMACEKPBSA-N 453.547 0.890 50 20 JCGD CCn1c(=O)n(CC(=O)OCC(=O)NNC(=O)c2ccc(OC)c(OC)c2)c2ccccc21 12929868 DZFBWLXWEOCMGA-UHFFFAOYSA-N 456.455 0.845 50 20 JCGD CN1C(=O)Cc2cc(S(=O)(=O)NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)ccc21 12969054 XCCQWHJAUBYJKU-UHFFFAOYSA-N 452.514 0.079 50 20 JCGD COc1ccc(OC)c(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3ccc(F)cc3)CC2)c1 15515891 SVBKEWZGSMBYIZ-UHFFFAOYSA-N 480.518 0.610 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3COc4ccccc4O3)CC2)cn1C 109583258 MRXFNLXGEAAOQF-KRWDZBQOSA-N 463.516 0.117 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCN(Cc2ccc3c(c2)OCCO3)CC1 725872945 SUPMSMFEWFGYHX-UHFFFAOYSA-N 459.528 0.808 50 20 JCGD 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CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012756 NWLIMTNYNIMSBL-SAABIXHNSA-N 457.336 0.487 50 20 JCGD C[C@H]1[C@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CCN1C(=O)OC(C)(C)C 1843012861 NPKNJFARAWUGLY-QFBILLFUSA-N 471.363 0.829 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)c2cc3n(n2)CCCNC3=O)C1 1843998997 QDKJHKWNBPTPED-UHFFFAOYSA-N 496.480 0.981 50 20 JCGD CC[C@@H](CC(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)NC(=O)OC(C)(C)C 1845234430 KJBFKCWEQKOGKU-SFHVURJKSA-N 459.352 0.877 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H]1CC=CCC1)c(=O)n2Cc1ccccc1 10161310 NSTHMMKEFNGCOC-QGZVFWFLSA-N 450.499 0.932 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2n[nH]c(=O)c3ccccc23)C1 16231348 WMNMUCASIYRXDD-ZDUSSCGKSA-N 474.499 0.390 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2cc([N+](=O)[O-])cc3c2OCCO3)c1 727363897 HTDGRHAFNWUFJS-UHFFFAOYSA-N 450.429 0.691 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)c3cc(F)ccc3Br)n(C)c2n(C)c1=O 728546292 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C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N)s3)C[C@@H]21 1787508836 LHGVXNKOIODQGW-RJSLJBRQSA-N 459.532 0.453 50 20 JCGD Cc1ncccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788611712 TUKRECBHQWDZJZ-YYWHXJBOSA-N 466.542 0.615 50 20 JCGD CC(C)(C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21)c1ccccn1 1791485613 PIGWWPSHGNUGGK-SNRMKQJTSA-N 466.542 0.651 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792973118 ZTHVOMJCWIRWBO-WHDKQWSOSA-N 487.981 0.059 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(S(C)(=O)=O)CC1 1797140615 VZGMJYKCOHXKFH-MHEUCROKSA-N 466.398 0.031 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(C)CCCN1)C2 1798524562 GGANNMMSTLDWJQ-DAMNHTQYSA-N 460.487 0.865 50 20 JCGD C[C@](Cl)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1799279622 SCCCNDLNNXPAIM-TYYYEBLRSA-N 461.302 0.582 50 20 JCGD 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NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)COc2cccnc2)[C@H]1c1cccnc1 1804336851 DPLXNBFHKHLQTE-HTAPYJJXSA-N 475.509 0.874 50 20 JCGD CCOc1cnc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1804918589 YSLYTZWZLFDJIW-IERDGZPVSA-N 490.524 0.902 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807361241 HURWZTPISIAHSH-DZFGPLHGSA-N 479.371 0.108 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C(=O)c2ccccc2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365577 VQBZBMZURUEJAI-RBBKRZOGSA-N 457.295 0.964 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)[C@@H]2C=CCN2)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807454686 WITNETYWIOOSDM-GPXNEJASSA-N 491.596 0.962 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1 1810294868 OZEOCMVKJBDWKA-FDDCHVKYSA-N 493.568 0.802 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813071579 UVOWTFBSXYTLNV-OXQOHEQNSA-N 457.535 0.516 50 20 JCGD CN1CCCn2nc(C(=O)N3CCCC[C@@H]3c3cc(NC(=O)c4ccc(B(O)O)cc4)n[nH]3)cc2C1 1817474259 CATRWXWCSWSNGE-OAQYLSRUSA-N 491.361 0.741 50 20 JCGD CC[C@@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)[nH]n1 1820854972 TZHPUHLZRBOUAQ-TZMCWYRMSA-N 490.952 0.867 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cnn4c3CCC4)sc2C1)c1ccc(B(O)O)cc1 1824043412 BRPWOUOCCLAFRZ-AWEZNQCLSA-N 451.317 0.505 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)CNC(=O)C(F)(F)F)sc2C1 1826143098 YAEWXNPSVNJBTI-QXBUHNKDSA-N 499.475 0.868 50 20 JCGD COCCn1ccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)n1 1827824712 AZOSQUSHAJLFJY-JOCHJYFZSA-N 468.363 0.756 50 20 JCGD O=C1OCCN1CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1828384601 BJMGSYADJOZQIX-HXUWFJFHSA-N 457.336 0.442 50 20 JCGD C[C@H](CC(N)=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1828593266 ACZRIUOKXFWQMQ-JTUHZDRVSA-N 494.976 0.550 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1830539099 AZABNYBHCBJNJH-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD Cc1cc(Br)cnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830724014 BVHOQMYFLFDCOC-RDTXWAMCSA-N 476.755 0.822 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830724771 BXVQFVIBHRTVNK-SSKFGXFMSA-N 489.997 0.832 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN(C)C(=O)c3ccccc3)CCO2)C1 1831151323 ZQWKZWKQWOKDOA-XMSQKQJNSA-N 467.950 0.469 50 20 JCGD O=C(c1cnc(-c2ccccn2)nc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833289771 ZPPVCBBEGPPRSB-UWJYYQICSA-N 461.906 0.208 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1 1833826766 WLRUADUKLFIWAF-ACJLOTCBSA-N 457.325 0.856 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccns3)CC2)CC1 1834052898 SIPQNHKRAVFXHQ-UHFFFAOYSA-N 457.560 0.641 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccccn3)CC2)CC1)c1ccc(B(O)O)cc1 1834797952 OVZNOSWOTIELCO-UHFFFAOYSA-N 450.348 0.189 50 20 JCGD Cc1ncsc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801302 YFBRIQFOTJFFQX-UHFFFAOYSA-N 456.377 0.630 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCC(=O)N3CCCC3)CC2)CC1 1835737161 QQCFEHLFKCKOFV-UHFFFAOYSA-N 499.616 0.273 50 20 JCGD Cc1cccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835934285 TUPUUWAJTHJFPF-RUZDIDTESA-N 466.343 0.378 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cnc4cc(Cl)ccn34)C2)C1 1835935688 MIDZYOBZHDGLEU-QHCPKHFHSA-N 498.732 0.051 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)n3ccnn3)CC2)CC1 1836513688 NLVQHETWDMBYIK-AKBIMGJMSA-N 483.577 0.545 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(C)CN(C(=O)OC(C)(C)C)C1)CCO2 1836726993 WCBWOSZAQWRYHK-ZHRRBRCNSA-N 489.997 0.954 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2 1837297371 SRDYJYYIHCRZGR-ZLGUVYLKSA-N 467.906 0.431 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(S(C)(=O)=O)cn3)C2)C1 1837712178 HHNKIDUVJDQLKK-FQEVSTJZSA-N 485.635 0.407 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837943287 AIWDULVUPDABSQ-KZULUSFZSA-N 471.308 0.276 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)CC2)CC1 1838401104 YRMKEEJDQPNRCU-RBUKOAKNSA-N 476.954 0.734 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)N3CCN(C)CC3)CCO2)C1 1839105697 GQCYLLHHXNRRIK-SQGPQFPESA-N 475.428 0.252 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1839151051 GWBLJRXYLVPDGY-ZWKOTPCHSA-N 461.302 0.481 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)Br)C2)C1 1839686666 TZBNRXYRWNLHQO-OGHNNQOOSA-N 451.314 0.788 50 20 JCGD CN(C)[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)c1ccc(Cl)cc1 1839729324 CHCLFVUNGHPFDS-LVCYWYKZSA-N 474.385 0.999 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)C1 1839962516 IQOFZHNYOBMNSD-YGRLFVJLSA-N 493.248 0.972 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1840031616 XCZYGDPPJCWDAG-UGSOOPFHSA-N 490.376 0.339 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(S(C)(=O)=O)c3)C2)C1 1840149462 PKBXLQMPISCUOP-YLJYHZDGSA-N 474.963 0.414 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)CNC4=O)C2)C1 1840153071 CAYYWXCWJDZOBL-UTKZUKDTSA-N 451.907 0.254 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3ccc(C)cc3)C2)C1 1840156835 VNEYLCARSTZPEH-GCJKJVERSA-N 467.950 0.435 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c1F 1842851874 DNLZEBSYPCUOHH-UHFFFAOYSA-N 460.242 0.793 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012791 PHDWENORJVQDHQ-UHFFFAOYSA-N 457.336 0.440 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CCN2Cc3ccccc3C2=O)C1 1843871322 KHNHQZKCXFQZSE-UHFFFAOYSA-N 462.510 0.548 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264251 YIKDGCJDAFIVQD-KRWDZBQOSA-N 488.545 0.138 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1 1845038387 XKXCSQIPARPOBQ-IBGZPJMESA-N 458.563 0.451 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cnncc1C(=O)O)C2)NC(=O)NCc1ccccc1 1845038880 CMYNKQVGQLADDJ-UHFFFAOYSA-N 481.513 0.338 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc(F)c(F)c1)NNC(=O)c1nn(-c2ccccc2)cc1O 10159994 NZGYKFWIUZNNMY-UHFFFAOYSA-N 465.438 0.986 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)c1ccccn1 17329278 CARUIRWAJJWORU-OAHLLOKOSA-N 474.948 0.278 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cccc(C#N)c1)c(=O)n2Cc1ccccc1 104855415 LNENFSXXCPFEQC-UHFFFAOYSA-N 471.477 0.761 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)NCc1ccccc1S(=O)(=O)N1CCCCC1 725871417 BKQNQUQIQDWWHL-UHFFFAOYSA-N 463.516 0.715 50 20 JCGD NC(=O)NCCC(=O)NNC(=O)CCN1CCN(C(c2ccccc2)c2ccccc2)CC1 726021526 RHHBPKVLUOFBFH-UHFFFAOYSA-N 452.559 0.990 50 20 JCGD CCS(=O)(=O)CCOc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728854071 KSQYHGZBKKRXKW-UHFFFAOYSA-N 497.599 0.516 50 20 JCGD Cc1ccc(S(=O)(=O)NCc2ccccc2)cc1C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O 729276193 YTXVXOHSRYHFEB-AWEZNQCLSA-N 468.557 0.172 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)c2cnc3c(c2)c(=O)n(C)c(=O)n3C)cc1OC 862093596 ZPARKWPAZWXCLR-UHFFFAOYSA-N 455.471 0.895 50 20 JCGD COc1nc(N)nc(N2CCCC2)c1C=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 863950998 ZUYXVWQFHXPMJN-UHFFFAOYSA-N 489.558 0.452 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc3oc(=O)ccc3c2)c1 903901272 FDTWAJVFDGLQBK-UHFFFAOYSA-N 451.482 0.667 50 20 JCGD Cn1cnc(S(=O)(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1Cl 914563258 WUZNKHMLPYRJSW-UHFFFAOYSA-N 491.979 0.037 50 20 JCGD O=C(NCc1ccc2c(c1)OCO2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915879325 VEXQRSXAWFNCGL-UHFFFAOYSA-N 462.484 0.580 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 915921662 CEJIGMBPMLPPKU-UHFFFAOYSA-N 478.527 0.869 50 20 JCGD Cn1nc(C(=O)NNC(=O)[C@H]2CCCCN2S(=O)(=O)c2cccs2)c2ccccc2c1=O 916123886 KEEPQYXWSZOCIC-OAHLLOKOSA-N 475.552 0.999 50 20 JCGD COC[C@@H](C)n1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)N2CCN(CC(=O)N(C)C)CC2)c1C 917230981 QJXQLDCIALPVGH-AGKWGAAGSA-N 473.574 0.995 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919885827 RXINDEQKRYXGSV-GJZGRUSLSA-N 472.589 0.689 50 20 JCGD CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2[N+](=O)[O-])CC1 920290755 BASCETXTJOKMTH-UHFFFAOYSA-N 479.457 0.314 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)[C@H](C)OC[C@H]1CCCO1)N(S(C)(=O)=O)CC2 921074239 NGEOWSYWDQBQKK-LESCRADOSA-N 499.586 0.684 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1 1778947218 DHOBSKPCGCIVKY-HXUWFJFHSA-N 463.926 0.199 50 20 JCGD Cc1nccnc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779873711 ZYHCSZSWIQZLKW-VGOFRKELSA-N 453.503 0.225 50 20 JCGD Cc1nc(F)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779902959 XSNSJPSZWAPZSN-AUSIDOKSSA-N 455.295 0.650 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN(CCO)CCO)C2 1780716653 LEOJRLDZSLHBQL-AYOQOUSVSA-N 454.395 0.023 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781052921 YEGPDALJCPSDQX-KTTGSAFNSA-N 495.341 0.264 50 20 JCGD CCOC(=O)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1781138777 OJUHXYYGWPWSMT-ATIYNZHBSA-N 494.353 0.984 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1781229678 HPJHJRAEMMTGQS-JCGIZDLHSA-N 453.319 0.547 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781334633 YVHAEJUMNSEQHN-JCGVRSQUSA-N 482.347 0.783 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)C1 1782210542 YYCDWOMZQFKUKU-VOLVWJTLSA-N 466.579 0.463 50 20 JCGD Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c(O)c1 1782898738 CICDTIOWRSQBPZ-ZJSXRUAMSA-N 452.316 0.822 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935353 NIYXYXGTSZOXHD-HJPURHCSSA-N 477.537 0.147 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784093538 AJSCTJMTIWNANJ-RBZJEDDUSA-N 491.969 0.022 50 20 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CC(C)(C)OC(=O)N1CCC[C@@]1(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1793645999 GSIZJHQIWIFNFL-CKBPBPHLSA-N 459.971 0.965 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1CCOC1=O)C2 1793879734 CIROIBFLGXWIPZ-IVSAIRAKSA-N 488.969 0.550 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(=O)oc1)NC(=O)NCc1ccccc1 1794996113 ZQYDVOROADOIED-HATOLVCRSA-N 483.525 0.189 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3nncn3c1)C2 1796442137 SDOGSSHEZXQEJD-WVNFENISSA-N 464.486 0.067 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)C2 1796445535 CTJLEAZRKNRTST-CRDHYWRUSA-N 467.530 0.238 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1799825936 UGLCZMVELXKMIM-OPMZPASUSA-N 452.316 0.509 50 20 JCGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)[S@@](=O)c1ccccc1 1800214228 IOADNRIATOEVAL-DEAZOFBASA-N 485.566 0.085 50 20 JCGD 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O=C(NC[C@H]1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807376347 VLBZWGIERJQLKO-DNVCBOLYSA-N 464.247 0.026 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)[C@@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1 1807928484 PODZLMVJFJSXQF-GTAWCEEGSA-N 451.999 0.977 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)C#CC(=O)O)[C@H]1c1cccnc1 1812878824 MHKBCSDQWNFYIL-MSMHQLFBSA-N 450.455 0.309 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)cn1 1813069720 AXPLPNTULNISMX-HTAPYJJXSA-N 469.546 0.963 50 20 JCGD Cc1nn(C)c(C(=O)N2CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)c1F 1813071856 YSYWSMOTYHPINB-OXJNMPFZSA-N 459.526 0.955 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CN2C(=O)CSC2=S)[C@H]1c1cccnc1 1813073056 FLMRSMOSIMXMKX-YWZLYKJASA-N 492.627 0.321 50 20 JCGD O=C(CCCn1ccnc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813352325 UNEUNTNYRCXMAL-NFBKMPQASA-N 461.331 0.758 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](N)Cc3cscn3)sc2C1 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C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1830535085 IQMXDJQXQNIFTB-DYVFJYSZSA-N 474.312 0.279 50 20 JCGD Cn1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(C(F)(F)F)c1 1830727939 LDHVKSSVPYATAF-RHSMWYFYSA-N 453.845 0.714 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)n(-c2ccccc2)n1 1830727946 LGVMJIHEEJBXFX-DENIHFKCSA-N 462.934 0.850 50 20 JCGD CN1CCN(CC(=O)N2CCC([C@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1 1831873680 ZPXXXDMBEDXMDM-HXUWFJFHSA-N 450.628 0.227 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832878352 BBJRDQYGDQXPCK-NRFANRHFSA-N 466.611 0.443 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnn(C(C)(C)C)c1)CCO2 1833454444 MGYVXFYRSSFSAA-VNSNFZHPSA-N 499.572 0.842 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C(C)=O)[nH]n3)CCO2)C1 1833826771 WLRUADUKLFIWAF-SCLBCKFNSA-N 457.325 0.856 50 20 JCGD Cc1nc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)s1 1834075103 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1836718707 ANZKPBCAFHFAQE-NRFANRHFSA-N 464.994 0.982 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)CCO2 1837292698 JVAAKJHHOCVFDV-PMACEKPBSA-N 482.331 0.963 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1ON=C(c3ccccc3)O1)CCO2 1837297370 SRDYJYYIHCRZGR-ORYQWCPZSA-N 467.906 0.431 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1 1837384962 MRHATQICXANFHM-QWQRMKEZSA-N 463.373 0.324 50 20 JCGD CCCc1onc(C)c1C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457749 PINQIIMVXIJGIS-QHCPKHFHSA-N 486.529 0.318 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ccncc34)C2)C1 1837459373 DQGICOIUFLPEGQ-VWLOTQADSA-N 490.520 0.617 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/C(=O)NCc3ccco3)CCO2)C1 1837637283 ZLELPVMBZBGXPO-HCIHWQEHSA-N 469.922 0.162 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837677893 IRQVVOQQAILPRK-SUYBPPKGSA-N 452.321 0.438 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)n1ccccc1=O 1837689087 MZQXQMFUVGIIFG-XUWXXGDYSA-N 460.300 0.556 50 20 JCGD O=C(c1ccnc(Cl)n1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1837924427 AUBJEXMTLDMENE-NHYWBVRUSA-N 451.680 0.891 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1838386338 LKNHIBTTYJDWJS-FQEVSTJZSA-N 473.574 0.870 50 20 JCGD O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838458080 NVJCWNVCIJATDX-WZONZLPQSA-N 475.929 0.313 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839106349 BWIBTFHNFBFJEW-WIYYLYMNSA-N 457.015 0.630 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1N(C)C 1839116309 YTHVLXNOZNBLJZ-DEOSSOPVSA-N 491.589 0.204 50 20 JCGD COc1cc(C)c(C)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1839465206 HKCCTRPXMPFHMH-DEOSSOPVSA-N 476.574 0.755 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc3c(O)cccc13)CCO2 1839606182 JFJJLMBTRJSNPM-VWLOTQADSA-N 491.309 0.004 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn(C)c3=O)C2)C1 1839963004 XEPVAZAKFVMIBP-KXBFYZLASA-N 456.337 0.629 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C#CC3(O)CCCCC3)C2)C1 1840033723 NZQMXZZDPCJZQR-JXFKEZNVSA-N 457.365 0.925 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)nc1 1840182733 ROEGATYZEFZXKW-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C34CC(c5ccccc5)(C3)C4)C2)C1 1840187204 MFWJRLXAAPTQEA-WNMGUVTHSA-N 484.597 0.938 50 20 JCGD CCOCC(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C1 1843428855 UMPRYYPTBHHLIU-IBGZPJMESA-N 489.378 0.042 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCCN1C(=O)c2ccccc2C1=O 1848088395 NHXVRIPPKAFBBH-PMACEKPBSA-N 490.520 0.577 50 20 JCGD CCC1CCC2(CC1)NC(=O)N(CC(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1)C2=O 16593797 CDSYJLNWLPLDPB-UHFFFAOYSA-N 479.559 0.589 50 20 JCGD CCn1c(CCC(=O)NNC(=O)c2ccccn2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 17328753 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477.543 0.385 50 20 JCGD COc1cccc(C(=O)N2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)c1 918775703 AQLMQWWOUOYDDS-UHFFFAOYSA-N 474.543 0.801 50 20 JCGD Cn1nc(C(=O)NNC(=O)CN2C(=O)Cn3c(cc4ccccc43)C2=O)c2ccccc2c1=O 920276169 PVMBPTJXKJMRNL-UHFFFAOYSA-N 458.434 0.332 50 20 JCGD CCc1ncc(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC)n(Cc3ccccc3)c2=O)s1 920851136 IUUCDHVIHITBNJ-UHFFFAOYSA-N 481.538 0.908 50 20 JCGD C[C@H](OC[C@@H]1CCCCO1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 921146163 LUTDDOCZDCQCMN-RDJZCZTQSA-N 455.533 0.443 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778055353 ORZAVSVHJQEXAJ-JOCHJYFZSA-N 484.589 0.866 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncnn4c3)C2)C1 1778739949 WEKZOIJSTZESDN-QVGKIPNLSA-N 464.486 0.307 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(CO)o3)C2)C1)NC(=O)NCc1ccccc1 1779549008 HALSTMFOKZFPEE-DEOSSOPVSA-N 485.541 0.562 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccn(C(F)F)n2)C1 1779758549 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COc1ccc(F)cc1CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1784081788 QJRGVMRVHMOUFM-HSZRJFAPSA-N 456.279 0.200 50 20 JCGD CCc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cn1 1785881422 XDXNTWSNUKHTJO-YSSFQJQWSA-N 452.515 0.550 50 20 JCGD Cc1ncc(/C=C/C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)s1 1786981964 IJTUTCONTOCTLC-WMBCKCKVSA-N 455.345 0.438 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786983641 ONDKMDYBCWLLEY-QQOZLPODSA-N 451.332 0.234 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4sccn4c3)C[C@@H]21)c1cccc(B(O)O)c1 1786984374 JIQLRGRFVQVRIM-SNRMKQJTSA-N 453.329 0.588 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc2c1OCC2 1787813836 BWRJVUBZFHBDBS-YYWHXJBOSA-N 450.300 0.208 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)ncc1[N+](=O)[O-] 1788610171 HJZMEHPAILGUCQ-AXHNFQJDSA-N 483.485 0.204 50 20 JCGD Cc1nc2ccccn2c1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610231 LJVMJCUKQICDAG-SNRMKQJTSA-N 477.525 0.548 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CO[Si](C)(C)C)C[C@@H]32)no1 1788669617 GVYOKCDKYMZOJA-ZOBUZTSGSA-N 452.584 0.544 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(O)nn3)C[C@@H]21 1789220799 OLVLGHVSTYDPMX-AXHNFQJDSA-N 485.453 0.923 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCCS3(=O)=O)[C@H]2C1 1790750066 GSLQJUPDZDYYAC-SBJFKYEJSA-N 451.383 0.717 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(OC(F)F)cn3)C[C@@H]21 1791288531 AQWANSTZNNRLHF-QRTARXTBSA-N 469.489 0.649 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)[C@H](O)CCl)C3)[C@@H](O)C1 1792513885 IHKIIOZWQOVQFA-DBWAAGBOSA-N 459.971 0.842 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccn(Cc2ccc(F)cc2)c1=O 1794406460 QADBTSLBQITXJO-NBMJBFSESA-N 492.935 0.888 50 20 JCGD 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C#CCO[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O 1798521733 YGOMQYXSRQIQPG-NTNQKNOYSA-N 459.455 0.762 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(F)ccc1OC(F)(F)F 1798573142 RVMAYYLHKZVBNY-HBCWATKFSA-N 496.222 0.921 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1801457416 VZKZBKKQIHZDIM-PIBIMKELSA-N 497.600 0.688 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1C(=O)CSC1=S 1802107046 HYRVEZRNINRPID-SKILGCBUSA-N 454.401 0.673 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2=NN(C)C(=O)CC2)[C@@H]1c1cccnc1 1804123250 MERFIAAZHYZHNW-KKSFZXQISA-N 457.535 0.069 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)N2CCCC2)[C@@H]1c1cccnc1 1804153377 QMIJCDUWLNGALJ-MBSDFSHPSA-N 493.568 0.802 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)[C@H]1COc2ccccc2O1 1804196632 KBUDVSBZIJYIEG-WUMKDDEVSA-N 487.321 0.921 50 20 JCGD 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O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cnc3c(c2)CCNCC3)[nH]n1)c1ccc(B(O)O)cc1 1817476002 ZFXLPFGEZWNAQS-QFIPXVFZSA-N 488.357 0.792 50 20 JCGD C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1 1822185191 YMPJINPFLFCUNP-MWLCHTKSSA-N 452.246 0.910 50 20 JCGD Cc1nn(C)c(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)c1F 1826080714 UWXBYMXSEVSYBL-LLVKDONJSA-N 451.528 0.923 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H](C)n3cnnn3)sc2C1 1826977001 RAPXFVJKRSAZRG-IJTYQOOWSA-N 470.519 0.437 50 20 JCGD O=C(CCNC(=O)c1ccccc1)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1827964358 BVUVGCGPNJMBBJ-SFHVURJKSA-N 492.366 0.869 50 20 JCGD CC(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1830010659 NDZSXDRBMCLNFH-HRAATJIYSA-N 477.986 1.000 50 20 JCGD CC(=O)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)n[nH]1 1830535262 LBAKFWHKFXSFAL-SGTLLEGYSA-N 457.325 0.713 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830538717 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O=C(COc1ccc(O)cc1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833211006 RPWOXIHTZWLQQV-UHFFFAOYSA-N 481.358 0.336 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833263690 RDLHAVRLDPVUDZ-HNNXBMFYSA-N 480.212 0.583 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c[nH]1 1833379806 DGDKPCMUKYPDPD-DEOSSOPVSA-N 469.347 0.376 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3[nH]cc4c3CCC4)CC2)CC1)c1cccc(B(O)O)c1 1834801090 KPYYWRJIAWQPPP-UHFFFAOYSA-N 464.375 0.682 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3nnsc3C3CC3)CC2)CC1 1835210687 XSSKRCZPIJLLMF-UHFFFAOYSA-N 498.613 0.913 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cn4ncccc4n3)CC2)CC1 1835737799 BBEWGWAQLISWTI-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)ccc1C 1835931287 LGDYXYVOPQZJJZ-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1OC 1835939543 RXOKLBXHRKAGQY-VWLOTQADSA-N 498.341 0.076 50 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CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1781234655 OWTUKOKYUXSFLY-OCBCSQNSSA-N 454.351 0.896 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnc3ccc(F)cn23)C1 1781382499 RJRGZPJURSOSSK-NTKDMRAZSA-N 495.515 0.913 50 20 JCGD CC(C)N1CCC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)CC1 1782208971 DQCTVMAMUZQNKE-HYBUGGRVSA-N 465.639 0.994 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2[C@H]3COC[C@H]32)C1 1782799111 WFRNOPSFOJKGST-QMZNAZLISA-N 457.531 0.527 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](O)CCl)C3)cc1F 1783059701 PNSSMNNZNFZUPW-XAUMDUMWSA-N 476.954 0.956 50 20 JCGD COC(=O)C1(C(=O)N2CC[C@@]3(CN(C(=O)c4cc([N+](=O)[O-])ccc4OC(C)=O)CCO3)C2)CC1 1783216098 ZHOHCPGYADOSGY-OAQYLSRUSA-N 475.454 0.917 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@H](O)CN1C(=O)OC(C)(C)C)CCO2 1783879763 XTWDXBKBYQNJJY-FAPUVCABSA-N 475.970 0.440 50 20 JCGD 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N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC[C@@H](N)C(N)=O 1795637392 FUNZYPJZHZJYCA-XBHGAPDLSA-N 461.469 0.054 50 20 JCGD N#Cc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)ccc1F 1797752961 PBSLVLWAUQWKHO-VPTLXERWSA-N 466.473 0.142 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2c(O)nnc2O)cc1 1798598956 NJSAFGBHZMVOEB-IKVITTDRSA-N 480.319 0.665 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN1CCNC1=N)C2 1799217793 HEIXZFCEEAWRKL-QDMKHBRRSA-N 458.475 0.612 50 20 JCGD CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@]1(O)CCN(C(=O)OC(C)(C)C)C1)C2 1799269941 GEWSYSJVWCWSNE-WUUQAYSMSA-N 459.971 0.965 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1nccn1 1799412821 RELNIRFYNQZWND-HBCWATKFSA-N 458.431 0.015 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1799685888 AZUGIIVUJFQANY-BTJTYRRCSA-N 496.524 0.480 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN(C)NC(=O)NCc1ccccc1 1799869808 MCWPTQORJYOCEY-AYWYSENESA-N 482.589 0.899 50 20 JCGD COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(OC)c1 1800415860 JNXUOEQXDLEOSE-NHKMSHSESA-N 482.342 0.220 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccccc1F 1800648281 QEAMGYAHIOLJBD-VTEUUUEMSA-N 457.462 0.106 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2)[C@@H]1[C@@H](O)CCN1C(=O)OCc1ccccc1 1800824031 TYVSISAMHGZFCS-QSMSVPEVSA-N 483.924 0.882 50 20 JCGD CCOc1c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Cl)COC)cnc2c1cnn2C 1800975546 QQOYLGSYMAHNKF-DLTLXFJOSA-N 465.938 0.824 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803147637 XVOKIRQCFCKKEX-SFHLNBCPSA-N 487.981 0.383 50 20 JCGD Cc1nn(C)c(C)c1C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1803791229 LQNDOQKLARFRNG-KNQAVFIVSA-N 461.331 0.745 50 20 JCGD 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CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSCC(=O)OC)C2)C1 1839962572 KUATXJRAAZYIEL-SUMWQHHRSA-N 467.382 0.523 50 20 JCGD C[C@@H](S)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1840163154 NDNKGHNRAPBFBZ-VGSWGCGISA-N 479.603 0.107 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(Cl)ccc3F)C2)C1 1840183367 ZNLJMWIBBSOAEU-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnc(C(F)(F)F)c3)C2)C1 1840183693 UMTBDDCDFKTHLI-HXUWFJFHSA-N 487.479 0.543 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(C)c1 1840187359 VKDGHNDQORMZIB-DEOSSOPVSA-N 490.557 0.225 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840854812 OBUUHBOIZKWVMP-GRDNDAEWSA-N 452.321 0.438 50 20 JCGD C[C@@H]1[C@H](C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)CCN1C(=O)OC(C)(C)C 1843015769 YKVZQZZOVTXTDP-VQIMIIECSA-N 471.363 0.829 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264915 XMTPDSGITAVVCE-UHFFFAOYSA-N 450.499 0.758 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCc1cccnc1)c(=O)n2Cc1ccccc1 10161450 LOBDKOPETIBLMO-UHFFFAOYSA-N 475.509 0.603 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1ccc(O)nc1)c(=O)n2Cc1ccccc1 10161567 BNPNXXRHJSRSOV-UHFFFAOYSA-N 491.508 0.626 50 20 JCGD C[C@H](NC(=O)c1ccco1)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 28580960 UWMZROWKWYOZOW-HNNXBMFYSA-N 478.527 0.199 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CS(=O)(=O)Cc2ccc(C#N)cc2)c1 107910807 VCJWDUWAJLOQCB-UHFFFAOYSA-N 464.525 0.185 50 20 JCGD COc1cc(F)c(S(=O)(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)c(F)c1 726765016 RSGWCLSCIAILRS-UHFFFAOYSA-N 455.848 0.898 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCN(C)C(=O)OC(C)(C)C)cc1 729612789 HXZSGKPOBZMDMR-UHFFFAOYSA-N 457.553 0.813 50 20 JCGD COc1ccc(CCC(=O)NNC(=O)C2CCN(S(=O)(=O)c3cn(C)c(C)n3)CC2)cc1 747644642 VXOXJHPUNYLLRP-UHFFFAOYSA-N 463.560 0.918 50 20 JCGD Cn1cc(NS(=O)(=O)c2ccsc2C(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)cn1 751294336 DYCZFZDTLUVSPA-UHFFFAOYSA-N 473.500 0.333 50 20 JCGD Cc1sc2ncn(CC(=O)OCC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)c(=O)c2c1C 807640729 XZMDTXBQMHTQQE-UHFFFAOYSA-N 459.440 0.987 50 20 JCGD N#Cc1cccc(S(=O)(=O)NCC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)c1 913600907 RSSRVEQBUVAUOH-UHFFFAOYSA-N 491.551 0.082 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCc2cccc(C(=O)N(C)C)c2)cc1 916484118 TUODJCLUHJNVOT-UHFFFAOYSA-N 461.544 0.848 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H]1CC(=O)N(C2CCCC2)C1 916549956 FDESGTHDSDCOAD-GOSISDBHSA-N 492.598 0.579 50 20 JCGD Cc1cc(=O)c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)nn1-c1ccccc1C(F)(F)F 919886428 XACZRFHCYSVRFG-LLVKDONJSA-N 473.433 0.691 50 20 JCGD Cn1ncc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)ccc21 1778021861 WKRBDVIHTFYDBZ-HSZRJFAPSA-N 463.498 0.329 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4cnccc34)C2)C1 1778610771 GZXRLYLURWELSB-XMMPIXPASA-N 460.494 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(O)nc1)C2 1779372665 UUMDAZZOKYQSBI-VGOFRKELSA-N 454.487 0.227 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1781105918 KDOFQGMDZBZTFC-QFBILLFUSA-N 457.413 0.627 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](F)Br)CCO3)C2)C1 1781115307 PXEUMSWAFCSAPG-UMCXVIDHSA-N 494.358 0.735 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@@]2(CN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)CCO2)C1 1781226876 BUEFZHPGPKJLFK-DLBZAZTESA-N 465.359 0.518 50 20 JCGD COc1ccc(CCC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(OC)c1 1782992866 VSYKZTVXXFRQOM-VWLOTQADSA-N 497.552 0.779 50 20 JCGD Cc1ccc(C(=O)NCC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1 1783259208 GUHMTTGQXBYOSP-ATIYNZHBSA-N 493.369 0.232 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](C)CBr)[C@H]3C2)no1 1783967446 UEHDXGIEIIYWLO-PCBIJLKTSA-N 471.352 0.724 50 20 JCGD COc1ccc(COCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1784095843 ZCXZYKWHXPZLAW-XMMPIXPASA-N 468.315 0.035 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1784414769 YKQODODORMYOQZ-AOMKIAJQSA-N 455.345 0.386 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1785127862 KAGDUNDXBFQSNQ-QFIPXVFZSA-N 458.707 0.786 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc(Cl)c(F)c3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978647 HOEVFUYBNWUNTP-MDKPJZGXSA-N 474.725 0.995 50 20 JCGD COc1ccc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786981847 MNXHHEDOZVZNIY-HSQYWUDLSA-N 452.316 0.591 50 20 JCGD Cc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)ccc(F)c1F 1786982228 SESXDJTVHTVSCS-QSFXBCCZSA-N 458.270 0.860 50 20 JCGD COc1ccccc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607934 WSFOWSFQIXSANY-XJABCFGWSA-N 481.553 0.920 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)C[C@@H]21 1788609889 BMDYLHOXBAOPRF-KHDYIWLOSA-N 486.460 0.640 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS[C@@H]3CCCCO3)[C@H]2C1 1788647489 ZQEIOUFLRNSOHD-NWZZKEMCSA-N 456.609 0.599 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(=O)C3CC3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724940 RVPOIFXQMVPABG-UFYCRDLUSA-N 471.558 0.291 50 20 JCGD Cc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)cn1 1789725008 XBRTUJVFRWGCEL-ONTIZHBOSA-N 495.584 0.725 50 20 JCGD C[C@@H](NC=O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1789879158 FZVWKVQKBNIKEZ-YXMSTPNBSA-N 460.959 0.233 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1790577040 WDEUPMYLDGQCFL-XEHJXZTKSA-N 451.332 0.234 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](Br)Cc3ccccc3)[C@H]2C1 1790780531 FYQKAIQQBYEXHD-OYSTVDSJSA-N 495.418 0.565 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1CCCN(Cc2ccccc2)C1 1793756545 SMJWLRDXVZNOAP-UCKMRUJXSA-N 491.397 0.482 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CN1CCS(=O)(=O)CC1 1794091957 BXNIMDLAARPIEU-XGUBFFRZSA-N 450.399 0.529 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(C)n1 1794590872 UFRFUZLBEPNCFR-FVCICTRLSA-N 458.431 0.166 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(-n2cnnc2)cc1 1795493812 DVBRYAUCTBPYOW-MXXHGQMLSA-N 490.524 0.605 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(Br)c1F)C2)c1cccc(B(O)O)c1 1795739972 XPGJSIGFLFNQRG-HBCWATKFSA-N 491.122 0.785 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3[nH]ccc3n1)C2 1796442218 XAMYOHLIJPHSBN-DFZQMDCHSA-N 463.498 0.900 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](C)N1CCN(C)CC1)C2 1796892760 PJKXUSIEYLTDRD-ZRYVXYHCSA-N 457.579 0.395 50 20 JCGD Cn1ncc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)ccc21 1797083217 UFKFFVNEGUGNMR-CWPLJXCYSA-N 463.498 0.089 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCSCC1)C2 1798521743 ZALBIZDBSQSNDT-VPTLXERWSA-N 492.554 0.772 50 20 JCGD C[C@H]1C[C@]1(C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097542 OGXQRMZWWUTIJB-NUSRAOODSA-N 457.575 0.968 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnc2cc(C)ccn12 1800083880 UTVSBSMJDFTOPT-BMDFQBGOSA-N 477.525 0.980 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3c(=O)[nH]c4ccccc4n3n1)C2 1800978137 LUORTZOXBOCNSG-OQMKEHIESA-N 474.905 0.028 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)Cc1ccccn1 1801224227 WQDJFTGXPCIWLA-OODBJQIASA-N 466.542 0.984 50 20 JCGD O=C(C[C@@H]1NC(=O)NC1=O)NC[C@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1 1804343370 DBSQDEJKWPIPHZ-WWGRRREGSA-N 452.309 0.471 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nc1 1805094974 URNJCKMZEIVBTR-CVDCTZTESA-N 473.342 0.856 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CN2CCCCC2)[C@H]1c1cccnc1 1806887431 QYUNIRCSYJGUCR-PGRDOPGGSA-N 465.558 0.886 50 20 JCGD O=C1Cc2cc(C(=O)N3CC[C@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)ccc2N1 1807361853 JMCXPVVAEDCRIC-NTKDMRAZSA-N 484.321 0.889 50 20 JCGD Cn1nc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c2c1CCC2 1807362473 LZSVBDLTKSFLMU-JPYJTQIMSA-N 473.342 0.617 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCc2ccc(O)nn2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372862 JTIVJQYCVULYDO-JPYJTQIMSA-N 475.314 0.209 50 20 JCGD Cc1cnc2c(C(=O)N3CC[C@H](CNC(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)cnn2c1 1807373888 DGBYKKGNFXHNCB-KNQAVFIVSA-N 484.325 0.746 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)CN)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807453959 QXBXAZCEQAVWHY-SIKLNZKXSA-N 453.547 0.392 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@@H]1c1cccnc1)[C@@H](F)Br 1808652566 YPUHUIUFHTXMOE-USXIJHARSA-N 491.383 0.508 50 20 JCGD CC(=O)Nc1cc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)ccn1 1808918887 RANFDDVXLWZTCP-NFBKMPQASA-N 487.325 0.748 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)c3cnc(OCF)cn3)CC2)C1 1809969371 UBHJBCMEKXLVFW-UHFFFAOYSA-N 456.283 0.621 50 20 JCGD CN1CCN(C2(C(=O)N3CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]3c3cccnc3)CC2)CC1 1813072096 BEFNPWSMHSDRQN-REWPJTCUSA-N 485.633 0.240 50 20 JCGD CC(=O)N[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(C)(C)C 1815335814 SIHICPICEMEILA-MAUKXSAKSA-N 472.376 0.600 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815344015 BLBKJLDZPAEYCT-MRXNPFEDSA-N 495.370 0.349 50 20 JCGD NC[C@@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)c1ccccc1 1815354730 QZCODAXLZQTPID-QZTJIDSGSA-N 464.356 0.791 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cnn3cccnc13)CC2)c1cccc(B(O)O)c1 1815356388 GYZSWRYHRYYFNH-CQSZACIVSA-N 462.300 0.405 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817475470 RTLGLLWJIRKNDH-SFHVURJKSA-N 452.324 0.677 50 20 JCGD CCn1nccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819795227 KPWZNSNSCBOMEA-NSHDSACASA-N 454.516 0.898 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc[n+]([O-])cc1)CC2 1819797548 DQWDYWHHEPMPSM-LBPRGKRZSA-N 453.484 0.315 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)N1CCN(C)CC1 1819797698 GIQAZXWZWRGJEI-ZIAGYGMSSA-N 486.602 0.003 50 20 JCGD CCOC(=O)c1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)ccn1 1821583647 UNZBMUOFATUDHN-INIZCTEOSA-N 494.338 0.934 50 20 JCGD O=C(CN1CCCCC1=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1825863164 WVPLHXPIFSACSE-HNNXBMFYSA-N 456.333 0.061 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccnc1C(N)=O)CC2 1826080750 WGQAQPBCXCYIPE-LLVKDONJSA-N 459.532 0.236 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)CC1 1827676038 CRCALTISEYHESK-OAQYLSRUSA-N 491.419 0.025 50 20 JCGD C[C@H](NC=O)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829220889 GHWCMSOYKRSIGE-CECAUBDESA-N 480.949 0.173 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(C(=O)O)ncn3)C2)C1 1830534875 DLRXYMHOQFYGOB-KPZWWZAWSA-N 471.308 0.276 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CCOC[C@@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1830737787 HAJCQSIYSFAXOV-IFXJQAMLSA-N 479.933 0.002 50 20 JCGD Cc1cccc(C)c1N1C[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1=O 1832544150 UKPMTHGOVVQGSV-IECBHUPTSA-N 493.988 0.712 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832800322 OCMKTKRYOOHZLV-WBMJQRKESA-N 460.285 0.031 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1 1833004189 FMZXLAHOTRIABJ-UHFFFAOYSA-N 485.501 0.685 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)nc1 1833597912 BJGZMLRVWBZEMD-GOSISDBHSA-N 490.376 0.340 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c(O)c1 1834800928 AYJAPJSQTUMJOT-UHFFFAOYSA-N 481.358 0.580 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ncccc3F)CC2)CC1)c1cccc(B(O)O)c1 1834800952 CBTFFSBFMKRFSS-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)C(C)(C)NCCC#N)CC2)CC1 1835118404 ZALUWRQGPZHLEQ-UXHLAJHPSA-N 498.632 0.974 50 20 JCGD CN1CCN(CC(=O)NC2CCN(C3CCN(C(=O)CCBr)CC3)CC2)CC1 1835481373 UMUBPOOZCBCWCF-UHFFFAOYSA-N 458.445 0.590 50 20 JCGD O=C(/C=C/C(=O)NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)NCc1ccco1 1835805242 HVIKAGVFXIHUSN-GNAXCBTBSA-N 466.966 0.623 50 20 JCGD CCn1nc(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c2ccccc21 1835928025 BBNNTLAXPKAMFS-VWLOTQADSA-N 492.341 0.120 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@H](O)CCl)CC2)CC1)c1cc(=O)nc2sccn12 1836076065 QVBRUBOKZUXOPV-MRXNPFEDSA-N 467.979 0.541 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C(F)F)no1)CCO2 1836247262 HDMKDJZRQYTTRS-IBGZPJMESA-N 459.450 0.055 50 20 JCGD O=C(c1n[nH]c2c1CS(=O)(=O)C2)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836717749 ITFHWRGXSDBRJH-MRXNPFEDSA-N 474.967 0.050 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1837338415 KMMLPMNUTNOWHP-MZNJEOGPSA-N 482.541 0.256 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccc1O 1837459573 KRFOVIFNUSREJY-HSZRJFAPSA-N 469.498 0.083 50 20 JCGD Cn1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cn1 1837466812 HZJDHFZRCKKTEC-UHFFFAOYSA-N 455.519 0.345 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)no1 1837519530 QHIWNIBNJTXHFD-UHFFFAOYSA-N 456.503 0.908 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)COc3cccnn3)CC2)CC1 1838102962 IKULZEYYVGOZMT-WPWMEQJKSA-N 497.556 0.988 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCCO4)CC2)CC1 1838326329 HSOSXOHFXIDPDH-UHFFFAOYSA-N 476.578 0.651 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1F 1838916454 UQBFAZGZUKMSFN-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccnc3c(O)cccc13)CCO2 1839607464 ZBWIMWWRCYZWPC-XMMPIXPASA-N 485.541 0.383 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H]3[C@@H](O)CCN3Cc3ccccc3)CCO2)C1 1839727178 DQJOUADHYRZEAO-XBJMDHIQSA-N 496.004 0.332 50 20 JCGD CN(C)C(=O)NCC(=O)N1CCOC[C@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839742206 RPGJKPIRCMGEEH-VAPFXODJSA-N 491.495 0.599 50 20 JCGD COC(=O)C12CC(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](C)Br)C4)C3)(C1)C2 1840007144 QAGLEKYBHNQGCS-KSBHDHOUSA-N 459.337 0.570 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1c1ccccc1)CCO2 1840118241 RFIKGRBZBQLUCQ-SLSDLSHTSA-N 464.327 0.240 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4c(s3)CCC4)C2)C1 1840183776 ZGAQVFLFTPDAEZ-JOCHJYFZSA-N 464.588 0.680 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1841338982 FTAOMPMTNKZMIH-JKSUJKDBSA-N 457.531 0.872 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)CN2C(=O)COc3ccc(Cl)cc32)C1 1841855741 LRMUFVBTDARUIJ-UHFFFAOYSA-N 498.927 0.581 50 20 JCGD CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 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PHLVOECLDPYZAL-GFCCVEGCSA-N 479.353 0.209 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2c(C)nc3cc(O)nn3c2C)cc1 751291487 WOQYGLOJIIQJIA-UHFFFAOYSA-N 474.543 0.761 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)NNC(=O)c2cccc(CN3CCS(=O)(=O)CC3)c2)c1 751327364 ZUGONTBRJJYVCB-UHFFFAOYSA-N 465.553 0.395 50 20 JCGD Cc1sc2ncn(CC(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)c(=O)c2c1C 807636264 MAVONECNCPJGLB-HNNXBMFYSA-N 472.479 0.605 50 20 JCGD O=C(COC(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1)NNC(=O)[C@@H]1COc2ccccc2O1 849194816 ZNAQMXHVYRPBBC-SFHVURJKSA-N 467.394 0.925 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cnc3c(c2)c(O)nc(=O)n3C2CC2)cc(OC)c1OC 879363211 QBXSIIHVJJEFCF-UHFFFAOYSA-N 455.427 0.933 50 20 JCGD Cn1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2C(F)(F)F)c2ccccc2c1=O 913573091 UPFGPCWCHCKXOZ-UHFFFAOYSA-N 483.428 0.692 50 20 JCGD COC(=O)c1ccccc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 916107991 ZMDKSCCEFZOHCK-UHFFFAOYSA-N 467.525 0.881 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)NC[C@@H](C(C)C)N2CCN(C)CC2)c1 916257722 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CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)C(=O)Nc3cccnc3)CCO2)C1 1780097905 RDPXDCUGFBLXEN-QHCPKHFHSA-N 497.464 0.997 50 20 JCGD CC(C)[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)NC(=O)NCc2ccccc2)C1 1780558688 DEVVDFQDTSFDOF-JLRUASKGSA-N 489.617 0.863 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1 1781997909 NUXFJKHLETWSMG-BGIGGGFGSA-N 477.352 0.779 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O)CCO2 1783881565 SAQOURXOLCYMDV-CMBDLQSPSA-N 475.970 0.298 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1 1784239896 PVAJUOWDOVGWFQ-BKMJKUGQSA-N 492.580 0.793 50 20 JCGD CN[C@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1)C(=O)O 1785076533 QPMYOYHDJWLQST-QMHWVQJVSA-N 490.985 0.161 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1785321144 PGQBGIXWRRZZLV-CKFHNAJUSA-N 466.000 0.672 50 20 JCGD 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CCOC(=O)C1(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1807363283 BHXIWQAEFOPXJB-QUCCMNQESA-N 465.315 0.424 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807368328 RSCXEAPHPFVEGS-LTMIRXACSA-N 473.342 0.609 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374575 ZZRDOTFFJLZWIG-PGRDOPGGSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)[C@@H]1CC[C@@H]2CCC(=O)N2C1 1807736640 VEAFTVBHJKPHSB-LNGMVNIQSA-N 490.369 0.482 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](N)Cc2cccnc2)[C@H]1c1cccnc1 1810303627 UDXLGNKDENWHDP-NYVOZVTQSA-N 488.552 0.365 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1 1810307017 CFGYANGGWSMKSK-BLGKUDCZSA-N 472.509 0.903 50 20 JCGD CC(=O)O[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(C)C 1815343997 BACQTBVARQJPII-YJBOKZPZSA-N 459.333 0.636 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc3ncnn3c2)[nH]n1)c1ccc(B(O)O)cc1 1817471997 ASXQZEKABCECCI-SFHVURJKSA-N 459.275 0.752 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1ccc2nncn2c1 1819117813 TXGBFIXSHSRIEF-SFHVURJKSA-N 459.275 0.752 50 20 JCGD Cc1cnn([C@@H](C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)c1 1826746368 YNJKLWVMZZAVHM-XJKSGUPXSA-N 453.333 0.815 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cc(=O)n3[nH]cnc3n2)CC1 1827048430 RSSGAKYQFTVZKC-ZBFHGGJFSA-N 450.927 0.905 50 20 JCGD CS(=O)(=O)N1CCC(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1828357743 NJXKMLYITRPRCD-QZTJIDSGSA-N 464.028 0.877 50 20 JCGD CNC(=O)CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Cl)COC)CCN2C(=O)OCc1ccccc1 1829341123 XNZOQOYFCBMLOK-FDDCHVKYSA-N 494.976 0.828 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc(Cl)ccc1F)CCO2 1830188573 IVRQYECTBUPQNZ-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD CC[C@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1830525277 KWMXZTJMOHUCIX-UWJYYQICSA-N 465.459 0.361 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1830535855 UUINHHPHNGSIKT-KUHUBIRLSA-N 488.404 0.965 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4n3)C2)C1 1830538388 DYOKTTZEQWMVSY-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD O=C(c1cc2cccnc2nc1O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830736075 RGDQPXMTOJBKHG-YWZLYKJASA-N 450.879 0.005 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830743751 SYCMYISCBXKQJF-SXGZJXTBSA-N 463.959 0.203 50 20 JCGD COc1cc(N2CCC(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)CC2)ncn1 1830957512 LCPARZUCSVBBCX-WIYYLYMNSA-N 485.944 0.692 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2 1832364257 ZCFBFCLKGWFUMV-XMMPIXPASA-N 482.317 0.307 50 20 JCGD CC[C@@H](NC)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549660 WILHGBLAJPLVHY-XFQAVAEZSA-N 477.002 0.573 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832800167 KVFBXMITSCSQOQ-YOEHRIQHSA-N 474.312 0.421 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)[C@@H](O)CCl)CC1 1832929465 MLPKJNPBGMZIMV-BBWFWOEESA-N 489.013 0.975 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c[nH]1 1833380157 LJSMOMINCJGQLE-XMMPIXPASA-N 484.557 0.695 50 20 JCGD CSCC(C)(C)C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833505217 HOPDYTYDXGVVKD-UHFFFAOYSA-N 461.437 0.941 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1834800223 ZPDJQCQLYBXJKC-UHFFFAOYSA-N 494.357 0.047 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccnc4ccccc34)C2)C1 1835937149 QJZRRRKOMPEQPB-RUZDIDTESA-N 475.310 0.298 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C)c1 1835939247 ITPKMJFKFWSLDC-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836780717 GYRAPHBYEPETQB-JLTOFOAXSA-N 453.927 0.104 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CC[S@](=O)CC)CCO2)C1 1837245609 CFTYHVDWZNCFQM-SJUHQFKNSA-N 453.399 0.775 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnc(Cl)c3)C2)C1 1837457241 ZADLYBDYBHHVGH-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD CCn1nc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1C 1837919180 NNIFUGFZNBIJHT-UHFFFAOYSA-N 468.363 0.817 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3nccc4nc[nH]c34)CC2)CC1 1837919299 DOBWIQPCQUSZLH-UHFFFAOYSA-N 477.330 0.564 50 20 JCGD CSc1ncccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1838285927 HDKQMSGTIWXEKP-JOCHJYFZSA-N 486.554 0.186 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C3=CCCC3)C2)C1)NC(=O)NCc1ccccc1 1839054154 IZQYBYMDNVNFPU-RUZDIDTESA-N 485.585 0.899 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839150404 LPLGTPVGTGZFHK-COXVUDFISA-N 474.407 0.007 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839156202 GQOBCXAUGIJDCF-ZYSHUDEJSA-N 452.379 0.984 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200342 GHGVGEPTETXKLG-BROMNRLTSA-N 488.314 0.267 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839388682 ZLPBRVULGGTSQM-SJCJKPOMSA-N 456.323 0.090 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2 1839739275 WTAIVCIPORNWBC-SPKLELGKSA-N 494.898 0.854 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCOC3=O)C2)C1 1839742056 MRTGRYGQKBMCRB-VAPFXODJSA-N 490.463 0.780 50 20 JCGD C[C@@H](NC=O)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839743916 DOVWDFWZDQXBLM-RWSPSULHSA-N 462.453 0.463 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1840031114 GBOCPECNRPXRGM-MRRFBWAASA-N 499.362 0.233 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3nnc4ccccc43)C2)C1 1840151368 ZNQCLCAAOBWNRW-MGPUTAFESA-N 451.911 0.142 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(-n4cccn4)nc3)C2)C1 1840153518 RDQQMRPPEQDWIW-LAUBAEHRSA-N 463.922 0.591 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)[C@@H](C)O4)C2)C1 1840154287 RIJIDTJGIUTXTR-RQVMVGKASA-N 481.933 0.730 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(Cl)cc3)C2)C1 1840183602 ODXSQRCETIOKGH-JOCHJYFZSA-N 466.966 0.712 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cccc(=O)n2O)C1)NC(=O)NCc1ccccc1 1842211484 SHYRVLZQXLYJNI-UHFFFAOYSA-N 468.514 0.249 50 20 JCGD C=CCNC(=S)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1 725908836 WKFMFRJYSAURME-UHFFFAOYSA-N 467.617 0.993 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCC(=O)N(C)CCc2ccccn2)nc1 727608387 PZPLWQOJOGPGPW-UHFFFAOYSA-N 463.564 0.834 50 20 JCGD CC(=NNC(=O)CNC(=O)c1ccco1)c1cccc(N(S(C)(=O)=O)S(C)(=O)=O)c1 729820065 WYTOAIRAUWPQLN-UHFFFAOYSA-N 456.502 0.275 50 20 JCGD O=C(COC(=O)CCN1C(=O)COc2ccccc21)NNC(=O)[C@H]1COc2ccccc2O1 746250770 HSYJDLRUXXCJHO-GOSISDBHSA-N 455.423 0.333 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)[C@@H]2CC(=O)N(c3ccc4c(c3)OCCO4)C2)n1 760436874 SUUMWCGNOBTFIM-CYBMUJFWSA-N 474.495 0.509 50 20 JCGD CCCn1nc(C(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)c2ccccc2c1=O 786273855 PAOAUZFVHBHYAL-KRWDZBQOSA-N 498.927 0.895 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)cc1)NNC(=O)Cn1cnc2ccccc21 913495828 REWSLXXQAMDMOC-UHFFFAOYSA-N 466.317 0.925 50 20 JCGD O=C(CNC(=O)c1c[nH]c2ccccc2c1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 915357457 LDKDVGQOWKGMAU-UHFFFAOYSA-N 497.533 0.504 50 20 JCGD COc1ccc([C@H](CNC(=O)NNC(=O)Cn2nc(C)cc2C)N2CCOCC2)cc1OC 915895714 UHQWXVRDDZVJRZ-SFHVURJKSA-N 460.535 0.921 50 20 JCGD Cc1noc(CCCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 916093020 WYYQGWCTYIVJHT-UHFFFAOYSA-N 465.532 0.502 50 20 JCGD C[C@H]1CCCCN1[C@@H](C)CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1 916448917 SWJCWPPFAMMOSZ-IRXDYDNUSA-N 453.613 0.907 50 20 JCGD CC(C)NS(=O)(=O)c1cccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)c1 916486338 MFXSGFGBSLOXNL-UHFFFAOYSA-N 472.527 0.764 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NC[C@@H]2CCN(CC(F)(F)F)C2)cc1 916577681 AZYUSHQLXPVGAC-AWEZNQCLSA-N 465.498 0.830 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H]2C[C@H](O)CN2C(=O)Cc2ccccc2F)cc1 919185720 YFFHWYXVDHPEOD-HKUYNNGSSA-N 457.458 0.643 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2ccc(CN3C(=O)CNC3=O)cc2)cc1OC 921180998 VPLHPOHXUWMANW-UHFFFAOYSA-N 470.438 0.374 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)cn1 1777800395 OUTDKLUKPSYAGO-MBOZVWFJSA-N 473.979 0.353 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1779029647 WNKYROOSTMLHPF-KXNSMUHISA-N 473.530 0.108 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3ncccc3Br)C2)C1 1779651807 SVQXIRNFVPKVFH-FQEVSTJZSA-N 489.330 0.600 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)cc(Cl)n3)C2)C1 1779804098 JXOADWOSJHDGOO-FQEVSTJZSA-N 464.114 0.826 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)CCBr)CCO2)C1)NC(=O)NCc1ccccc1 1780968489 AVOBPAHUDCUEFT-OAQYLSRUSA-N 496.406 0.948 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](C)Br)C1 1781997072 BIQPRHBWJSWIOO-VMUDFCTBSA-N 453.399 0.964 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C#CC1(O)CCCCC1)C2 1782214823 NBTNZBHLPNHGJL-AUSIDOKSSA-N 462.591 0.572 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1CC[C@@]2(C1)CN(C(=O)C(O)O)CCO2 1782867869 QPRMHWMUFIHXLN-CECLQJIQSA-N 450.289 0.497 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1783020099 RJDWXICHIFDLOH-FXAWDEMLSA-N 458.964 0.452 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1783575030 BWOGWXJLLBLEGA-CYFREDJKSA-N 487.362 0.209 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)C1 1783865213 XEZCBAKUOUYRHN-PXAQALGRSA-N 473.530 0.108 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)C[C@](C)(O)CC(=O)O)C2)C1 1783928649 LXPZMWFFESCGKS-SZFUDVHCSA-N 491.969 0.564 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccc([N+](=O)[O-])o3)[C@H]2C1 1784218608 LVDMZHVFASNMJG-MZWQYVGQSA-N 484.469 0.493 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(CO)CC3)[C@H]2C1 1785053146 OHHJKPQSCFKPNN-AJHRRDMJSA-N 459.547 0.077 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1 1785109556 YEJJOEQTPLJZAO-HSZRJFAPSA-N 451.288 0.082 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCNC(=O)c3ccc[nH]3)[C@H]2C1 1785248420 CEVMICAAQRHWHZ-DUYHWBDASA-N 497.556 0.248 50 20 JCGD Cc1cnc(Cl)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1786256936 SYZCTMSEEQOKSW-SNRMKQJTSA-N 457.723 0.630 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1ccc2ncncc2c1 1788378973 RAOTWJHUUHVEDQ-XJABCFGWSA-N 460.299 0.217 50 20 JCGD COc1ccccc1OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788607820 LOVJFCUYSLQCCC-XERREHJYSA-N 483.525 0.366 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)c3ccccc3)C[C@@H]21 1788611598 LZIVBCQCWJDXLH-KNTRFNDTSA-N 455.490 0.989 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)nc1 1789724132 DYGXWRMATYHSIX-VDGAXYAQSA-N 496.568 0.839 50 20 JCGD N#Cc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(Cl)c1 1790229881 IYJSNDKZBBOMNU-LRQRDZAKSA-N 467.718 0.799 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)CC2=O)c1 1792971411 JAGTZUBVHXARRN-GODLDSPTSA-N 465.934 0.237 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793116758 STYCQPFAOPVCQS-AICCOOGYSA-N 461.943 0.681 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OCC(F)(F)F)n1)C2)c1ccc(B(O)O)cc1 1795732440 GHXPOTFMDMWXIE-CCWDJLKJSA-N 493.247 0.220 50 20 JCGD O=C(CCS(=O)(=O)c1ccccc1)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796187019 HEEWBMIPBMVOPR-ACDBMABISA-N 470.356 0.482 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1796839924 PJUMWPGENYUVNZ-RDGPPVDQSA-N 475.351 0.158 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CNC(=O)c1cc(C)on1)C2 1796891799 LMXSJOGRRAAARQ-MVRRYPJTSA-N 469.502 0.485 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc(Cl)cc1[N+](=O)[O-] 1799764671 CPNGMDNIRNGKFP-YVWYUNDQSA-N 487.705 0.753 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)CC[C@H](N)C(N)=O)[C@@H]1c1cccnc1 1807192764 YGOQQOQLYNMBLR-UTXMOHQDSA-N 454.369 0.711 50 20 JCGD Cc1noc(CC(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1807525833 QVCOMYSVVDOVAC-YWZLYKJASA-N 464.486 0.334 50 20 JCGD O=C(O)c1cc(C(=O)N2CCCC3(CCN(C(=O)c4ccc(B(O)O)cc4)CC3)C2)ncn1 1807573454 RBORGYPNEOPWCP-UHFFFAOYSA-N 452.276 0.013 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1807949157 NCDQHMMAABCEDL-YFROIQMUSA-N 479.328 0.764 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2nccc3nc[nH]c23)[C@H]1c1cccnc1 1808134595 HYBJSIDMTICSSQ-YCRPNKLZSA-N 485.508 0.985 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1808317842 LWSGFEVAKQJPLV-HQRMLTQVSA-N 461.390 0.610 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@H]2c2cccnc2)n1 1810485055 BLFOIFGVGDVHRX-SCTDSRPQSA-N 461.950 0.988 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cc(Cl)ncn1 1811122961 JNXUSYPOIVWQHK-OXQOHEQNSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccccc1-n1nccn1 1811469714 JJLYTFPDRJPFEV-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD CCN(C)[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1812312226 QIBKHRNCBYGMSM-MDYRTPRTSA-N 453.547 0.740 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1814171212 IJMQKGAGLKWYKN-APWZRJJASA-N 482.541 0.989 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CNC(=O)C1)CC2 1817283057 SIZYXITWQFJTMR-DESFHTRISA-N 457.516 0.325 50 20 JCGD C[C@@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1)N1CCN(C)CC1 1820789657 IMEOHDAKJGWRFT-FUHWJXTLSA-N 462.599 0.411 50 20 JCGD C[C@H](C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1)n1ccnn1 1821721440 PGNXFIAHJXURLL-MLGOLLRUSA-N 452.479 0.567 50 20 JCGD COCCOCCOCCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822254736 HXNJBFIBQWCRDR-HXUWFJFHSA-N 488.350 0.465 50 20 JCGD O=C(c1ccc2ncnn2c1)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057453 FSJXDYUBSCQFKC-OAQYLSRUSA-N 461.331 0.956 50 20 JCGD Cc1cc(NC(=O)CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)no1 1827660340 MRNIYLYQRCFTDY-HXUWFJFHSA-N 482.346 0.925 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)CC1 1829101777 ARAQQGFIWRZDNZ-INIZCTEOSA-N 461.599 0.897 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnccn3)C2)C1 1830546665 VHXZTXMLHOXFRX-QIGIYGOBSA-N 453.337 0.977 50 20 JCGD Cn1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1C(F)(F)F 1830728341 RREPNSHPFZGNJL-BZNIZROVSA-N 454.833 0.109 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830738694 RQFFSAMEKLJXRZ-UTKZUKDTSA-N 450.923 0.552 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@@H]2CCCS2(=O)=O)CC1 1831282935 HXAHJMCPNXRZDP-MOPGFXCFSA-N 477.587 0.496 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)NC(=O)OC(C)(C)C)CCO2 1832042698 IPTRGMRVHOTWLL-QVKFZJNVSA-N 477.986 1.000 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc(O)cn2)CC1 1832317372 KBLVZWQQCOJWNR-QFIPXVFZSA-N 451.332 0.943 50 20 JCGD O=C(c1cnnc(Cl)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1833209711 VACWQKVLAJMOGB-WFASDCNBSA-N 451.680 0.891 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cncc(C)c1)CCO2 1834281516 DCTUCCXUZIXPFM-NWJFTTBMSA-N 468.514 0.594 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1834732162 GTJIAFGINIIGRN-XJKSGUPXSA-N 460.417 0.182 50 20 JCGD C[C@H](NNc1ccccc1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797798 HQKRYDUBBWFJID-IBGZPJMESA-N 493.417 0.557 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)c3ncn(C)n3)CC2)CC1 1835118200 HEFGPYVYHNVPEZ-CVKSISIWSA-N 469.550 0.134 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2 1835674724 FLYCRRVNERMJJX-HNAYVOBHSA-N 459.385 0.756 50 20 JCGD CC#CC[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835938134 NAKBCCHEECNVKW-RPLLCQBOSA-N 490.365 0.634 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccs3)CCO2)C1 1835964863 JXZQSOBWRAFOEB-LFTXJPJQSA-N 471.539 0.530 50 20 JCGD O=C(Cn1cnnn1)N1CCO[C@@]2(COCCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1836150336 MPYMGASAIJIJEX-XLIONFOSSA-N 493.362 0.136 50 20 JCGD C[C@@H](Nc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837459483 ROJLMIMEJGEBAL-MZNJEOGPSA-N 482.541 0.256 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)C(C)C)C2)C1 1838528268 NMXHRAUTRWCOQD-HSZRJFAPSA-N 492.529 0.930 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2)C1 1839141452 IZACMUULEBSWJB-BXTJHSDWSA-N 463.959 0.346 50 20 JCGD O=C(c1cnc(Cl)nc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839197093 IQRROFWWOMCUSJ-XHDPSFHLSA-N 451.680 0.891 50 20 JCGD Cc1c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn2[nH]cnc(=O)c12 1839200638 NQJMUMNOHDKGEO-KBXCAEBGSA-N 486.298 0.092 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2 1839739276 WTAIVCIPORNWBC-UHYGZKCKSA-N 494.898 0.854 50 20 JCGD CS(=O)(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2 1839743777 SXFTYKVAEVUKEI-IHSQGBLNSA-N 497.520 0.763 50 20 JCGD O=C1C[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](Br)Cc4ccccc4)CCO3)C2)CN1 1839802451 XJTBXKSSTJPBKT-NPPFBWRTSA-N 494.386 0.585 50 20 JCGD C=CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840108055 PRZXMBMLMQJWHP-WHSLLNHNSA-N 475.970 0.512 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCC[C@@H](C(=O)OC)C1)CCO2 1840148825 XSROFAZDANJCKL-GRXQJBFDSA-N 460.955 0.676 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)n(-c2ccccc2)n1 1840184016 NSLXIWMUBCRKAA-RUZDIDTESA-N 498.584 0.624 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc4cnccc34)C2)C1 1840185330 LMSLDIFPZONTLJ-QHCPKHFHSA-N 470.530 0.073 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)CC(=O)Nc2cc(C)on2)C1 1843400298 YALHJOIKPWCBCN-ZVHZXABRSA-N 455.475 0.649 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC2(CCCN2C(=O)c2ccc([N+](=O)[O-])c3c2OCO3)C1 1844757734 HJDFDPSRLFASDP-UHFFFAOYSA-N 453.216 0.134 50 20 JCGD C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 16203372 XCTFVTUSQSLOFU-CYBMUJFWSA-N 454.480 0.414 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1n[nH]c(=O)c2ccccc12 17195265 AFBLKQQILZMPQC-UHFFFAOYSA-N 487.494 0.027 50 20 JCGD CC(C)Cn1c(=O)[nH]c(=O)c2c(C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc(C3CC3)nc21 105873983 OHDAIIAWHSBCPU-UHFFFAOYSA-N 489.496 0.669 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)CN2C(=O)N[C@@](C)(c3ccc(OC)cc3)C2=O)cc1 725906819 GKEHNMVDNIGSIO-QFIPXVFZSA-N 455.471 0.730 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCc3ccc(OCC#N)cc3)nc2)CC1 727942336 GUHKZPTVMNWOLF-UHFFFAOYSA-N 459.532 0.746 50 20 JCGD COc1ccccc1NS(=O)(=O)c1cccc(C(=O)NNC(=O)NCCS(C)(=O)=O)c1 727942966 PKVZCKNKCDSSSG-UHFFFAOYSA-N 470.529 0.485 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2c(c1)nc(CCC(=O)NNC(=O)c1cnn[nH]1)n2CC 729456558 SJHMAHQTZMHTFJ-UHFFFAOYSA-N 462.536 0.599 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCCOCC1CC1 731119920 XCOOKSWHLXNILS-UHFFFAOYSA-N 454.549 0.397 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)CN2C(=O)N[C@](C)(c3ccc(F)cc3)C2=O)cc1C 825164229 JQRYQCQYZMVKDU-JOCHJYFZSA-N 455.446 0.996 50 20 JCGD NC(=O)c1csc(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 919693909 PAGPKRIDPWCTAS-UHFFFAOYSA-N 466.541 0.262 50 20 JCGD CC(C)Cn1c(=O)nc(O)c2c(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc(C(C)C)nc21 919886304 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COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3n(n1)CCCNC3=O)C2 1782175123 FJLJSYPEXPJIKZ-AVBTWRTFSA-N 467.954 0.398 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)COCCOCCOCCOC)CCO2)C1 1783355139 LEYDZYIBGAOBLR-FXAWDEMLSA-N 495.411 0.686 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21 1783970362 SZHXIMHOPRCFED-HOSILWTGSA-N 478.347 0.714 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@]3(O)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1784009601 ADHCXKSMQHUXQD-PNHOKKKMSA-N 490.395 0.972 50 20 JCGD CC#C[C@H](CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2)c1ccc(O)cc1 1784018516 RLVLFXMMTWGFRW-RLWLMLJZSA-N 476.338 0.713 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)CBr)C[C@@H]21 1784439571 ZWVCHVBFZIRVOD-QTVXIADOSA-N 468.414 0.325 50 20 JCGD Cc1nc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c(C)s1 1785409400 GCNJCEYPUURJOY-QRFRQXIXSA-N 457.361 0.276 50 20 JCGD 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0.421 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cnc4ccccc43)C2)C1 1840155574 FEXAAIICXXXCEH-HRAATJIYSA-N 450.923 0.747 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(Cl)c(F)c3)C2)C1 1840185897 ZRJUZYVERFRLBX-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C1)C2 1843015659 SOOSDMOOWCUPRA-SLFFLAALSA-N 483.374 0.971 50 20 JCGD C[C@@H](Br)C(=O)N1CC2(CCCN2C(=O)[C@H]2CSCN2C(=O)[C@@H]2CCC(=O)N2)C1 1845874314 SUGBKYSDRZFTGE-FRRDWIJNSA-N 473.393 0.153 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCN1C(=O)C=CC1=O 1847951036 BOEARSTVXWKVFZ-IRXDYDNUSA-N 470.438 0.651 50 20 JCGD CN(CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CCc1cnc[nH]1)NC(=O)NCc1ccccc1 1848166604 CGSOEDIEFAOXAM-PMACEKPBSA-N 453.547 0.890 50 20 JCGD Cc1cccc(O[C@H](C)C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCOCC3)cn2C)c1C 18103677 PMPIQDGKBLPDKP-MRXNPFEDSA-N 464.544 0.891 50 20 JCGD CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 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GEQCJSFOXASPNO-YCRPNKLZSA-N 450.923 0.574 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778094305 FNLXBLNAVXWAAO-BNMXHOPLSA-N 467.954 0.888 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778094725 MGXYIVZZAWHSJF-OFUJIHMTSA-N 488.589 0.939 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)Cc3ccc4c(c3)CCC4)CCO2)C1 1779028139 FFGDRTPFNZXVMM-VWLOTQADSA-N 463.538 0.860 50 20 JCGD COc1cc(F)ccc1CC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779035184 APOSWTBLSIUWGO-QHCPKHFHSA-N 471.489 0.519 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@](C)(Cl)CCl)C1 1780712063 JDBYAYMTXULVMF-OHDICMOHSA-N 452.379 0.888 50 20 JCGD C[C@H](NC=O)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](Br)Cc3ccccc3)CCO2)C1 1781252402 NXFGTBPTIQWGIB-KNBMTAEXSA-N 452.349 0.957 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781325446 DHUGYGYQNJNPRE-YOEHRIQHSA-N 478.340 0.760 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1782730799 QQZVVFRSJCUBKI-JLTOFOAXSA-N 451.365 0.997 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C1)CC2 1782988906 WDMZEICLBBMKIL-FQRUVTKNSA-N 478.354 0.624 50 20 JCGD O=C1CN(CC(=O)N2CCO[C@@]3(CCN(C(=O)[C@@H](Br)Cc4ccccc4)C3)C2)C(=O)N1 1783019161 TVYWNKTWIMGAMB-KKSFZXQISA-N 493.358 0.374 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1783191532 YLFVMNAECCKHPD-NJNPRVFISA-N 453.584 0.178 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C[C@](C)(O)CC(=O)O)C2)C1 1783928653 LXPZMWFFESCGKS-WVFSVQOHSA-N 491.969 0.564 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(O)nc(O)n3)C[C@@H]21 1785076440 HBKQKOUWVQVBIX-JURCDPSOSA-N 499.952 0.613 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1785567355 IZPPFOADPILRNA-HSZRJFAPSA-N 475.351 0.115 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)Cn3cncn3)C[C@@H]21 1787508633 MDFQIHRJTMOYQV-MEOCNFHCSA-N 470.534 0.028 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](Br)CC)C[C@@H]21 1788475519 MABJDFPOMCOABF-DKBOKBLXSA-N 450.330 0.204 50 20 JCGD Cc1cc(C#N)cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)c1 1788609750 GAOBDCMBVSUZDE-NDXORKPFSA-N 462.510 0.772 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)n1 1788611607 MBUNLXLEHLYSCO-FNHZYXHNSA-N 469.546 0.544 50 20 JCGD CCOc1ncc(Cl)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1788979930 WPFAAQLYBILAEO-YSSFQJQWSA-N 487.749 0.721 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)ccc1C 1789616690 NHYGYYLTKPHFQF-VCOUNFBDSA-N 452.316 0.591 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc2c[nH]nc12 1790362490 ZDNSGCUQMXYVDC-GKCIPKSASA-N 477.525 0.777 50 20 JCGD 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CC(=O)OC[C@@H](OC(C)=O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1798471838 CTIGJTZONRINDG-RGDJBACXSA-N 475.502 0.253 50 20 JCGD CS(=O)(=O)c1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)c1 1799343538 ZUQGPDCFKPLYEY-AYRXBEOTSA-N 463.325 0.984 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc([N+](=O)[O-])c2c1OCO2 1799345025 LWNJWMLNVZONLQ-BTTYYORXSA-N 461.475 0.948 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CC(=O)CN1C(=O)OC(C)(C)C)C2 1800754342 MHAGXCURYHTSQD-XYTFPVCRSA-N 488.379 0.938 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)NC[C@@H]1CCN(C(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1807119720 DKOXCNGSMZVFJB-MLHJIOFPSA-N 483.997 0.929 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807366839 HNZYUJLGXQLEPG-NQIIRXRSSA-N 460.299 0.302 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373829 CGLHMWYTGRMBFL-DENIHFKCSA-N 477.330 0.238 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375679 PGLNCHOQYZJMHT-AVRDEDQJSA-N 460.299 0.094 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]cnc3n2)[C@H]1c1cccnc1)[C@@H](F)Br 1808661272 HOVLZBMPZUNNNK-TUKIKUTGSA-N 478.282 0.823 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc2n(n1)CCCC2 1809865229 PFPLCTYEQXLPEP-AUSIDOKSSA-N 473.342 0.928 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cc1 1809968320 RLHJLGRDODNUJZ-UHFFFAOYSA-N 498.410 0.857 50 20 JCGD Cc1nccc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)n1 1810301930 DXFCBVJAVMVYOQ-JXFKEZNVSA-N 460.498 0.812 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810303248 RIOKBZNITSHPAQ-KUDFPVQQSA-N 481.557 0.705 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810304142 ABQDXNMZYPTWNL-ZNRXUEPQSA-N 484.513 0.016 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cnc3c(c2)CCNCC3)[C@H]1c1cccnc1 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NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(C(N)=O)cc1)CC2 1819801957 VZSRCPUYZKHOLV-CYBMUJFWSA-N 479.522 0.780 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1821684470 HXEGKGUXCAXDQZ-SUMWQHHRSA-N 458.280 0.957 50 20 JCGD CCOc1ccc(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)nn1 1821754497 RWVMMKFTTRNJOU-CQSZACIVSA-N 467.316 0.551 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cncn1)CC2)NC(=O)NCc1ccccc1 1822518745 SKQULMCNTHTQDS-INIZCTEOSA-N 497.585 0.693 50 20 JCGD O=C(c1cccn2c(O)nnc12)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059125 FITMVSVGLKQOFM-FQEVSTJZSA-N 477.330 0.662 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)CCl)CC2 1828308400 VVJBYTWXGBXBKS-ZMLRMANQSA-N 489.982 0.424 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2n[nH]cc2[N+](=O)[O-])CC1 1828923912 CUDROTTZGWIWDD-MRXNPFEDSA-N 470.490 0.864 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(CO)on2)CC1 1828924124 JEBWHFQLBBMGDG-IBGZPJMESA-N 456.503 0.713 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CN3CCSCC3)CCO2)C1 1829715926 DQXYEAZYPBYEAB-YJBOKZPZSA-N 464.426 0.665 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3cccc(C)n3)CCO2)C1 1829722652 TVILZPWCZBASTD-RWPQRYAXSA-N 494.552 0.994 50 20 JCGD Cc1nn(-c2ccccc2)c(O)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830725728 RJFXWPSEUBKDPT-HTAPYJJXSA-N 478.933 0.556 50 20 JCGD O=C(c1cn2ccc(Cl)cc2n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830731661 NFTJTZJRDNKIOY-KXBFYZLASA-N 457.314 0.657 50 20 JCGD COc1cc(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1OC 1830732760 ADKAKCPGJSINEE-KKSFZXQISA-N 456.923 0.682 50 20 JCGD O=C(c1cccc(N2CCOCC2)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732946 COGAHVCPPOQYQJ-UGKGYDQZSA-N 467.950 0.193 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830738697 RQFFSAMEKLJXRZ-UWJYYQICSA-N 450.923 0.552 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cn1cc([N+](=O)[O-])cn1)CCO2 1832801254 XTDZHAVFAHMHQJ-GOSISDBHSA-N 455.544 0.099 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cncc(F)c1 1834254301 WIALTGQZMCTCSF-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)ncc1[N+](=O)[O-] 1835187020 ADQUCLRWZGBYMZ-UHFFFAOYSA-N 495.345 0.477 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCN3CCN(C)CC3)CCO2)C1 1835400009 HPTCURFWHHQRIY-PXNSSMCTSA-N 475.428 0.111 50 20 JCGD COc1cc(F)c(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(F)c1 1835931742 AJTXWKLCKVOEIZ-HSZRJFAPSA-N 490.268 0.037 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3cc4cc(F)c(F)cc4[nH]3)C2)C1 1835937188 ROFCRUCDTLQKSM-XMMPIXPASA-N 499.279 0.510 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCO1)CCO2 1836221563 FMGFYWZGECJZHY-DENIHFKCSA-N 477.470 0.769 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836681143 SVHOEPQBVRWSNP-SJORKVTESA-N 477.986 0.470 50 20 JCGD Cc1cccc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)[nH]c12 1836857144 SMUYPCKWIBUUJT-DEOSSOPVSA-N 471.558 0.919 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c(F)c1F 1837461530 XWZDBSHHAYMBKM-HSZRJFAPSA-N 489.479 0.656 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccn4cncc4c3)CC2)CC1 1837921283 UQYLHEFFJUZZLV-UHFFFAOYSA-N 476.342 0.940 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1 1838030789 BMHXASFHOMDJEQ-KKSFZXQISA-N 463.922 0.796 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1=Cc3ccccc3NC(=O)C1)CCO2 1838446199 ASJBELQLDAMSRE-RUZDIDTESA-N 499.568 0.242 50 20 JCGD O=C(c1cnc2snnc2c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1838508917 DUXBVQNUHBLBPL-LRDDRELGSA-N 474.312 0.847 50 20 JCGD CN(C)c1ccc([N+](=O)[O-])c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1838542541 HXNIUWZMZONCCD-FXAWDEMLSA-N 470.910 0.331 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)C1 1839129330 QCDXZWQSURJIAS-JKSBSHDWSA-N 489.997 0.690 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1839145989 SNZZTLDSGDKJFX-AVYPCKFXSA-N 453.927 0.069 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1839200462 IFVNDHYXAKWTBJ-HDMKZQKVSA-N 459.316 0.098 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c([N+](=O)[O-])c1 1839232520 MPENLMYDZKMESQ-PXNSSMCTSA-N 471.894 0.202 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1840077712 HHGYCRJLBQCDMS-WOJBJXKFSA-N 485.405 0.749 50 20 JCGD COc1cccc(Cl)c1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840186553 ATSVJMZIJPJNSX-QFIPXVFZSA-N 482.965 0.792 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)c(OC)c1OC 1841435337 GHEDDYPHTJXLNC-XYOKQWHBSA-N 480.326 0.923 50 20 JCGD O=C(c1ccc(Br)c(O)c1)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012033 XEKMCTBCZPESQN-UHFFFAOYSA-N 459.105 0.965 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014816 FDLKGDRWEFNDMF-GOSISDBHSA-N 469.347 0.440 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC2(CCCN2C(=O)CCC(=O)NN(C)C)C1 1846385220 FPBOSSAPNKAIHM-UHFFFAOYSA-N 461.475 0.710 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCn1c(=O)[nH]c(=O)c2ccccc21 12702934 XXPPQJKXHNFCBC-UHFFFAOYSA-N 458.500 0.143 50 20 JCGD Cc1nc2ccccn2c1C(=O)NNC(=O)CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1 14842055 BSZYVBFALOTPHJ-UHFFFAOYSA-N 498.565 0.717 50 20 JCGD CCCn1nc(C(=O)NNC(=O)Cn2c(=O)ccn(Cc3ccccc3)c2=O)c2ccccc2c1=O 14847202 FVIADRIUFBMCDI-UHFFFAOYSA-N 488.504 0.639 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc1 15948177 JYBDTWDYBWCMJA-UHFFFAOYSA-N 451.526 0.949 50 20 JCGD C#CCNS(=O)(=O)c1cccc(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)c1 17191052 WGLLYVGZJWAOMR-UHFFFAOYSA-N 453.480 0.403 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)NCCC(=O)N2CCN(c3ncccn3)CC2)cc1C 726710555 GDERNHIXVGGPDH-UHFFFAOYSA-N 455.519 0.542 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2cc3c(cc2Cl)NC(=O)C3)c1 728014340 AVPDGOFQPBPQCB-UHFFFAOYSA-N 472.932 0.708 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)N3CCCC3)c(C)o2)n1 728727817 LNALFDUNZDKXCM-UHFFFAOYSA-N 470.529 0.684 50 20 JCGD Cn1nc(C(=O)NNC(=O)c2c(F)ccc(S(=O)(=O)NC3CC3)c2F)c2ccccc2c1=O 729833314 DTFNIUSJOHFXMH-UHFFFAOYSA-N 477.449 0.727 50 20 JCGD Cc1oc2ncn(C)c(=O)c2c1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 768569822 UJWDTEZPBZLQBT-UHFFFAOYSA-N 459.484 0.694 50 20 JCGD Cc1cc(Br)cc2c1NC(=O)C2=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O 915048610 IEKUSCPDMMVRKP-UHFFFAOYSA-N 467.305 0.115 50 20 JCGD CN(C)Cc1cccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)c1 916569014 XSZCVMUIRIIGQD-UHFFFAOYSA-N 461.592 0.906 50 20 JCGD C[C@@H](NC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)c1ccc(S(=O)(=O)N(C)C)cc1 918106066 XBRMEENNTLJADZ-CYBMUJFWSA-N 472.527 0.889 50 20 JCGD O=C(NCCNC(=O)c1ccc(F)cc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 919916269 FPHCUGLXRRREBQ-UHFFFAOYSA-N 493.517 0.221 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1nccc2[nH]ccc12 1777902477 UUDYQGCLPUJXDN-HYBUGGRVSA-N 462.315 0.684 50 20 JCGD C[C@@H](NNc1ccccc1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029719 XNNBUHMKQWBPPO-WAIKUNEKSA-N 467.530 0.134 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccnc4c3OCO4)C2)C1 1780029407 USMSRXLZTSUZCR-PWYGXMRTSA-N 468.470 0.388 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccnn1)C2 1780054260 FXYOZIITXZNVPO-DENIHFKCSA-N 486.485 0.939 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1780918392 LNTASUVKTDWAAF-UWJYYQICSA-N 450.923 0.952 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)C(C)(C)NCCC#N)CCO2)NC(=O)NCc1ccccc1 1780969640 IJRLMZBZLLDZKV-VWLOTQADSA-N 499.616 0.444 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[C@@H]1Cc2ccccc2N1 1781587205 IJIJDNVSSACYHE-SGIRGMQISA-N 463.343 0.531 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1cn3c(nc1=O)SCC3)C2 1782173938 UCJOUEJTPCBBLW-GCKMJXCFSA-N 485.006 0.659 50 20 JCGD O=C(CCNC(=O)c1ccccc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)CCl)C2 1783101187 DOVBAAZPBKARBC-NJNPRVFISA-N 451.951 0.920 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CN(C(=O)OC(C)(C)C)CC[C@H]1O)CCO2 1783874533 ILTQPAZCRYBTMB-FSTVOOFJSA-N 489.997 0.688 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)[C@H](Cc3cnc[nH]3)NC(=O)OC(C)(C)C)CCO2)C1 1783878828 KDBOCPJIIXBCAU-HYFFOGBASA-N 499.996 0.929 50 20 JCGD CN1CCN(c2ccc(C(=O)N3CCO[C@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)cc2)CC1 1783932776 FCOOLPIKXRHBIV-VWLOTQADSA-N 486.617 0.255 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4n(n3)CCNC4=O)C[C@@H]21 1783968259 SEDKPWMQSHZQOI-DVZHBHJUSA-N 468.352 0.251 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784092069 GPOSQBPAFGPSLZ-SOMFZHDCSA-N 489.997 0.184 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)ccc21 1784093568 YTVNGMDVXDEPSN-USJZOSNVSA-N 450.923 0.070 50 20 JCGD COc1ccc(Cl)c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1 1784944320 HHARODGLEMJPQY-JOCHJYFZSA-N 458.707 0.786 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1785284333 XCVAWNVFUKRGNX-XMMPIXPASA-N 480.525 0.144 50 20 JCGD O=C(CCBr)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccn4c(O)nnc34)C[C@@H]21 1786405845 FOTBJJMXVUODRG-UBHSHLNASA-N 452.309 0.813 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/c3ccccc3N)[C@H]2C1 1786905109 SXENDVBPGXTZLM-FNLSNQLSSA-N 464.526 0.574 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786980052 DBZAELADWQLAOX-YYWHXJBOSA-N 495.341 0.234 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c4cnccc34)[C@H]2C1 1788455122 HJLUHBSUXBREOW-GMVOTWDCSA-N 463.498 0.469 50 20 JCGD CCOC(=O)c1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1F 1789227954 VPMNPIZCRFJWBI-NDXORKPFSA-N 498.316 0.589 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C[C@@H](O)CNC(=O)OC(C)(C)C)[C@H]2C1 1789935828 KSZCMOKOOOSUJT-QEOTZNIISA-N 477.986 0.496 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCN4C)C[C@@H]21 1791291057 JOWRLYLAENNAIT-ZJOUEHCJSA-N 457.575 0.645 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C(Cl)Cl)[C@H]2C1 1791292392 CHAPAZHOAVMLNC-CYDGBPFRSA-N 454.351 0.655 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1 1791293917 OAIBDZPKSUAGGB-WDSOQIARSA-N 475.546 0.831 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)Br)C[C@@H]21 1791543621 HJTKTMNRTDZDKB-UUAYOZFRSA-N 470.368 0.220 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1coc(Cl)n1)NC(=O)NCc1ccccc1 1794395870 OHYBPJHONGDOSM-HGKCTWBKSA-N 490.948 0.877 50 20 JCGD CC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1795143062 KFDOUMDYWVSTFB-HATOLVCRSA-N 459.547 0.291 50 20 JCGD COc1ccc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c1 1795736858 LCPUTLOTWUBEPM-YVWYUNDQSA-N 458.707 0.545 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796893247 VKHHXTYMHHBMBX-YPPYOEKHSA-N 482.545 0.229 50 20 JCGD CC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](NC(=O)c1ccccc1)[C@@H](C)O)C2 1799264429 JLWTXCHLUFQNEZ-JITAAIDCSA-N 451.951 0.773 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799349566 YWUJJDSARJTJAV-OGMFBOKVSA-N 482.347 0.542 50 20 JCGD O=C(CCBr)NC[C@@H]1CCN(C(=O)CN2CC(=O)NC2=O)[C@@H]1c1cccnc1 1806343868 ZUCDOCLDHQZLDR-SUMWQHHRSA-N 452.309 0.424 50 20 JCGD O=C(CCC(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)N1CCCC1 1806647686 UXEQIVCCDFPPTP-UHFFFAOYSA-N 455.364 0.614 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(=O)OC(C)(C)C 1806722503 WDMJZSZCCQNUOW-DENIHFKCSA-N 496.373 0.948 50 20 JCGD CC(C)(NCCC#N)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807144771 ANVCPFNUYJCZTN-FPOVZHCZSA-N 463.347 0.363 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc3c(c2)CNC3=O)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361819 UFPZCNRQEOBVBL-XXBNENTESA-N 484.321 0.638 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@H]2C[C@@H](O)C2)[C@H]1c1cccnc1 1808417957 UKDIWRPHXAWRIL-YRNRYTTQSA-N 452.515 0.992 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nc1 1808895631 TWHPRJGZDMABLR-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnc3[nH]ncc3c2)[C@@H]1c1cccnc1 1809707270 ZWUNTLJAJAVJRO-YWZLYKJASA-N 485.508 0.985 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810295686 VNEHBQAKVFUJFJ-CHBUMTKESA-N 477.525 0.258 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)Cc2cncnc2)[C@H]1c1cccnc1 1810295699 VRMZQQGDPBLYEV-UTKZUKDTSA-N 460.498 0.432 50 20 JCGD Cn1nc2c(c1C(=O)NC[C@H]1CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]1c1cccnc1)CCC2 1812224507 HXHOIUSXBSUDHO-GCJKJVERSA-N 473.342 0.617 50 20 JCGD COC(=O)CSCC(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813068260 KZJRLXLFMQLIRE-KKSFZXQISA-N 465.576 0.367 50 20 JCGD C[C@H](Cn1cccn1)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813069693 AAHIYEOOAAAUSB-LZNRXBQRSA-N 455.563 0.993 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2ccc3c(n2)OCCO3)[C@H]1c1cccnc1 1813071726 WBEGGQGXGZTRSH-JTSKRJEESA-N 482.541 0.940 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1 1813072301 AFUKQPITSVBYFL-WCAVRKLYSA-N 495.584 0.674 50 20 JCGD O=C(CCc1cnccn1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813442100 CXDGLGYXDKWZOE-WMZHIEFXSA-N 459.315 0.504 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)CN2C(=O)CSC2=S)[C@@H]1c1cccnc1 1814190891 CXOFTQLFZOARKV-YWZLYKJASA-N 492.627 0.321 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)[C@@H](O)CCl)n[nH]1 1814877878 NBGAIMFGTSURIV-PMPSAXMXSA-N 451.915 0.472 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337057 KHCVDUZOQDMKGX-HNNXBMFYSA-N 458.349 0.211 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H](O)Cc1ccccc1)CC2)c1ccc(B(O)O)cc1 1815348572 PSCFKSAEXZEQIG-PKOBYXMFSA-N 465.340 0.652 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H](O)Cc1ccccc1 1822078769 COCMYLOHVVBEJS-RTWAWAEBSA-N 462.315 0.999 50 20 JCGD C[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(=O)n3[nH]nnc3n1)CC2 1825642209 PTBLLJUAVCAVAZ-BQBZGAKWSA-N 467.309 0.278 50 20 JCGD O=C([C@@H](O)CCl)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H]3[C@H]4COC[C@H]43)C2)C1 1828550854 DSOXYDYMGVJEAP-JPNCOXSSSA-N 491.972 0.931 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828926516 MASBQCLPCLFNFY-QZTJIDSGSA-N 459.551 0.365 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(O)nc(O)c3)C2)C1 1830538993 XZHBTLUVWQOONR-SGTLLEGYSA-N 458.309 0.594 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830730759 DJKMFRQZRFMRGX-HRAATJIYSA-N 453.923 0.072 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830735671 LKGQVMNHSYYBMO-VQIMIIECSA-N 457.867 0.279 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CC1 1830737333 DGSJLKYEIRKXHU-JTSKRJEESA-N 489.997 0.690 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C1CCC(F)(F)CC1)CCO2 1831002527 GQIIEGHXQTYSOS-OAQYLSRUSA-N 466.290 0.262 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cc(C(=O)O)ncn2)CC1 1831872138 PRHFNWKKARHWGV-SFHVURJKSA-N 460.535 0.781 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)c3cccnc3)CCO2)C1 1832729540 HRYLBKIHSQJKES-LIRRHRJNSA-N 469.336 0.051 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834800380 FKDZZMXGRCHIMR-OAHLLOKOSA-N 480.212 0.583 50 20 JCGD CC(C)N[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)C 1834800934 BJTKEOXGNTUMBL-HSZRJFAPSA-N 472.439 0.574 50 20 JCGD Cc1cc(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)no1 1834801470 NEUMNDWWPWUELJ-UHFFFAOYSA-N 454.336 0.091 50 20 JCGD O=C(CCBr)N1CCO[C@@]2(COCCN(C(=O)c3[nH]nc4ncccc34)C2)C1 1834822554 VBDXMBIZBJIGMI-SFHVURJKSA-N 452.309 0.813 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834823737 HHNGYNPOWVINTJ-NRFANRHFSA-N 499.358 0.691 50 20 JCGD CCc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)n(C)n1 1835737980 PJAQIBIKRSRNHM-UHFFFAOYSA-N 482.589 0.480 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)CO[Si](C)(C)C)CC2)CC1 1835837093 TWRADUWWKUOMKW-LJQANCHMSA-N 456.660 0.561 50 20 JCGD Cc1cn(CC(=O)N2CCC(N3CCC(NC(=O)[C@@H](F)Br)CC3)CC2)c(=O)nc1O 1836414291 CDILWLLSWZSGRK-MRXNPFEDSA-N 488.358 0.519 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCN(C(=O)OC(C)(C)C)C1)CCO2 1836638261 FUNFVERMHGZZIB-JLHGSKIFSA-N 489.997 0.954 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)[C@H](O)CCl)CC3)CC2)cn1 1836718114 SDVBFSYLJBASEJ-LJQANCHMSA-N 488.006 0.838 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cc(C)on3)CCO2)C1 1837550354 ZYNHLEGDQPUFBJ-AUUYWEPGSA-N 487.351 0.343 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnccc1Cl)CCO2 1837776335 YSAOVSPOGCEYLF-WGLQLPMYSA-N 488.932 0.939 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)N1C[C@H]2C[C@H]2C1 1838370519 PXOVBOKWRNRQKO-QRVBRYPASA-N 463.623 0.698 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3OCCC4)C2)C1 1839154844 ZXIQZIQLUXHPBD-RBUKOAKNSA-N 461.346 0.972 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1 1839939113 CLECUHOMHGEYES-DEOSSOPVSA-N 460.575 0.757 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cncc(C(F)(F)F)c3)C2)C1 1840185488 NIZJSRSYKKIWIH-FQEVSTJZSA-N 487.479 0.543 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1841515351 OKGFXFHZIYZWCW-UHFFFAOYSA-N 490.561 0.434 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccccc1F 1845262293 GUJLIGLCLUNADL-HSZRJFAPSA-N 482.516 0.693 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)c(C)c1 1846921667 ZGIBWYBURQLAPT-UHFFFAOYSA-N 451.483 0.911 50 20 JCGD CS(=O)(=O)CC[C@H](NC(=O)c1ccccc1Br)C(=O)NNC(=O)c1ccccn1 20887981 QYWGEVIPLZFUNW-HNNXBMFYSA-N 483.344 0.838 50 20 JCGD Cn1cnnc1SCc1ccc(C(=O)NNC(=O)Cn2c(=O)[nH]c(=O)c3ccccc32)cc1 26751557 HNGOLDMSSLBNPY-UHFFFAOYSA-N 465.495 0.572 50 20 JCGD O=C(CN1CCN(C(=O)NNC(=O)CNC(=O)c2cccs2)CC1)NCc1ccccc1 725872486 PQTIUTWMHJXZCV-UHFFFAOYSA-N 458.544 0.153 50 20 JCGD CC1CCC(NC(=O)CN2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)CC1 728302355 NBSSMLYNXZOBDM-UHFFFAOYSA-N 493.634 0.647 50 20 JCGD C[C@@H](C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)S(=O)(=O)c1ccc(F)cc1 728329578 CDRYMCLFEINUSC-YVEFUNNKSA-N 466.443 0.519 50 20 JCGD CC(=O)c1ccc(S(=O)(=O)N(C)CCCC(=O)NNC(=O)CNC(=O)c2cccs2)cc1 751208611 GUSRIJRPNJZETN-UHFFFAOYSA-N 480.568 0.929 50 20 JCGD O=C(COC(=O)[C@H]1C[C@@H](O)CN1S(=O)(=O)c1ccc(Cl)cc1)NNC(=O)c1ccccc1 771189370 QCHOJWMKZXRXDH-NVXWUHKLSA-N 481.914 0.468 50 20 JCGD COc1cc(C(=O)NNC(=O)c2sccc2S(=O)(=O)N2CCOCC2)cc(OC)c1OC 789985902 LEXKSENCFUJGFP-UHFFFAOYSA-N 485.540 0.870 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCc1c(C)n[nH]c1C)c(=O)n2Cc1ccccc1 914847289 DNTRBVNZXZCEFN-UHFFFAOYSA-N 492.540 0.548 50 20 JCGD C[C@@H](O)CNS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)cc1 915487033 XFDVHGJDUIQUTB-GFCCVEGCSA-N 469.903 0.617 50 20 JCGD Cc1ccc(OCC(=O)NNC(=O)NCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 915921800 KPKCPLWMVGGHKO-UHFFFAOYSA-N 462.528 0.925 50 20 JCGD C[C@@]1(NNC(=O)NCc2ccc(S(=O)(=O)NC[C@H]3CCCO3)cc2)CCS(=O)(=O)C1 916649876 VMNCCORPHRLVCO-CRAIPNDOSA-N 460.578 0.025 50 20 JCGD COC(=O)CCOc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 917719245 BTQVVURUNVTCJE-UHFFFAOYSA-N 485.540 0.502 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCCc3ccccc32)c1)N[C@@H]1CCS(=O)(=O)C1 919884000 FQBDBRRVSOXRTM-QGZVFWFLSA-N 492.579 0.959 50 20 JCGD CN(C1CCCCC1)S(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)cc1 919885670 QBQXHZCBHSRVRQ-HNNXBMFYSA-N 472.589 0.771 50 20 JCGD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)c2)C1 919886518 UNYNQZBFITUCPR-IIAWOOMASA-N 472.589 0.484 50 20 JCGD CC(C)(C)NS(=O)(=O)c1ccccc1CNC(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 920919566 UBIJEXZLDUUXKM-UHFFFAOYSA-N 472.531 0.883 50 20 JCGD COc1cc(OC)cc(C(=O)NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)c1 921018760 BQVUMVHELWFFSZ-UHFFFAOYSA-N 454.530 0.844 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](Br)Cc3ccccc3)CCO2)C1 1778788689 JCZFFCAKAHUWPH-LZJOCLMNSA-N 498.374 0.887 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Nc3cnccn3)C2)C1 1779054373 IQIUOQRFSQXLOB-WVCNJGOASA-N 468.518 0.241 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccc3nncn3c2)C1 1779072349 KBZHDFIOKOVZBR-VGOFRKELSA-N 457.535 0.230 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1csc(N)n1)C2 1779373410 PEDCPZACTLSDAK-FOIQADDNSA-N 459.532 0.165 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(CCN(C(=O)c3csc(C(F)(F)F)n3)C2)C1 1779756074 VKSJDOUQMPNKCD-GOSISDBHSA-N 469.250 0.599 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)CCS(C)(=O)=O)CCO2)C1 1780098970 MLOUAAYCBKSNSA-FQEVSTJZSA-N 483.499 0.398 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1780852570 QKYYROHAXYCWPG-QHCPKHFHSA-N 453.499 0.841 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccns1)CCO2)NC(=O)NCc1ccccc1 1780970273 SZIVZUCITAMXOT-QFIPXVFZSA-N 472.571 0.933 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1781335192 WBXQXRZNADAJEY-WPKBUWHJSA-N 457.300 0.720 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1781374517 ASTGJPBGQFHJTP-MWTRTKDXSA-N 453.499 0.596 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnn4c3OCCC4)C2)C1 1782277455 KJVWTUNCSTWGNJ-IBUSPFOHSA-N 469.502 0.243 50 20 JCGD O=C(CCCn1ccnc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782483729 OYHMKKNCLNFSMB-NFBKMPQASA-N 454.336 0.171 50 20 JCGD CN[C@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1)C(=O)O 1783023947 RJNDUQDBDDKCRI-FVJLSDCUSA-N 482.375 0.885 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1783550123 AMIVSSAXVPVJKZ-RPQNVMPDSA-N 457.955 0.816 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(CCN(C(=O)C3=COCCC3)C2)C1)NC(=O)NCc1ccccc1 1784005093 AYYOZWQCJVTBPT-DEOSSOPVSA-N 471.558 0.857 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784084160 MKQXTIQSSLPTCH-NXOAAHMSSA-N 477.986 0.497 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](Cl)COC)CCO2 1785575792 CQXUWVUERBQKHN-XFQAVAEZSA-N 457.955 0.987 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-c4ccccc4)no3)C[C@@H]21)c1ccc(B(O)O)cc1 1786981043 MUCFTBGRFPKOEQ-LEDOBFOHSA-N 475.310 0.929 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc(Cl)n3)C[C@@H]21 1788610963 CMUICPFKYZHBOS-PJODQICGSA-N 459.894 0.036 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](Br)Cc3ccccc3)[C@H]2C1 1790779417 DCYGJHZSSWMIJN-FKSLSLAPSA-N 495.418 0.565 50 20 JCGD COc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)cn1 1793892898 XWFHVQNNFIGCFC-ZMQIZJGTSA-N 482.541 0.746 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1c[nH]c2nccc-2c1Cl 1796221564 HDLQGWSSLXLVAV-HBCWATKFSA-N 468.706 0.365 50 20 JCGD C[Si](C)(C)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)co1 1797723831 WASSTIPSMIIYGS-XEMDLRDOSA-N 456.380 0.022 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(=O)nc3sccn13)C2 1797957548 MXRPPHGEXBODQD-FVCICTRLSA-N 450.593 0.811 50 20 JCGD N#Cc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc(C(F)(F)F)c1 1799784677 KHOIYEBPTIPMMT-XEMDLRDOSA-N 487.243 0.774 50 20 JCGD C[C@H](NC(=O)c1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1799812512 PEASNDDLGRWQBL-VJICWTENSA-N 467.306 0.576 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(I)cnn1C)C2 1800977758 FJAZYNPOXRQOON-NOHGZBONSA-N 496.733 0.482 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(O)CCN(C(=O)OC(C)(C)C)C1 1801050605 SQHSIDRGCPAADV-VPEYGQHGSA-N 475.970 0.202 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCO3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365882 ZLUZSVCNEOXCRS-XMSQKQJNSA-N 475.314 0.374 50 20 JCGD Cn1ccc2c(O)ncc(C(=O)N3CC[C@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)c21 1807373427 AWOIRUYPFQMAJB-XMSQKQJNSA-N 499.336 0.987 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc3nn[nH]c3c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374568 ZZRDOTFFJLZWIG-AVRDEDQJSA-N 470.298 0.666 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374959 LTOHTQWQHCGQIJ-CRAIPNDOSA-N 479.220 0.187 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808439232 JVNOBFMEPJTWHJ-DENIHFKCSA-N 465.315 0.590 50 20 JCGD COCCn1ccc(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1808657583 MHCPJTOYRZZDMK-UTKZUKDTSA-N 492.540 0.556 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1)[C@H](F)Br 1808679428 XYOLHFIHKNEHTG-UAGQMJEPSA-N 461.332 0.065 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810306410 YTYIBGSHZIBMGQ-OXJNMPFZSA-N 497.556 0.924 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2CCCC3(CCN(C(=O)c4cccc(B(O)O)c4)CC3)C2)cn1 1810437130 HAJHWQFGCXMUAL-UHFFFAOYSA-N 499.398 0.465 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1812865114 UVIZZBYNVLDFSZ-QANKJYHBSA-N 460.137 0.864 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813068656 PLISRZMLIMZONP-NQIIRXRSSA-N 460.579 0.623 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](C)CS(C)(=O)=O)CC2 1817275735 BLSYEAZPCSGEJS-VDGBYBFQSA-N 494.599 0.870 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)/C=N/O[C@@H]2CCCCO2)[nH]n1)c1cccc(B(O)O)c1 1817476564 WVTRHIKZJYUJER-CJLXMBDASA-N 469.307 0.924 50 20 JCGD COC[C@H](Cl)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800626 QDZFLQXEHKXIEF-CABZTGNLSA-N 452.924 0.621 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1ccc2nn[nH]c2c1 1821605541 FEBLANHLWCJBFR-IBGZPJMESA-N 459.275 0.981 50 20 JCGD COC(=O)C1(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)CC1 1825278336 VWLCQZOHNSTSJJ-SNVBAGLBSA-N 458.500 0.321 50 20 JCGD O=C([C@H](O)CCl)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H]3C[C@@H](O)C3)C2)C1 1828550989 FQIVZVBRZAYKPN-ISJRUSPKSA-N 479.961 0.809 50 20 JCGD NC[C@H](N)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1829046640 CSFRGDIBCHMBOA-TWOQFEAHSA-N 455.918 0.259 50 20 JCGD C[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1830719312 BUHPHRRFZSTQCL-STXHMFSFSA-N 463.959 0.203 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1830885769 KMBUBVPLAYDWBH-DJJJIMSYSA-N 484.377 0.522 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CC1 1831870815 GXVCHHSNBFMRNV-OALUTQOASA-N 497.637 0.865 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)N3CCCC3)CCO2)C1 1832420005 XZYJLJCWJFMCGN-UZLBHIALSA-N 474.396 0.876 50 20 JCGD CC(C)c1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)co1 1833350692 KJUJYRTURRYQOK-OAQYLSRUSA-N 451.524 0.241 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CN3CCS(=O)(=O)CC3)CC2)CC1 1833712964 KLGSZAAEPNGDON-IBGZPJMESA-N 477.071 0.696 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(Cl)s1)CCO2 1834055738 ZXSRZDAXAFJZKS-HXUWFJFHSA-N 464.736 0.465 50 20 JCGD Cc1ncc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)s1 1835737816 DNWKDCBEQXLWOQ-UHFFFAOYSA-N 471.587 0.949 50 20 JCGD O=C(Cc1ccc(Cl)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929599 YDQCSGMHFQRGEF-QHCPKHFHSA-N 472.734 0.333 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)ccc1C 1835931288 LGDYXYVOPQZJJZ-XMMPIXPASA-N 468.315 0.067 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1 1835934014 KEBTUPIWNKYBIM-NRFANRHFSA-N 466.290 0.262 50 20 JCGD O=C(c1ccc2cc[nH]c2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835936738 AMAXLKVYVBSOFE-XMMPIXPASA-N 463.299 0.232 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836474103 SMWFTVBCKKVOSN-ZJNRKIDTSA-N 498.346 0.019 50 20 JCGD C[C@@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CN3C(=O)CNC3=O)CC2)CC1 1837047113 HXVIELKIPMLVOW-GFCCVEGCSA-N 459.341 0.320 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3scnc3C3CC3)C2)C1 1837456741 MURBVGZCXVWFCX-QFIPXVFZSA-N 486.554 0.403 50 20 JCGD CCn1nc(C)cc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919419 PGVXELKORQFKFX-UHFFFAOYSA-N 468.363 0.817 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)Cc3ccccc3)CC2)CC1 1838764333 GQBZHLFUJLTFDY-QFIPXVFZSA-N 474.602 0.962 50 20 JCGD O=C([C@@H](Br)Cc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCO2 1839079720 KBUJNIWBUPUEFH-ZVVDCOBXSA-N 496.402 0.172 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1 1839203073 YUGPBQYIMGIDTA-WQGACYEGSA-N 455.277 0.695 50 20 JCGD CC(C)(C)OC(=O)NCC[C@H](O)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1839204320 NMBCVRZGTWGFIL-DJJJIMSYSA-N 484.377 0.522 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)ccc1C 1839402966 SVJWMBHCFLZDKY-VWLOTQADSA-N 495.341 0.017 50 20 JCGD COC(OC)C(=O)N1CCOC[C@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839742168 QNPOFDUNIAQMNF-NAVGAYGYSA-N 465.453 0.947 50 20 JCGD O=C1CC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)=NN1 1839802303 RMWNSZUOJVVQFS-IERDGZPVSA-N 493.358 0.325 50 20 JCGD COc1cc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc(OC)c1OC 1839804676 VZILPYALSZCDQT-UYKGIYJLSA-N 498.960 0.782 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CCN3C(=O)c4ccccc4C3=O)C2)C1 1840150916 SLRDTLPGDUBDFW-JPYJTQIMSA-N 493.944 0.383 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)nc4ncccn34)C2)C1 1840152731 RGZFIGRDUATUJJ-QRWLVFNGSA-N 451.911 0.362 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C(=O)Nc3c(C)cccc3C)C2)C1 1840154797 GZBMLWLTQURFPL-VGOFRKELSA-N 467.950 0.952 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(NC(C)=O)c3ccccc3F)C2)C1 1840155310 WZVDOXHGURQVIE-YSZBQJHXSA-N 499.967 0.887 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3c[nH]c4ncccc34)C2)C1 1840184435 MLXMZSMKYVNBRH-JOCHJYFZSA-N 458.519 0.006 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)cc(Cl)c1)CCO2 1840711566 WXRGFABGFVLXMD-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012022 VVNSASNGQGKYRD-OAHLLOKOSA-N 453.279 0.141 50 20 JCGD CC(C)(C)OC(=O)N1Cc2[nH]nc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)c2C1 1843013597 NYUIPZJTAJQEBW-UHFFFAOYSA-N 495.345 0.471 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@H]1Cc3[nH]nc(C(F)(F)F)c3C1)C2 1844265023 LRNJMRVUGJJSAP-LLVKDONJSA-N 477.447 0.659 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1CCC(=O)NC1)C2)NC(=O)NCc1ccccc1 1845038270 LGRNSANTTWLFRB-GOSISDBHSA-N 456.547 0.062 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)C1 1845824442 QSKNDIAJFTUMCA-OEAKJJBVSA-N 469.458 0.094 50 20 JCGD Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1S(N)(=O)=O 27230560 PXYZXFNOCRWSAB-UHFFFAOYSA-N 480.568 0.892 50 20 JCGD Cn1cccc1C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 726540274 BYTFJDHZYHVWMT-AWEZNQCLSA-N 476.964 0.221 50 20 JCGD NC(=O)c1cccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 726717678 AWSSDIYEXWDKSE-UHFFFAOYSA-N 459.528 0.757 50 20 JCGD CC/C=C(/C)C(=O)N1CSC[C@H]1C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 728018295 JHHBEJXEVHUMIT-DJXGBFBFSA-N 454.574 0.956 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NN=C1C(=O)N(Cc2ncon2)c2ccc(Br)cc21 728433740 FNFWKCZICIACRY-MRVPVSSYSA-N 471.293 0.137 50 20 JCGD C[C@@H]1Cc2cc(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)ccc2N1S(C)(=O)=O 728847782 OZSWYUVXWJZHCS-CQSZACIVSA-N 458.544 0.865 50 20 JCGD Cn1cc(Br)cc1C(=O)NNC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1 748212553 OQEOQKQVGUZUQR-UHFFFAOYSA-N 453.253 0.956 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=S)NC(C)(C)C)c(=O)n2Cc1ccccc1 769228317 UVUNYDFHKVOUJQ-UHFFFAOYSA-N 457.560 0.722 50 20 JCGD CN(C)S(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc([N+](=O)[O-])c2)cc1 789852164 DRBHSMSQYAMTFG-UHFFFAOYSA-N 450.429 0.463 50 20 JCGD C[C@H]1CN(CCC(=O)NNC(=O)CNS(=O)(=O)c2cccc(C(F)(F)F)c2)C[C@H](C)O1 912919596 PPBBBZPULGHSFF-STQMWFEESA-N 466.482 0.630 50 20 JCGD COc1ccc2c(c1)C[C@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)N3CCOCC3)c1)CO2 914775654 HTFDWIBXKABXGD-KRWDZBQOSA-N 475.523 0.728 50 20 JCGD CCCCS(=O)(=O)N1CCC[C@H]1C(=O)NNC(=O)CCN1CCN(c2ccccc2)CC1 915874416 FVWIHSRGXRZWJL-FQEVSTJZSA-N 465.620 0.940 50 20 JCGD CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)COc3ccccc3[N+](=O)[O-])cc2)CC1 916390888 UWGDIICUIRFXIL-UHFFFAOYSA-N 470.486 0.892 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1F 1779032840 XRGBPVPUWBYCQR-DEOSSOPVSA-N 499.499 0.758 50 20 JCGD C[C@H](C(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)N1CSCSC1 1779149760 SYHYEVLCXHAKCX-BEFAXECRSA-N 459.638 0.232 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1 1780220770 HXYUGBGEYDDVJT-OAQYLSRUSA-N 469.694 0.048 50 20 JCGD Cc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(-n2nccn2)c1 1780245646 RUHBUHZZNNXAOM-QHCPKHFHSA-N 469.546 0.392 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)CCc3cncnc3)CCO2)C1)NC(=O)NCc1ccccc1 1780970094 ROZSSRQSNUKYAN-VWLOTQADSA-N 495.584 0.585 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccon1)CCO2)NC(=O)NCc1ccccc1 1780970671 ZOTABBNKMJEJNE-JOCHJYFZSA-N 456.503 0.464 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)C1)CCO2 1783933576 QYTMSABACVVZPB-HOOSLVGPSA-N 495.621 0.883 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccccc3Cl)C[C@@H]21)c1ccc(B(O)O)cc1 1786979400 DPHQISFABKBRBX-CUWPLCDZSA-N 456.735 0.856 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc4cc(C)ccn4c3=O)[C@H]2C1 1788045090 CRKUZODQYSXPGD-DKIMLUQUSA-N 462.934 0.850 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)c(O)cc3O)C[C@@H]21 1788609988 JXDCHYQFEYGTJD-LLJZQGTPSA-N 489.916 0.657 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c[nH]c4nccc-4c3)C[C@@H]21 1788610496 WLSOOJMULWBOMR-JVPBZIDWSA-N 463.498 0.420 50 20 JCGD CN(C)NC(=O)CCC(=O)NC1(c2ccc(NC(=O)c3nccnc3C(N)=O)cc2)CCC1 1789948581 DTGQNHOCDSRRFU-UHFFFAOYSA-N 453.503 0.696 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5ccc(B(O)O)cc5)C[C@@H]43)cc2N1 1790501754 HXVLUBOVMOSMNV-VCOUNFBDSA-N 477.326 0.158 50 20 JCGD COc1ccc(CCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c(OC)c1 1790765933 ONQBRPUWGNSWKM-APTRMMRNSA-N 496.369 0.610 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCc3ccc(C#N)cc3)C[C@@H]21 1791287227 VRTMAWMEUBFLKX-ACRUOGEOSA-N 455.559 0.844 50 20 JCGD C[C@H](Cc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1791445610 KFRWCGPUMPXQRQ-BHVFFLMSSA-N 450.344 0.839 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCCCC1=O)C2 1793879273 UPSBHDUHLMJDGE-RCJHGTSTSA-N 486.997 0.721 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)c1 1794320747 BYXSZMVSCNESCR-ZMJPVWNMSA-N 464.313 0.379 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1occc1Br)C2)c1ccc(B(O)O)cc1 1795734371 NRMMDBMNTZIWEY-YWVIFJGQSA-N 463.093 0.239 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OCC3CC3)cc1F)C2)c1ccc(B(O)O)cc1 1795736336 ZWUWDJPDKXQVPQ-FEJSZKPUSA-N 482.317 0.811 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(OCC(F)(F)F)n1)C2)c1cccc(B(O)O)c1 1795737260 LNWMWJBNPMJXGR-CCWDJLKJSA-N 493.247 0.220 50 20 JCGD CN[C@@H](CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)C2)C(=O)O 1796092588 CFEAAQRMGHTPKO-RDGPPVDQSA-N 474.562 0.034 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cc(=O)n2[nH]cnc2n1 1796185460 GCECQYARFKDDJM-BTTYYORXSA-N 495.452 0.817 50 20 JCGD Cc1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)c(-n2nccn2)c1 1796188431 FIVRUZYVOGIXGX-ACDBMABISA-N 459.315 0.821 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCCO2 1797436153 AEYLULPMTUADFS-IHHIPJHASA-N 469.502 0.003 50 20 JCGD Cc1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](C)Br)C3)cn2[nH]cnc(=O)c12 1798466976 VUEYBMYHLTXFSK-FMSGJZPZSA-N 452.309 0.318 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1nc(N)n[nH]1)C2 1798524581 GPLCJASLXOGOLH-DBWKPXFBSA-N 487.473 0.056 50 20 JCGD CC1=C(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)CCO1 1799095016 PYMNIFOOJGNRBJ-HATOLVCRSA-N 471.558 0.617 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)c1ccc(F)cc1)C2 1800978354 BGEBCBDEDFRQJW-IVFVNLKQSA-N 455.914 0.787 50 20 JCGD O=C(CCc1c[nH]c2ncccc12)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1802063360 ABYNHWRCHZQPBC-OPMZPASUSA-N 462.315 0.079 50 20 JCGD COC(=O)[C@H]1CCC[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cnccc2C(=O)NN)C3)C1 1802258059 PEBOGUBUVXMDHQ-VIQHNZTISA-N 457.531 0.916 50 20 JCGD CC[C@H](C)[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803611959 BWCCBVZEOWYRON-QHERXFFYSA-N 454.531 0.807 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1 1807028315 JGPDUDRKMWMSPY-LNSITVRQSA-N 463.269 0.596 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)[C@@H](N)c2ccccn2)[C@@H]1c1cccnc1 1807170884 XHSJUDCMYDOSKA-CZAAIQMYSA-N 474.525 0.495 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnnc(Cl)c2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360583 CMCSLZHHGHNLIQ-OXQOHEQNSA-N 465.706 0.838 50 20 JCGD Cc1cnc2c(C(=O)NC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)cnn2c1 1809835559 MOQDQFIUYQNGMA-UGKGYDQZSA-N 484.325 0.746 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(C)(C)C 1810294680 MCHGXSDROSIBDK-JRGCBEDISA-N 495.584 0.951 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1 1811206584 ZDNZVTGXTVTBSD-LAUBAEHRSA-N 461.287 0.193 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)Cn2cccc([N+](=O)[O-])c2=O)[C@H]1c1cccnc1 1813073570 JSBQOFMHFQMDOL-JTSKRJEESA-N 499.528 0.231 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816673756 HJBSTMPXWKFOBE-HTQZYQBOSA-N 481.336 0.668 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cnncc2C(=O)O)[nH]n1)c1ccc(B(O)O)cc1 1817472073 GEVVCNFLWXHSQY-QGZVFWFLSA-N 464.247 0.197 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc4c(c3)n(C)c(=O)n4C)sc2C1 1818357905 BRVKKCVLALGKOI-CQSZACIVSA-N 499.597 0.932 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401578 ISOZTDPATBVRMC-OAHLLOKOSA-N 475.531 0.620 50 20 JCGD O=C(Nc1cccnc1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819528122 AHIWNGBTFPPXHG-SFHVURJKSA-N 462.275 0.429 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccnc1C(N)=O)CC2 1819794062 XJQDYEMVOSSSBN-SNVBAGLBSA-N 480.510 0.175 50 20 JCGD COCCn1nccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819796914 HRZSAZBPGPSGMC-GFCCVEGCSA-N 484.542 0.524 50 20 JCGD CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)[nH]n1)NC(=O)NCc1ccccc1 1820711136 KRFYUVZCJDWPGL-MJGOQNOKSA-N 496.572 0.884 50 20 JCGD C=C(CC(=O)OCC)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1820894556 NZNUACPUUVZNCA-SFHVURJKSA-N 454.292 0.905 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1824517854 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COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1829114591 JTJCCBNLTZSPDZ-HMKRNGOWSA-N 488.589 0.891 50 20 JCGD COC[C@H](Cl)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(=O)N(C)C)C2)C1 1829340237 GNHVTTHKJZNMRV-FDDCHVKYSA-N 494.976 0.781 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1831639975 HQCWOUVETIUBLL-UWJYYQICSA-N 452.939 0.675 50 20 JCGD Cc1ncccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1832640482 RTYPRODFHGLRPC-HSZRJFAPSA-N 461.563 0.152 50 20 JCGD C[C@@H](CBr)C(=O)NC1CCN(C2CCN(C(=O)c3c[nH]c(=O)cn3)CC2)CC1 1833263493 RLNFEQJMNQXUOK-ZDUSSCGKSA-N 454.369 0.986 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCN3C(=O)c4ccccc4C3=O)CC2)CC1)[C@@H](O)CCl 1833308063 HBAUWWIZKSZGTK-FQEVSTJZSA-N 490.988 0.844 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834797366 GMLHIHIGEJIMIZ-UHFFFAOYSA-N 481.406 0.817 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1834824187 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Cc1cc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1C(F)F 1836162499 HAQQIHWYNLYMNI-UHFFFAOYSA-N 489.332 0.765 50 20 JCGD C[C@@H](Oc1ccccc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837460010 QMCCTFXNIVWDJT-OSPHWJPCSA-N 483.525 0.223 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1837711861 ULQAQUUHODBMHT-HRAATJIYSA-N 489.642 0.180 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cncc(C(F)(F)F)c1)CCO2 1838181510 ZPKOTZANNRSQIR-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD CC[C@H](C)[C@@H](N)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528322 RACHCBCLTMUAHA-NQKDMWHGSA-N 492.529 0.964 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSCC(=O)O)C2)C1 1839967005 WHSQVJAXRBQOQT-BLLLJJGKSA-N 453.355 0.434 50 20 JCGD COC(=O)C12CC(C(=O)N3CCO[C@@]4(COCCN(C(=O)CO[Si](C)(C)C)C4)C3)(C1)C2 1840005611 KYQFJADUUQFCNS-XVAXZDLZSA-N 454.596 0.638 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c(=O)[nH]c1C 1840030944 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CC(C)(C)OC(=O)NC12CC(C(=O)N3CC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)(C1)C2 1783434383 IPTNUYHFMJGWBE-DDJHWDJXSA-N 499.373 0.257 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1ccccn1)CCO2 1783535205 ASTVUOOSQYCKNJ-NJSLBKSFSA-N 453.337 0.813 50 20 JCGD COCCOCCOCCOCC(=O)N1CC[C@@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1783679464 KGBHVYPSUPFDIO-OAQYLSRUSA-N 464.987 0.778 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)C3CN(C(=O)c4ccccc4OC)C3)CCO2)C1 1783867975 CWJAJRRXXPNVAE-WZONZLPQSA-N 479.961 0.851 50 20 JCGD O=C(C[C@H]1OCCc2ccccc21)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1784398141 OESDXBCEVWQKDS-LSUHJGNXSA-N 478.354 0.664 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(O)cc4)CC3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978771 SCAVLXIUNMIMKH-HSQYWUDLSA-N 464.327 0.397 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3OCCc4ccccc43)C[C@@H]21)c1cccc(B(O)O)c1 1786982665 CHTCRNGHWARXKL-HCUBDLJJSA-N 478.354 0.664 50 20 JCGD O=C(Cc1cc(F)cc(F)c1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1787076698 UKIRGYLJTMLKQL-NDXORKPFSA-N 458.270 0.481 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)Nc1ccc(C2(NC(=O)c3cnccc3C(=O)NN)CCC2)cc1 1789544520 MAENFZIGBAMURS-HXUWFJFHSA-N 497.508 0.928 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnnc3O)C[C@@H]21)NC(=O)NCc1ccccc1 1789726684 MVHIZVRAUKBKQA-IHPCNDPISA-N 497.556 0.122 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790293052 XPWSIBNHPPTHGP-ROOHIHILSA-N 498.496 0.514 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(-n4ccnc4)ccn3)C[C@@H]21 1791290664 IHHHANURVLCIFN-QRFRQXIXSA-N 469.546 0.234 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCCNC(=O)OC(C)(C)C)[C@H]2C1 1792256062 MVNFBXHYSXKKBP-BZSNNMDCSA-N 483.610 0.644 50 20 JCGD C[S@](=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](O)CCl 1793105871 FMIZQYPJESPQBC-JLVFJBGXSA-N 480.027 0.886 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccnc(C(F)(F)F)c1 1794545169 NZBGHWYMNIVYHQ-FVCICTRLSA-N 478.431 0.616 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCc3cccc(Cl)c31)C2)c1cccc(B(O)O)c1 1795740593 ITOSAMWSLIVECD-ZRAXVTTISA-N 468.746 0.953 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1ccc(N2CCOCC2)cn1 1796188347 SHQXIPBULQKBOG-ACDBMABISA-N 464.331 0.164 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)c1cccc(OC2CCOCC2)n1 1796188839 TYRYGVVEOSJDDO-ACDBMABISA-N 479.342 0.885 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc2cccnc2s1 1796907141 SLLNCMKFZNALDK-HGKCTWBKSA-N 451.313 0.493 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc(C(F)(F)F)cn1)C2 1797750695 OYZSDMSKDHCIDN-CULMDFNYSA-N 479.419 0.011 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1=COCC1)C2)NC(=O)NCc1ccccc1 1799098967 LAFDMGOOHBAYNU-CEQLMSFQSA-N 457.531 0.226 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)N(C)C(=O)OC(C)(C)C 1799136011 DAAVIBYHKQNPKD-ZXFNITATSA-N 490.561 0.144 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCC2(CC1)OCCO2 1800380099 NBMWCAGGYLEUIO-TWKZMHJBSA-N 487.557 0.643 50 20 JCGD CCOc1ccc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc1OC 1801012268 RNMPHYIUOXAYTK-MRSFGVLCSA-N 476.574 0.599 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C1 1801138979 GWWZRKXAGMBHHN-RPUYLAQPSA-N 459.971 0.823 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1804046222 ZBMVONCHIHPZFA-RDGPPVDQSA-N 491.419 0.875 50 20 JCGD Cc1cc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)on1 1804260257 XSBCZYXVJOZGAP-IERDGZPVSA-N 463.498 0.939 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnnc(Cl)c1 1804723452 XMGLXHQQEJRMPH-OXJNMPFZSA-N 465.706 0.838 50 20 JCGD CNC(=S)NCCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808417906 RZYOESDNDNQYNH-SSZMOEMMSA-N 498.613 0.705 50 20 JCGD COCCn1nccc1C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809966888 MHHGRQPTVBPWCG-UHFFFAOYSA-N 454.336 0.368 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCCC2(CCN(C(=O)[C@@H]3CC[C@@H]4CCC(=O)N4C3)CC2)C1 1809970040 ZOWPXTOCTPITLZ-TZIWHRDSSA-N 467.375 0.612 50 20 JCGD COCCn1nccc1C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810302598 MABFFAOUSUTWMW-LAUBAEHRSA-N 492.540 0.556 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc3cccnn3n2)[C@@H]1c1cccnc1 1813072477 DWWXNBFDXHOVRZ-VGOFRKELSA-N 464.530 0.817 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CCn2cncn2)[C@H]1c1cccnc1 1813320014 ZWESVWXKCPYVPZ-OXJNMPFZSA-N 463.502 0.082 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)Nc2cc([C@@H]3CCCCN3C(=O)[C@@H](F)Cl)[nH]n2)n(C)c1=O 1815799227 ATZVOYXFMYRQTC-XHDPSFHLSA-N 480.888 0.384 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)c3ccc4ncnn4c3)sc2C1 1819402813 QDPDNZFXSIPSPQ-ZDUSSCGKSA-N 456.532 0.785 50 20 JCGD C[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)N1CCN(C)CC1 1820784143 AMWVDVFWHYEECS-JXFKEZNVSA-N 468.367 0.031 50 20 JCGD C[C@H](NC=O)C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc2ccccc2)C1 1828551022 GEYAJAWIKIRQCG-AQOAWAETSA-N 480.949 0.173 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@@H]1C1CC1)CCO2 1830492970 BCSZHNQBZCNEHJ-BMGKFCSRSA-N 457.531 0.623 50 20 JCGD O=C(CCc1noc(-c2ccccc2)n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830733035 CVQVTRKTVDCACL-VGOFRKELSA-N 478.933 0.725 50 20 JCGD O=C(Cc1cccc([N+](=O)[O-])c1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1833038385 CCPOEZZLTCEJJX-UHFFFAOYSA-N 494.357 0.703 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc(=O)nc4sccn34)CC2)CC1)[C@@H](O)CCl 1833312174 IJWSRLJIVOQOJS-INIZCTEOSA-N 467.979 0.541 50 20 JCGD CCC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1833532516 SWMNITZULFLNMQ-MRXNPFEDSA-N 452.920 0.690 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cc[nH]n3)CC2)CC1 1833562200 YPJGMHXXZNIMTC-CVKSISIWSA-N 454.535 0.729 50 20 JCGD Cc1cncc(CCC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1833815651 MWDRBRCYALOPRI-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD Cc1ccc(CCC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)nc1 1834800210 ZVUGTWYDRFHRLV-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD CC(C)(C)NCC(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835736973 OJIQJBRDHAFRKA-UHFFFAOYSA-N 459.595 0.258 50 20 JCGD COCCOCCOCCOCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)CCl)CC2)CC1 1836719405 RIGKVGRHSKZAIZ-HXUWFJFHSA-N 495.013 0.281 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)Cn1cncn1)CCO2 1837648805 UVZSTCFVBLAYIG-RVKKMQEKSA-N 458.357 0.544 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C(F)(F)F)ccn1)CCO2 1838083987 UFJGPMMFIRWTIQ-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1[nH]cc3c1CCC3)CCO2 1838453201 YTDHZTFOYITDQJ-RLWVUDJFSA-N 482.541 0.707 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](NC(C)=O)c3ccc(F)cc3)CCO2)C1 1839038563 OUCBUELOCGDNJW-DXIQSLLYSA-N 485.940 0.713 50 20 JCGD O=C(Nc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc1)C1CC1 1839249457 PQRIZFSCNMNLSQ-AVRDEDQJSA-N 465.934 0.705 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)(Cl)Cl)CCO2 1839922246 OAMCUSPAGIZZNP-INIZCTEOSA-N 480.736 0.125 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C(C)(C)CNC(C)=O)C2)C1 1839962379 CHNPZYKSMUZAFJ-HNAYVOBHSA-N 462.385 0.779 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3Cc4ccccc4CN3)C2)C1 1840152265 CWLSQNJFHDHUQJ-IPJJNNNSSA-N 451.951 0.411 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4cc(C)cnc34)C2)C1 1840153276 JOBWODNNXIVEGM-UZLBHIALSA-N 451.911 0.362 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccncc4)[nH]n3)C2)C1 1840153810 ZRMJEWGGCBEUKV-KKSFZXQISA-N 463.922 0.796 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840452985 KDWGQFZRCNIOHM-JOQOYGCGSA-N 460.300 0.996 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3F)CC1)CCO2 1840859221 OQVTZLUMMJNFFH-DEOSSOPVSA-N 497.527 0.626 50 20 JCGD COc1cc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)ccc1[N+](=O)[O-] 1844264896 WBXVQNIIYCESNR-UHFFFAOYSA-N 468.470 0.662 50 20 JCGD CC(C)(C)OC(=O)N1Cc2nccnc2C[C@H]1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847567756 CVRUXPRPTFVMHF-XLAORIBOSA-N 479.965 0.940 50 20 JCGD O=C(CCNC(=O)c1ccsc1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 21894518 MVVMKAIOAOHGHW-UHFFFAOYSA-N 466.541 0.350 50 20 JCGD CC(=NNC(=O)CSc1nn(C)c(=O)n(C)c1=O)c1ccccc1I 727776861 FMJFGKPVRRZPPO-UHFFFAOYSA-N 473.296 0.716 50 20 JCGD COc1ccc(CC(=O)NNC(=O)COc2ccccc2O)cc1S(=O)(=O)N1CCOCC1 730781478 OHXXEMVUVKLXAU-UHFFFAOYSA-N 479.511 0.191 50 20 JCGD COc1ccc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)Cc1ccccc1F 731330104 ODDJSJAHYPALOC-UHFFFAOYSA-N 451.476 0.859 50 20 JCGD CC(C)NC(=O)C(=O)NNC(=O)[C@]12CCC(=O)N1c1ccccc1C(=O)N2Cc1ccccc1 744447384 FMXFAVUCXXXDEM-DEOSSOPVSA-N 463.494 0.838 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)[C@@H]2Cc3ccccc3O2)cc1[C@]1(C)NC(=O)NC1=O 748214847 LGABVHLGVKTXEG-JXFKEZNVSA-N 460.468 0.063 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)CS(=O)(=O)Cc1ccc(Br)cc1 751202755 WLXXTGRXADOMTL-UHFFFAOYSA-N 458.290 0.534 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)cc1 761736382 WPCJYNZVKMUGFN-HNNXBMFYSA-N 463.516 0.787 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)Cc1cccs1)c(=O)n2Cc1ccccc1 769682716 VLQPEPAWJMQDAN-UHFFFAOYSA-N 466.523 0.880 50 20 JCGD C[C@@H]1Oc2ccccc2N(CC(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)C1=O 813580607 QTLZEQMYAAQRRH-SCLBCKFNSA-N 455.423 0.331 50 20 JCGD Cn1c(=O)c2cc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)cnc2n(C)c1=O 862362791 KGNRUBRFZIENQE-UHFFFAOYSA-N 450.480 0.759 50 20 JCGD C[C@@H](Oc1ccccc1F)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCNC(=O)C2)c1 906470640 ICQRIXIIQSDAPO-CYBMUJFWSA-N 464.475 0.175 50 20 JCGD CN(CC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1)[C@H]1CCS(=O)(=O)C1 914532049 WHVZZBAYNQFEEY-IBGZPJMESA-N 483.554 0.268 50 20 JCGD COc1cc(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCOCC3)o2)cc(OC)c1OC 914709715 VJEVDVUKVAOOMZ-UHFFFAOYSA-N 469.472 0.401 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)N[C@H]1CCN2CCCC[C@@H]12 916639687 WYWCEECMGASDJH-PMACEKPBSA-N 479.603 0.597 50 20 JCGD Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)cc1 919885181 KPUVWSIFFRNZKE-INIZCTEOSA-N 466.541 0.927 50 20 JCGD O=C(NNC(=O)c1nnc(O)c2ccccc12)c1cc(S(=O)(=O)N2CCSCC2)c[nH]1 921020108 RLNFQDVDURQCRQ-UHFFFAOYSA-N 462.513 0.476 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3ccc(B(O)O)cc3)C4)nc2N1 1777818991 OSDFGDCYAARTEP-CJFMBICVSA-N 492.341 0.087 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc2[nH]ncc12 1777871439 GQFAGZLWTIEESQ-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD Cc1cc2nc(C(=O)N3CC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)[nH]c2cc1C 1778925163 SWYCMOIJSATVQH-XMMPIXPASA-N 477.525 0.936 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1779028413 DYIIWTMCDCILDD-DVECYGJZSA-N 496.524 0.226 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1NC(C)=O 1779032814 WFQCBQXSGWKQRL-DEOSSOPVSA-N 496.524 0.409 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CS[C@@H]3CCCCO3)C2)C1 1779084714 RYSYJTSMVJJLSM-NQIIRXRSSA-N 463.560 0.388 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)[nH]n1 1779573672 NSTVJWZEBWZZRK-QFIPXVFZSA-N 455.519 0.463 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)C3(N4CCN(C)CC4)CC3)C2)C1 1781105920 KDOFQGMDZBZTFC-VQIMIIECSA-N 457.413 0.627 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C#CC(=O)O)C1 1782013316 DXXSZVDKKAHHGY-XMSQKQJNSA-N 473.438 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CCC(CO)CC1)C2 1782209560 ZQBVLHSXJPXLED-LDSCCMFQSA-N 452.596 0.672 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1782730804 QQZVVFRSJCUBKI-VLIAUNLRSA-N 451.365 0.997 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1782804409 FZBQHKUVKLVQGK-YNSXNBMNSA-N 464.327 0.922 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(N3CCOCC3)c1)CCO2 1783934989 ONKKFGSGBINJKX-DEOSSOPVSA-N 473.574 0.340 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(Cl)c(O)cc1O)CCO2 1783935569 VTESLBPFKXCVAK-FQEVSTJZSA-N 454.911 0.568 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(Cl)cc3nn[nH]c13)CCO2 1783935994 ZPHOFEAYRHCJKV-FQEVSTJZSA-N 463.926 0.428 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)CBr)[C@H]2C1 1783964169 LUYQVIDIDZPKRB-QTVXIADOSA-N 468.414 0.325 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1785592407 SNXPZULWVBYXLW-RXPSNABZSA-N 499.373 0.208 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4ccccc4O3)C[C@@H]21)c1ccc(B(O)O)cc1 1786983510 MQDYALHEKKDYGD-MHADKKCISA-N 464.327 0.354 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508707 ITVDXWWKIHQMIK-ARQYOALSSA-N 471.518 0.156 50 20 JCGD O=C(Cc1cn2c(nc1=O)SCC2)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21 1789709869 FGWRMBBYFQQVDT-DRZSPHRISA-N 461.371 0.675 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc(C)c1C(=O)O 1790317411 UGJZNCGYUXHNOS-YYWHXJBOSA-N 480.326 0.589 50 20 JCGD CC(=O)NCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C[C@@H]21 1790843946 UGBFGVHFXKLJRU-VGWMRTNUSA-N 460.959 0.234 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1OC(F)(F)F 1792669337 VADAGEKODWIGDZ-CCWDJLKJSA-N 478.232 0.782 50 20 JCGD CO[C@H](C)[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl)N(C)C(=O)OC(C)(C)C 1792978374 AMALZBCYGZWBTG-DBHDPKECSA-N 477.986 0.446 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCc1ccc(C(F)(F)F)cn1)C2)c1ccc(B(O)O)cc1 1795732750 GESDDGFUTJNLNO-VPTLXERWSA-N 491.275 0.616 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cccc(C(F)(F)F)c1)C2)c1ccc(B(O)O)cc1 1795736920 QLIQUERXJMCARO-UPHUGPLXSA-N 476.260 0.831 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)[C@H]1[C@H]2c3ccccc3S[C@H]21 1797762974 HYHCACHCKXDHOF-CSXWMVMESA-N 464.352 0.458 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797954928 UOTDFTZTJGNHNU-KYHPRHEASA-N 472.659 0.670 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(F)nc1)NC(=O)NCc1ccccc1 1798040800 KVPQBCNARDGKBP-HATOLVCRSA-N 484.532 0.770 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Br)CCOC1 1799349313 SKJANKFKEVKKIU-UUUMGPIQSA-N 494.358 0.950 50 20 JCGD CCN(CC)C[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1800220824 IFYZCTJLMDOODX-XEBLMJKWSA-N 460.579 0.688 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CCCN(C(=O)OC(C)(C)C)C1)C2 1801012501 LGCIUOFLZXIMAQ-UGNRZPKXSA-N 495.621 0.596 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)C1(O)CCC1 1802462200 LFIVJWGCDKABHU-LKUPVBHCSA-N 451.332 0.632 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnnc(Cl)c1 1804723462 XMGLXHQQEJRMPH-UZLBHIALSA-N 465.706 0.838 50 20 JCGD CN(C)c1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)nc1 1807361170 FFVRQEYTONGPRT-AUSIDOKSSA-N 473.342 0.856 50 20 JCGD COc1ccc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc1 1807362989 OARFWPIOUMTSIM-AVRDEDQJSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nccc3nc[nH]c23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365288 XJZNIAQNWPLMKO-HTAPYJJXSA-N 470.298 0.666 50 20 JCGD CN1CCCC[C@@H]1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807365854 PPWPCKIARPUWPE-KSEOMHKRSA-N 450.348 0.565 50 20 JCGD CSCC[C@H](O)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1807367600 MITDKEIOMTYYNO-YZGWKJHDSA-N 457.361 0.195 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCC4(CCCN(C(=O)c5cccc(B(O)O)c5)C4)CC3)cnc2c1 1809978891 XFWGQYKRVMGHDA-UHFFFAOYSA-N 488.353 0.841 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CNC(=O)c2ccco2)[C@H]1c1cccnc1 1810302156 HGOHXCJNCNDWOK-IERDGZPVSA-N 491.508 0.423 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2ccnc3c2OCO3)[C@@H]1c1cccnc1 1810302905 NYAVNHPBUBFHPJ-DNVCBOLYSA-N 489.492 0.837 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@@H]1c1cccnc1 1810540894 HAHWHEAOHLWDKE-KBXCAEBGSA-N 470.566 0.379 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnc2c(c1)CCNCC2 1812379438 YHHVDFJCFCZTIT-SQJMNOBHSA-N 499.380 0.478 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1812863493 HPIOMPRZUXHUPU-WBIUFABUSA-N 475.307 0.311 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)/C=C/c2cnc[nH]2)[C@@H]1c1cccnc1 1813301049 PKVVLPCXGGJVQE-DMDWLKPBSA-N 460.498 0.836 50 20 JCGD COCCn1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815340356 JYEAXKKKRKCLEI-OAHLLOKOSA-N 469.332 0.205 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cn4ncccc4n3)sc2C1 1818462844 UDPIYECACUMIJX-NSHDSACASA-N 477.510 0.724 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cc[n+]([O-])cc2)[nH]n1 1819403586 VOXGOBKMYMBSGP-KRWDZBQOSA-N 450.459 0.661 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc4cn[nH]c4cn3)sc2C1)c1ccc(B(O)O)cc1 1819445836 LEDAIOLSNZMFOX-AWEZNQCLSA-N 462.300 0.634 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3nncn3c1)CC2 1819796764 FBVARBYHUPAWPU-GFCCVEGCSA-N 477.510 0.724 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc3ccc(F)cn3n1)CC2 1819799640 FACUYDZTWIONHZ-LLVKDONJSA-N 495.500 0.863 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2 1824604717 TXGNYTJGTYVWRH-QWRGUYRKSA-N 476.515 0.929 50 20 JCGD O=C(c1cc2ncccn2n1)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051786 FKLCTQJQLTXVDO-NRFANRHFSA-N 461.331 0.956 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)Cn2ccncc2=O)CC1 1827679329 XVWSSYIZCPPGKK-KKMLCIJBSA-N 481.557 0.997 50 20 JCGD CSCC[C@H](O)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](C)CBr)CCO2)C1 1830544138 ODFCUGXJHRMASF-JKIFEVAISA-N 453.399 0.588 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](O)CCl)CCO4)c12 1830734972 BNXZSMYMXQDIFL-KKSFZXQISA-N 451.907 0.846 50 20 JCGD COc1ccc(OC)c(C(=O)CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830737436 HMWIQSYTESBQMH-WMZHIEFXSA-N 498.960 0.723 50 20 JCGD CN1CCC(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)CC1 1833103930 ATAZMOPEIGDRBJ-UHFFFAOYSA-N 471.606 0.212 50 20 JCGD Cc1cc(CC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)on1 1833731482 JQTIWJQNQPJUKB-UHFFFAOYSA-N 454.336 0.091 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)nc1)CCO2 1834275370 WVSHYOLPHUFHDJ-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD CO[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccc1 1834801169 SBSKEOAHXFSIAB-DEOSSOPVSA-N 479.386 0.939 50 20 JCGD Cc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c(O)n1 1834801286 VWJXSDLFFMQZER-UHFFFAOYSA-N 466.347 0.274 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)[C@H]3CC[C@@H]4CCC(=O)N4C3)C2)C1 1834824188 VXEFXDGQGWEBDV-RZQQEMMASA-N 472.380 0.629 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)CNCP(=O)(O)O)CC2)CC1 1835833514 MPEKNZLMAYWZGM-UHFFFAOYSA-N 464.576 0.134 50 20 JCGD COc1cccc(OC)c1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836241356 PZCSMODBPMYGBU-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD CCOc1c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cnc2c1cnn2C 1836376691 GJEQGUPNRLVSLI-UZLBHIALSA-N 469.901 0.971 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836781385 QRKKQDORMAPDPI-VBKZILBWSA-N 498.378 0.260 50 20 JCGD O=C(c1cnn2cccnc12)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836848507 QMIFDGMCCAPQJX-GUYCJALGSA-N 456.272 0.490 50 20 JCGD O=C(C(Cl)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1ON=C(c3ccccc3)O1)CCO2 1837297445 UOMVYYKFPPAXQE-RTBURBONSA-N 458.298 0.981 50 20 JCGD C[C@]1(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CC=CCC1 1837460467 GJABFEHIKCMPFH-XZOQPEGZSA-N 457.531 0.502 50 20 JCGD CC[C@@H](C)[C@H](N)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837849833 RQNBTEJGNDPJNF-QRWLVFNGSA-N 460.579 0.671 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838499051 MVIUOPBOLWKTMS-JLTOFOAXSA-N 494.346 0.191 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839020269 TXSXSRDDVDWSTB-QHCPKHFHSA-N 462.547 0.528 50 20 JCGD CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CN(C)NC(=O)NCc1ccccc1)CCO2 1839054159 JAYORXRWLLXGFG-QHCPKHFHSA-N 461.563 0.589 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)ccc1C 1839402610 XHMIGHINIVNABO-NQIIRXRSSA-N 453.923 0.623 50 20 JCGD O=C1Cc2cccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)c2N1 1839574062 OUEQNIKXPSLIEY-LPHOPBHVSA-N 470.295 0.942 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCC(=O)N3)C2)C1 1839743353 KTXRDJUDVVFIFB-ORGVGYNBSA-N 474.464 0.607 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccc(N(C)C)c3)C2)C1 1840151041 VARJILTZHPWIKT-UGKGYDQZSA-N 469.966 0.842 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ccc(OC)nc3)C2)C1 1840151173 XBXFQQABBRQNEA-DYESRHJHSA-N 455.939 0.733 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](Cl)COC)CCO2)C1 1840156668 SBIACDQDBUJGSL-QYWGDWMGSA-N 477.986 1.000 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cccc4ncccc34)C2)C1 1840182257 AXWSYXLTJGZAMI-VWLOTQADSA-N 483.569 0.607 50 20 JCGD CC(C)c1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)no1 1840183601 ODIGOADQLIYHIT-OAQYLSRUSA-N 451.524 0.241 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCCNC(=O)OC(C)(C)C)C2)C1 1840187037 IKEGFLQOECOTDS-HSZRJFAPSA-N 499.609 0.121 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@@](C)(C(=O)N2CCCC23CN(C(=O)[C@@H](O)CCl)C3)C1 1841028850 GZHLNFVBCHOVEL-AVYPCKFXSA-N 459.971 0.798 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)c1 1843012137 HWMGICTUPIBXOC-UHFFFAOYSA-N 460.292 0.040 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CC4(CCCN4C(=O)CO[Si](C)(C)C)C3)csc2n(C)c1=O 1844378936 YGZRUTCEOMYEPR-UHFFFAOYSA-N 478.647 0.896 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CCCC34CN(C(=O)C(Cl)Cl)C4)csc2n(C)c1=O 1845014554 UHQFNZISJHTCQC-UHFFFAOYSA-N 459.355 0.848 50 20 JCGD Cc1cc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)nn1C 1845038525 OEYUPPRYPXNXAQ-UHFFFAOYSA-N 453.547 0.892 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1n[nH]c3c1CN(C(=O)OC(C)(C)C)C3)C2 1846384337 FVGKWRIBBGDZEX-UHFFFAOYSA-N 489.577 0.850 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2cccc(C(=O)NNC(=O)c3ccc4c(c3)OCO4)c2)CC1 15793454 UNLVYNOYCPRSIX-UHFFFAOYSA-N 474.495 0.343 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2nc(S(C)(=O)=O)n3ccccc23)c1 109026186 NLQXAHFTKNKGJT-UHFFFAOYSA-N 465.513 0.063 50 20 JCGD CNS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2nn(C(C)C)c(=O)c3ccccc23)c1 109568945 TXZDVVVRUZJZGL-UHFFFAOYSA-N 479.540 0.509 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)C1 728203596 UUTSNNGGIKXRRS-OAHLLOKOSA-N 487.542 0.780 50 20 JCGD COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(C#N)c2)cc1 728826679 ULEXLYOGSMGCRG-UHFFFAOYSA-N 460.512 0.917 50 20 JCGD Cc1ccc(NS(=O)(=O)c2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1 729275095 KVDPIBQLGXVFKK-ZDUSSCGKSA-N 454.530 0.495 50 20 JCGD Cc1ncsc1C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)/C=C\c1ccccc1 729453509 DVOZRXRFBFLLFQ-MEODZPNASA-N 486.597 0.606 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](CC(N)=O)NC(=O)c2ccccc2Cl)c1 786121907 LVZPUVQZRFTZHM-INIZCTEOSA-N 495.945 0.025 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc3c(c2)C(=O)N(C)C3=O)c2ccccc2c1=O 861578467 OWTYRWCMRCRDGO-UHFFFAOYSA-N 469.479 0.656 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)CNS(=O)(=O)c2ccccc2F)c2ccccc2c1=O 913588075 OMFRESOIFNJORY-UHFFFAOYSA-N 461.475 0.856 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC(=NNC(=O)Cc2csc(N3CCOCC3)n2)CC1 914555459 SCXFKPXWMDROOQ-UHFFFAOYSA-N 481.604 0.819 50 20 JCGD CC(=O)NCCc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1 917718364 WGDMKYBPDYTLAO-UHFFFAOYSA-N 494.595 0.773 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@H](C)NS(=O)(=O)c2cccs2)c1 917901008 KQJWPANACLXVLO-ZDUSSCGKSA-N 488.613 0.907 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)CCc2ccc(OC)cc2)c1 919835905 UVVKZYOYONVIHI-UHFFFAOYSA-N 464.544 0.668 50 20 JCGD O=C(NNC(=O)[C@H]1CCN(c2ccccc2Br)C1=O)N[C@@H]1CCS(=O)(=O)C1 919884368 FBIDZJMKDXURQT-GHMZBOCLSA-N 459.322 0.320 50 20 JCGD O=C(Cc1ccc(NS(=O)(=O)c2ccc(F)cc2)cc1)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 919884777 LBYSCFUHTLVIOY-MRXNPFEDSA-N 484.531 0.687 50 20 JCGD COc1ccc(N2CCN(C(=O)/C=C\C(=O)NNC(=O)[C@H]3COc4ccccc4O3)CC2)cc1 920254830 QJDRCLQESDHITQ-KUFMOJEASA-N 466.494 0.887 50 20 JCGD O=C(CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)NNC(=O)[C@@H]1COc2ccccc2O1 920339545 JBBNCSKQBAGTQR-INIZCTEOSA-N 450.429 0.251 50 20 JCGD CS(=O)(=O)NCCNC(=O)/C(C#N)=C\c1cn(CCC(N)=O)nc1-c1ccc(Cl)cc1 920850748 FCHGIAPMSDTUBI-UVTDQMKNSA-N 464.935 0.651 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc3ncccn3n1)C2 1778091157 OAEWQJYSFBSUKN-KBDRGJQMSA-N 492.540 0.991 50 20 JCGD CC[S@@](=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2 1778818216 UKVUTMOUAQVEHL-SOBNEZJNSA-N 451.549 0.109 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3csc(-c4cccnc4)n3)CCO2)C1 1779030675 TTYDIMKEOZZING-QHCPKHFHSA-N 493.549 0.961 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779036927 IYPRSTLDVHWRJY-HSZRJFAPSA-N 482.497 0.621 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(Cl)ccn1 1779643696 ICESDEWUXBMONV-DENIHFKCSA-N 457.723 0.856 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1ccnc1)C2)NC(=O)NCc1ccccc1 1780558683 CRGCRZIGCXFKAZ-PXDATVDWSA-N 497.600 0.743 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n(C)n1 1780968691 IZFSSMKHBKRDCJ-XMMPIXPASA-N 499.572 0.218 50 20 JCGD CCn1nccc1C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970343 UPLDOUWRHHNMIB-DEOSSOPVSA-N 483.573 0.693 50 20 JCGD CC(=O)Nc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1O 1781184120 ZZYWLWCKUSNNBI-RCZVLFRGSA-N 495.341 0.472 50 20 JCGD COc1c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)ccc(F)c1F 1781842288 MIISYWHQVSPMSZ-JOCHJYFZSA-N 460.242 0.411 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C[C@H]1NC(=O)NC1=O)C2 1781901527 PDVDGEFNAVSIQP-NVAPZFDKSA-N 459.341 0.272 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781933860 LUQDBVMKUXNWAJ-WZONZLPQSA-N 475.351 0.019 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(O)ccc3O)C2)C1)NC(=O)NCc1ccccc1 1782045224 UGZCKGAYUKETCZ-RUZDIDTESA-N 497.552 0.888 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)CC1 1783933553 PYAGSQSVDQILJQ-HOIFWPIMSA-N 452.552 0.169 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3c[nH]c4nccc-4c3n1C)CCO2 1783934452 AHCDQYRZFSNJRW-XMMPIXPASA-N 481.557 0.823 50 20 JCGD COC(=O)CCCCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1784050732 YNXVWQPMQRIZTR-JOCHJYFZSA-N 461.519 0.252 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccnc3)C[C@@H]21 1787509162 XCYQQNXJTMEECK-QARUKCAUSA-N 452.515 0.738 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnc(Cl)s3)[C@H]2C1 1789001013 FBYHRVHTQJNPOU-BPNCWPANSA-N 464.935 0.702 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C[C@@H]21 1791290867 QDCYFGYUXWDNAZ-SNRMKQJTSA-N 489.529 0.496 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1792202105 SJZLJKASZHWLGS-NXOAAHMSSA-N 459.971 0.823 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)C1CCN(Cc2ccccn2)CC1 1794158083 HIWCHMBAZNAZLF-HNJRGHQBSA-N 450.967 0.483 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)c(O)c1)C2)c1ccc(B(O)O)cc1 1795736318 YMVQUPDWAQLEDY-CCWDJLKJSA-N 489.131 0.352 50 20 JCGD CCOC(=O)c1ncn2c1CC[C@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@@H](F)Cl)C2 1796370601 NDLHHCOZSXJTQG-UOZBHZCFSA-N 456.902 0.746 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797754489 ZGIRAMXSZSGCQW-IHSNIMORSA-N 452.515 0.162 50 20 JCGD C[Si](C)(C)OCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCOCC3)n1)C2 1797955791 CPTQNWWPFDJQHW-UPHUGPLXSA-N 462.623 0.973 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C/N=C/c1ccco1)C2)NC(=O)NCc1ccccc1 1799097126 DRCAURFPWAJBRN-ZCQJHIOPSA-N 496.568 0.634 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br 1799347539 PQHMRVPEQAZLMD-XVIXHAIJSA-N 482.347 0.806 50 20 JCGD CC[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2 1800638086 PTAZRNRHKDKCGY-QKGCVVFFSA-N 478.384 0.635 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2ccccc2C1 1800679097 NMLXLDIRWUBVRR-VWNVYAMZSA-N 463.538 0.693 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)NC[C@@H]1CCN(C(=O)CCBr)[C@@H]1c1cccnc1 1804193793 FDZGASLTJAMSJQ-QFBILLFUSA-N 487.420 0.603 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1 1804596916 SJGTZKFBQXBDPX-ACDBMABISA-N 466.299 0.484 50 20 JCGD Cc1cc(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nn1C 1807360200 OYQDTYGKYZBCQS-XXBNENTESA-N 461.331 0.366 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1807376706 VZISCPFMHXNDEA-GCJKJVERSA-N 488.309 0.576 50 20 JCGD CCn1nc(C)cc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807984968 XXBNDYHGQTXCBS-DENIHFKCSA-N 461.331 0.920 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnc2[nH]ncc2c1 1809703359 KVNLPCVZZVTUTA-DYESRHJHSA-N 470.298 0.666 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC[C@@H]1CCN(C(=O)CCBr)[C@H]1c1cccnc1 1810099922 MJFIJVLOPYBNQE-JLJPHGGASA-N 457.325 0.937 50 20 JCGD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n(C)n1 1810299945 VSMGHNGSEAJGPQ-OXQOHEQNSA-N 462.514 0.755 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(O)n2)[C@@H]1c1cccnc1 1810300345 XNNRJQJSADGUEE-FOIQADDNSA-N 461.482 0.814 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1 1810303286 PQSAUKWLMIDSCS-VBKZILBWSA-N 477.481 0.520 50 20 JCGD CCOc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1 1811621521 SDTXZAMMQOSQDZ-PGRDOPGGSA-N 475.314 0.584 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnn2c1CCC2 1812140582 FJYSYCHNQHLGCZ-GCJKJVERSA-N 459.315 0.538 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@H]1c1cccnc1 1813070603 KBJGFORAXFPGDU-IERDGZPVSA-N 456.503 0.173 50 20 JCGD CC(=O)NCC(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822518410 OLRBIYCOVYCZPQ-MRXNPFEDSA-N 487.586 0.537 50 20 JCGD O=C(c1cnc2c(c1)CCNCC2)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827053450 PZNSZOAKUHBWRS-RUZDIDTESA-N 490.413 0.997 50 20 JCGD CNC(=S)NCCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1 1828931522 QLMQVEWBBBVKFC-QGZVFWFLSA-N 454.641 0.463 50 20 JCGD N=C(N)NCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829053064 XVHMHKQDGLQIBY-UZLBHIALSA-N 468.917 0.456 50 20 JCGD CN(CC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H](F)Br)CC1)C(=O)C(=O)O 1830382896 MYAHUJBBTLZZCN-OCCSQVGLSA-N 450.305 0.840 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncnn4c3)C2)C1 1830539432 GRVVUYOYNDSDJI-LIRRHRJNSA-N 466.336 0.830 50 20 JCGD O=C(c1occc1Br)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830727954 LLQXTQYEJSOKQS-BLLLJJGKSA-N 451.701 0.712 50 20 JCGD CN(C)[C@H](C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)c1ccccc1Cl 1830736044 QEUGNMJSTVYUHU-BBTUJRGHSA-N 474.385 0.999 50 20 JCGD CC(C)(C)OC(=O)N1CCCC[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830737046 CRFPTDLCKCVPGY-HYFFOGBASA-N 489.997 0.832 50 20 JCGD CC(=O)Nc1ccc(Cl)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c1 1830737345 DMODHSBUHVDZRA-PXNSSMCTSA-N 474.341 0.968 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccn3)C2)C1 1832549252 JRFVJRKWURYRPW-BTYIYWSLSA-N 483.953 0.679 50 20 JCGD O=C(NCCC(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1)c1ccc[nH]1 1833308582 WDISQDBPCURFGJ-GOSISDBHSA-N 453.971 0.306 50 20 JCGD Cn1ncc(Br)c1C(=O)N1CCC(N2CCC(NC(=O)[C@H](O)CCl)CC2)CC1 1833310285 OYKTVLAFVRJBHS-OAHLLOKOSA-N 476.803 0.968 50 20 JCGD CCc1ccnc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834798047 XVCXWUPMXKFBRX-UHFFFAOYSA-N 464.375 0.823 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)CN3CCCC3=O)CC2)CC1 1835118226 ITRAMYSNYYFDFN-WPWMEQJKSA-N 485.589 0.314 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc2cnccc2n1 1835324142 MZLKMULZEKAGQS-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCC(N2CCC(NC(=O)C3=NNC(=O)C3)CC2)CC1 1835697764 SXVXTHSEPJPMDM-KRWDZBQOSA-N 499.012 0.566 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@H]3C[C@@H]3c3ccc(Cl)cc3)C2)C1 1835930186 AROFUXABSJGTBY-OTNCWRBYSA-N 498.772 0.894 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)oc2ccccc12 1835930449 IQXXVZNYWZFHCA-VWLOTQADSA-N 478.310 0.805 50 20 JCGD C/C(=C\c1cccs1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835933863 FIJCDFRSSBUGMO-LVJXIGIWSA-N 470.356 0.601 50 20 JCGD C[C@@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)Oc1ccccc1 1835939858 LGOZLAGOWIICBV-DFBJGRDBSA-N 482.342 0.294 50 20 JCGD COc1ccsc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1836038327 JIYAGHRQTJLVHB-UHFFFAOYSA-N 471.388 0.936 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc3[nH]ncc3c1)CCO2 1836808913 WGROSJAILRKHMK-GOSISDBHSA-N 452.309 0.813 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3ncnn3c1)CCO2 1837165333 WIMQFQPNQGHEPS-GOSISDBHSA-N 452.309 0.584 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837457007 VRELZPSUILLLHP-UZLBHIALSA-N 453.927 0.163 50 20 JCGD CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccc1 1837457044 TVADEGDUELPQOT-UQBPGWFLSA-N 481.553 0.949 50 20 JCGD COc1c(C)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cc1C 1837459956 PHHXSSDKEKXGDQ-VWLOTQADSA-N 497.552 0.694 50 20 JCGD CCc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n(C)n1 1838394091 RFAZLUQCWLADFM-UHFFFAOYSA-N 483.573 0.907 50 20 JCGD COc1cc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)ccc1[N+](=O)[O-] 1839136250 PHSZNNOJRKKLML-JXFKEZNVSA-N 471.894 0.202 50 20 JCGD Cc1cnc2c(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@@H](F)Br)CCO4)cnn2c1 1839200025 ACJAIEGUOMFPCT-RDTXWAMCSA-N 470.299 0.798 50 20 JCGD Cn1nc2c(c1C(=O)N1CCOC[C@]3(C1)CN(C(=O)[C@H](F)Br)CCO3)CCC2 1839202437 FKVPKDKIPFDKTE-YJBOKZPZSA-N 459.316 0.669 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)CCO2 1839397401 RFDBJMUDOHZZPB-DEOSSOPVSA-N 484.557 0.520 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1onc3ccccc13)CCO2 1839546280 NHXROZFSHLMYHS-QHCPKHFHSA-N 480.481 0.210 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C(C)=O)[nH]n3)C2)C1 1839963272 GHGMTPUDVFVWSS-UGSOOPFHSA-N 457.325 0.856 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3C1)CCO2 1839994457 YVABRFZFPIEERL-BWKNWUBXSA-N 472.586 0.621 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3cncc(OC)c3)C2)C1 1840150978 UZXLJIIYZPXERY-WIYYLYMNSA-N 455.939 0.733 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)ccc3-n3ccnn3)C2)C1 1840154697 CXPQAYHLSNIEEP-PGRDOPGGSA-N 477.949 0.900 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4cnccc4c3)C2)C1 1840184360 HZSFJFAEIJRQJM-XMMPIXPASA-N 469.542 0.678 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cc[nH]c4c3)C2)C1 1840184606 WURZQNBGMWRJCH-QHCPKHFHSA-N 457.531 0.611 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(F)c(F)cc3F)C2)C1 1840185702 VPZIOJCSQHRLAT-OAQYLSRUSA-N 472.464 0.547 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc3c1CCCC3)CCO2 1840720665 DVOVTVKMTNQHKD-SANMLTNESA-N 478.354 0.629 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2 1840948895 UFYHEKUGVHXEEN-FCHUYYIVSA-N 464.274 0.182 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cn2ccc3sccc3c2=O)C1 1842019854 DUTDMPNESCHDCQ-UHFFFAOYSA-N 451.313 0.260 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)[C@H]2OCC[C@H]21 1843012476 RUOYWKJVVKOBIP-XUVXKRRUSA-N 499.373 0.208 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014840 IBCNRZFBQGPVQG-GOSISDBHSA-N 457.336 0.583 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)cc2)CC1 1843015312 CMXOQXYLEOYCNJ-UHFFFAOYSA-N 476.386 0.639 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CC23CN(C(=O)OC(C)(C)C)C3)C1 1846118724 ZYQTZAMREBJPCJ-MRXNPFEDSA-N 463.579 0.820 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1847067589 ZOEYWSFDRMKQMX-UHFFFAOYSA-N 460.535 0.807 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2c(C)[nH]c(=O)c(C#N)c2C)cc1 17406776 AENUCKOUGVWJMQ-UHFFFAOYSA-N 459.528 0.573 50 20 JCGD Cc1cccc2c(=O)n(CC(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)cnc12 18400812 NHMZQGPLABXXOZ-KRWDZBQOSA-N 452.423 0.236 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)c1ccc(N2CCCC2)nn1 727847631 MISIPAKXBDFIGV-UHFFFAOYSA-N 488.570 0.492 50 20 JCGD O=C(COC(=O)c1ccc(-n2cnnn2)cc1Cl)NNC(=O)[C@@H]1COc2ccccc2O1 729727586 DYZKYZODJQCYPK-INIZCTEOSA-N 458.818 0.460 50 20 JCGD Cc1ccc(-c2cc(C(=O)NNC(=O)NCCS(=O)(=O)N3CCSCC3)n[nH]2)cc1 730673429 VSFGDWQISJBOBZ-UHFFFAOYSA-N 452.562 0.708 50 20 JCGD COc1cc2c(cc1OC)CN(C(=O)CCCNC(=O)NN[C@@]1(C)CCS(=O)(=O)C1)CC2 731118947 JZWGMDLPSRFMTD-NRFANRHFSA-N 468.576 0.750 50 20 JCGD Cc1nc(O)c(C#N)c(C)c1CCC(=O)OCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1 742734002 JQBXVMZISQTNFC-SFHVURJKSA-N 454.439 0.739 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCC1CCOCC1 749187339 AZPBJLABIPVHRH-UHFFFAOYSA-N 454.549 0.397 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2cccc(Cl)c2)CC1)c1ccc(-n2cnnn2)cc1 807135519 KBDYOSWZTIEVAV-UHFFFAOYSA-N 490.933 0.677 50 20 JCGD CCCc1cc(C(=O)NNC(=O)Cn2c(=O)c3c(ncn3CC)n(Cc3ccccc3)c2=O)n[nH]1 901392453 PMVOURPDIOZPHQ-UHFFFAOYSA-N 478.513 0.565 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1ccc(O)nc1)N(S(C)(=O)=O)CC2 913161838 YIDZBHBKFQSFLY-OAHLLOKOSA-N 464.500 0.515 50 20 JCGD O=C1CN(S(=O)(=O)c2ccc(C(=O)NNC(=O)Cc3nc(-c4ccccc4)cs3)cc2)CCN1 914464062 SOTPYTLNMKVSAF-UHFFFAOYSA-N 499.574 0.934 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)NCCc2cccs2)cc1 914465295 PETIEYVZLCLCCQ-CQSZACIVSA-N 471.582 0.465 50 20 JCGD CCN(CC)CCNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 915879152 ZXUUFAYZNYEXJT-UHFFFAOYSA-N 455.581 0.312 50 20 JCGD Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 916108743 XLYRWAONVUCJMD-GOSISDBHSA-N 475.506 0.616 50 20 JCGD CN1CCN(c2ccc(CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cn2)CC1 916247209 IOXALHMKBCIIET-UHFFFAOYSA-N 450.503 0.225 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)NCCN3CCc4ccccc4C3)nc2)CC1 916442814 FYNODTZYYJGENF-UHFFFAOYSA-N 473.603 0.702 50 20 JCGD O=C(CCC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)NNC(=O)c1ccc(Cl)nc1 917253432 KTPKEEYPGIXKAH-UHFFFAOYSA-N 479.946 0.809 50 20 JCGD O=C(NCCNC(=O)c1ccc(F)cc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 919916129 CQJMGCZUSIULKM-UHFFFAOYSA-N 477.518 0.984 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)[nH]n1 1779032453 KJFAHWMYAKFGNJ-QFIPXVFZSA-N 455.519 0.463 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc3c1NC(=O)C3)C2 1779374604 RHHXVPWYGZJJCW-KBMIEXCESA-N 492.536 0.621 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(O)c1 1780554517 SKKYGEJSACZDJI-QFIPXVFZSA-N 455.471 0.157 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(=O)ccn1C)CCO2)NC(=O)NCc1ccccc1 1780968424 KVUIQYVEJQBIAG-VWLOTQADSA-N 496.568 0.175 50 20 JCGD C=CCO[C@@H](C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969905 QCLPVPIFKNKIDX-YADARESESA-N 473.574 0.754 50 20 JCGD COc1ccccc1CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1781887416 OECBXOQVJUNAIM-RCZVLFRGSA-N 466.343 0.745 50 20 JCGD CCOc1cccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1O 1781978310 JTFQKSCIWNWHLC-HSZRJFAPSA-N 454.288 0.228 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1O 1782136314 XYVQBERYXHBTAL-QFIPXVFZSA-N 461.519 0.167 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cc4cccnc4nc3O)C2)C1 1782268257 YDEIWDQXKMVBEA-QFIPXVFZSA-N 456.503 0.152 50 20 JCGD O=C(CN1C(=O)CNC1=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783019327 VXTOQGDNCJUCLZ-KKSFZXQISA-N 493.358 0.374 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCC(=O)NC3)[C@H]2C1 1783630582 OMZCLMVPYXRXCM-QIJLZVCCSA-N 488.497 0.640 50 20 JCGD CC(C)(C)c1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cn1 1786982184 QMPITDUYIAKEHG-JBACZVJFSA-N 465.359 0.966 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C3=NO[C@@H](c4ccccc4)C3)C[C@@H]21)c1cccc(B(O)O)c1 1786983070 MDBWGBKGFPVYRS-MHADKKCISA-N 477.326 0.477 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4cccnc34)C[C@@H]21)c1cccc(B(O)O)c1 1786983403 RFOIXYFFGRDKTN-NYVOZVTQSA-N 459.311 0.822 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(F)c3[N+](=O)[O-])C[C@@H]21)c1cccc(B(O)O)c1 1786985132 NEKCKHSNBCCKSR-FNHZYXHNSA-N 471.250 0.321 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc(N(C)C)o3)C[C@@H]21 1787508996 WLNRTVVBJLSKBR-SKIHNHESSA-N 471.518 0.468 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccncc3O)C[C@@H]21)NC(=O)NCc1ccccc1 1789726835 WFOWPVNPXDTMHN-VCOUNFBDSA-N 496.568 0.727 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)N3CCN(C)CC3)[C@H]2C1 1789795098 OPEUNCTVCBHSBA-FPSMNIFISA-N 459.429 0.633 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)C[C@@H]21 1791253402 BPYKFCZFMSXTSB-LLLHUVSDSA-N 479.921 0.526 50 20 JCGD C[C@H]1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)N1C(=O)OC(C)(C)C 1792429060 SZBHJOGJCYGEHQ-WBAHDQRJSA-N 459.971 0.964 50 20 JCGD Cc1cccc(C)c1N1C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CC1=O 1792975425 RJBCWPATPFUSNM-JNIAIEOXSA-N 463.962 0.846 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1OCCc2ccccc21 1793274019 TYZVECXFTHOYIC-BPVRBSMNSA-N 479.537 0.592 50 20 JCGD CSCC[C@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793879234 RATFNAIOFDQNKS-QRJUGERDSA-N 480.027 0.822 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN1CCc2sccc2C1 1793897498 ALIKVOMZDPVFHL-FAQVEIGNSA-N 463.604 0.069 50 20 JCGD CC(C)c1nn2ccccc2c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795738974 ONNONBMTEWJYLN-FEJSZKPUSA-N 476.342 0.655 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1797240923 UZJKZOYGRMASIJ-IRJINJETSA-N 464.327 0.137 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1nc(N)n[nH]1 1797625772 QXOIUJQFHQCJOK-DBWKPXFBSA-N 487.473 0.056 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1797714193 OIYPHDUWQJHJAW-IIZPIQPGSA-N 487.601 0.495 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)CBr)C2 1797785908 KVBRIZKESKJVHQ-QPHLWMPCSA-N 463.325 0.102 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl 1799273938 WNCZVIGJMUGKPM-ABWRSARUSA-N 486.396 0.992 50 20 JCGD CCN(CC)[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)c1ccccc1 1800301737 MNVWYLBEUWQHOG-YDLSIGKMSA-N 494.596 0.971 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1800320056 YYNIEFWYGRDGCA-HATUHQCHSA-N 450.845 0.333 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@H]1CCN(C(=O)[C@@H](N)CN)[C@@H]1c1cccnc1 1804239816 RRCCYDCKQCSCBY-LTIDMASMSA-N 468.986 0.506 50 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APBFDCYJINKZBY-MAUKXSAKSA-N 466.498 0.353 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cccn(C(F)F)c1=O 1810604032 WBGCMBLVSDTDIA-XLIONFOSSA-N 496.279 0.952 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)CCN3CCOCC3)sc2C1 1814644627 WIHYNXBVWLKISZ-CYBMUJFWSA-N 473.559 0.090 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)C1 1817470520 UHSSYNANSKNYCM-FCEWJHQRSA-N 468.319 0.985 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)c1cc2n(n1)CCCNC2=O 1818974155 JARDYKYHZQAOFG-GOSISDBHSA-N 491.317 0.039 50 20 JCGD CC[C@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819400212 DVUQVBKRMKISLH-RDJZCZTQSA-N 456.507 0.629 50 20 JCGD COCCOCCOCCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1822254734 HXNJBFIBQWCRDR-FQEVSTJZSA-N 488.350 0.465 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)n1ccnc1)CCO2 1830976929 KVRQKJWWVKOBQH-XJNGEBIUSA-N 471.518 0.035 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)CNC(C)=O)CCO2 1831697220 REYXYNPXGLRVDO-HNAYVOBHSA-N 462.385 0.779 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)CSc2nc[nH]n2)CC1 1832147568 BYKAVVDXZANYOQ-SFHVURJKSA-N 457.365 0.510 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cc4cccn4cn3)CC2)CC1)c1ccc(B(O)O)cc1 1834798613 QSFOINOSWQOWQF-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ccc4c(c3)CNC4=O)CC2)CC1 1835626761 WFPYRRSQWHQPFV-UHFFFAOYSA-N 484.601 0.488 50 20 JCGD O=C(CSc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929149 CHJLUZRCZKLRJQ-HSZRJFAPSA-N 470.356 0.229 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccc4cc(O)ccc4n3)C2)C1 1835937125 PTTDVTDNQDYWBJ-RUZDIDTESA-N 491.309 0.004 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1 1835940921 DROYGBPHXMRQSR-KOSHJBKYSA-N 452.316 0.240 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cnc2snnc2c1 1836100836 KOSJEDDIWKGIFY-UHFFFAOYSA-N 494.386 0.265 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)Cc3cnccn3)CC2)CC1 1836774717 YKDIFZHZMAXEQJ-UHFFFAOYSA-N 467.530 0.330 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836776602 VVSWXUJPTDEEKK-NRFANRHFSA-N 467.954 0.352 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc4n(n3)CCCO4)CCO2)C1 1836973021 KHUQRICOOOZYSC-SCLBCKFNSA-N 457.325 0.519 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H]3COc4ccccc4O3)CC2)CC1 1837079880 QZYYVVTVZNLWEQ-XMMPIXPASA-N 494.353 0.819 50 20 JCGD COC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837663008 DZOXMPMNLAFOQQ-UHFFFAOYSA-N 461.519 0.251 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](N)CCC(N)=O)CC2)CC1 1837842107 OELJWBPDLRXVFD-KXBFYZLASA-N 451.395 0.814 50 20 JCGD C[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1838022770 DGUHDRZMVPTBBG-NSHDSACASA-N 482.339 0.208 50 20 JCGD COCCn1nccc1C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838138251 QJHWEVWTAGBCAT-UHFFFAOYSA-N 478.594 0.515 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(N(C)C)c1)CCO2 1838923806 ARJXBBINEOAQCU-QTPRHWQCSA-N 496.568 0.957 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)cc3C#N)CCO2)C1 1839132292 CMSGFIRFCZKDLU-SIKLNZKXSA-N 465.934 0.820 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1839142249 KWDMXKZTUPAHIE-YHQOMNDMSA-N 468.938 0.467 50 20 JCGD CN(C)c1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1 1839197954 NVGJLZTVJFFQEV-QAPCUYQASA-N 459.316 0.908 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CO[Si](C)(C)C)C3)C2)nc2nccn12 1839549247 VRVCMUIITJYABG-OAQYLSRUSA-N 461.595 0.959 50 20 JCGD COc1ccc(/C=C(\C)C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1839725366 FHWSDXCVPGDXSM-DPYYHXFJSA-N 494.353 0.549 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3nnc(-c4ccccc4)o3)C2)C1 1840185029 FIPYHISGWPYRKA-QHCPKHFHSA-N 486.529 0.180 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(C#N)c3Cl)C2)C1 1840186017 YYYBTUJHLAQCSL-QFIPXVFZSA-N 477.949 0.655 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3nc[nH]c3C1)CCO2 1840361213 JEHKWRNXRFNKSK-UVKGDRFWSA-N 497.556 0.105 50 20 JCGD COc1ccc(Cl)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840653413 CBPJFRZJJNGUGO-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840896983 GESQURKYKQNXJH-IAGOWNOFSA-N 484.427 0.539 50 20 JCGD CC(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841353521 AUBRNUOUGYYPRR-IRXDYDNUSA-N 489.013 0.989 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCl)C1 1841354467 CJGDTIXCVDYUOK-KGLIPLIRSA-N 475.974 0.131 50 20 JCGD Cc1ncc(C(=O)N2CCCC23CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)cn1 1842333953 WYRABJVNOIFYRN-UHFFFAOYSA-N 451.531 0.948 50 20 JCGD CC(C)(C)OC(=O)NCC1(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)CC1 1844263361 VVLJNDVOJRBDEO-UHFFFAOYSA-N 472.546 0.807 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC12CN(C(=O)[C@H]1CC(=O)N(Cc3cccs3)C1)C2 1844263407 AROAWQMZRLFPRI-HNNXBMFYSA-N 482.566 0.612 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCCCN2CCC[C@@H]2C(=O)N(C)C)nc1 726278305 VUJQBVUSFCCCJE-MRXNPFEDSA-N 455.585 0.337 50 20 JCGD C=CCNS(=O)(=O)c1ccc(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)cc1 728213435 BRXCXMJJFUUICA-UHFFFAOYSA-N 493.611 0.844 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4c(c3)C(=O)N(C)C4=O)cc2)CC1 728214387 OAWLTRFNGJGKDB-UHFFFAOYSA-N 457.512 0.605 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)c3ccccc3N3C(=O)CC[C@]23C)n1 728723176 MCXJNAZMKITMEO-JOCHJYFZSA-N 485.522 0.684 50 20 JCGD COc1ccc(OCC(=O)NNC(=O)NCCN=c2ncnc3n(C)[nH]c(Br)c2-3)cc1 729625544 XVMNZPRBBBDYHR-UHFFFAOYSA-N 493.322 0.329 50 20 JCGD O=C(CNS(=O)(=O)c1ccc(Br)s1)NNC(=O)COc1ccccc1O 730781384 LMIYAJWAADDEBQ-UHFFFAOYSA-N 464.319 0.721 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2ccc3c(c2)OCCO3)c1 770418830 IFZOIVAUIRUBAK-UHFFFAOYSA-N 490.538 0.679 50 20 JCGD COc1ccc(C(=O)NCC(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1[N+](=O)[O-] 792977249 XKIAWIQSVPQAGX-UHFFFAOYSA-N 464.818 0.991 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CN2C(=O)COc3ccc(Cl)cc32)ccc1Cl 818030015 ZHBFZGHWZPNPNT-UHFFFAOYSA-N 473.294 0.827 50 20 JCGD Cc1c(/C=C(/C#N)C(=O)OCC(=O)N2CCN(c3ncnc4c3cnn4C)CC2)cc(C#N)n1C 858002776 MDNRGYSMCNIXAC-IUXPMGMMSA-N 473.497 0.681 50 20 JCGD O=C(CCc1nc(-c2ccccn2)no1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 915063283 YUBJPYARRXESAM-UHFFFAOYSA-N 486.510 0.546 50 20 JCGD O=C(NC[C@H]1CN(Cc2ccccc2)CCO1)NNC(=O)c1csc(N2CCOCC2)n1 915893737 ADYXHKGJTYCCHB-KRWDZBQOSA-N 460.560 0.825 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(c3ccccc3F)C2)ccc1Cl 916561273 MDKQYMAEGYQLJN-NSHDSACASA-N 454.867 0.941 50 20 JCGD N#Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1Cl 917718381 YASYWIREJXQUDZ-UHFFFAOYSA-N 484.943 0.856 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2n[nH]c(C)c2C(=O)OCC)c2ccccc2c1=O 917722724 ZULNXYYKAMRBDC-UHFFFAOYSA-N 462.488 0.638 50 20 JCGD O=C(CCNS(=O)(=O)c1ccc2ccccc2c1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 920212315 AYCDCTLNRSWKSE-HNNXBMFYSA-N 454.530 0.026 50 20 JCGD Cn1cc(F)cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1778373280 ODYKUPFNUVNMPJ-XMSQKQJNSA-N 458.494 0.604 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](O)c1ccco1)C2 1779371119 FIEFRBSEDZVJST-KGVIQGDOSA-N 457.487 0.139 50 20 JCGD CN1CCC[C@@H](C(=O)N2CCO[C@@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)C1 1780967882 AUXYVKOXSYWCPX-PXDATVDWSA-N 486.617 0.504 50 20 JCGD CCO/C=C/C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780970327 STMAGBUEOHWQIF-LEBWJFOGSA-N 459.547 0.713 50 20 JCGD N#Cc1ccc(F)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1781103284 PMGDDBRIWRZBQU-ZJSXRUAMSA-N 465.290 0.818 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2cccnn2)C1 1782518178 IYNACAYPMKPMEN-SJUPTTPXSA-N 483.529 0.503 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1)N1CCO[C@]2(CCN(C(=O)[C@H](Br)Cc3ccccc3)C2)C1 1783022737 NRNNKEPKHYANPS-NYUBLWNDSA-N 466.376 0.545 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ncc(Cl)cc1Cl 1783428955 VWZFAAUQVHKXQY-OWQGQXMQSA-N 478.141 0.975 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N2CC[C@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)c1 1784449020 GHHUTEPTJMNULU-CPJSRVTESA-N 497.600 0.929 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)CN3CCN(C(=O)OC(C)(C)C)CC3=O)C2)C1 1785669859 QHOHJZDUMPZGOV-ZHRRBRCNSA-N 486.997 0.913 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc4cnccc34)C[C@@H]21)c1cccc(B(O)O)c1 1786984295 ZVZDWHDKWLVVKK-TZYHBYERSA-N 459.311 0.822 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1csc2c1CCCO2 1787256347 JBNVHTNVAPXEDX-QSFXBCCZSA-N 470.356 0.660 50 20 JCGD C[C@H](CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)NC(=O)OC(C)(C)C 1787467653 UZZNIKBNMXACSV-LQJIQPLVSA-N 489.378 0.263 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccn4cncc4c3)[C@H]2C1 1788409069 YRUZTHQQAKRTDF-YSSFQJQWSA-N 463.498 0.240 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)n(C(F)F)n1 1791290913 RTXNCPXUQFQMLX-DZKIICNBSA-N 456.494 0.553 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C[C@@H]1CCOC1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](O)CCl 1792978303 POLSCGMWXGGHMZ-ARAZSQDJSA-N 489.997 0.496 50 20 JCGD Cc1cc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CN(C)NC(=O)NCc2ccccc2)C3)nn1C 1793131402 XLRHMDQDEHACTG-IRJINJETSA-N 497.600 0.207 50 20 JCGD C[C@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc(O)nc(O)c2C1 1794108687 PAWLESJSXVMIMM-QCPCCJPKSA-N 483.363 0.613 50 20 JCGD O=C(CCBr)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2 1795116589 WGZBHPNOHGPZOP-DRXBFXEBSA-N 457.281 0.131 50 20 JCGD COc1ccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1OC 1795733023 YOFFJDWHQOWITN-NHKMSHSESA-N 482.342 0.220 50 20 JCGD COc1ccc2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3ccc(B(O)O)cc3)[nH]c2c1 1795734643 WWJVCLVWFIYRQT-FAQVEIGNSA-N 463.299 0.373 50 20 JCGD N#Cc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c(C(F)(F)F)n1 1795995031 OLZDEOUQYFUXOW-ZSBFGKGUSA-N 488.231 0.169 50 20 JCGD C[C@H](CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)NC(=O)OC(C)(C)C 1796189329 YZRGMIPCRUOESO-DQEVTTJGSA-N 459.352 0.922 50 20 JCGD C[C@H](C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1)[S@@](=O)c1ccccc1 1796190396 UNAKCSVDMTXTLL-ADBFTHKZSA-N 454.357 0.815 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796441390 GDGFNRDWAYBHNB-OJZGHSRISA-N 460.535 0.015 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccccc1C(N)=O)C2 1796443876 PHVABBAHCYWAGD-RVQRMFQJSA-N 466.498 0.123 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](N)Cc1cccnc1 1796845013 CSEOCACYXFXDOZ-RTOSZMOLSA-N 451.531 0.724 50 20 JCGD CC(C)(C)OC(=O)N1CCn2ncc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)c2C1 1797319487 KKKCHEWOHGCRKZ-LTCOOKNTSA-N 497.980 0.437 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(-c2cc[nH]n2)n2ccccc12 1797321513 WEZXBVKKSDPPIZ-MRSFGVLCSA-N 499.336 0.526 50 20 JCGD COC(=O)Nc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797753161 VXBSNEYEUVCBMY-CCWDJLKJSA-N 482.497 0.380 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3sc(C)cn3c1=O)C2 1800977695 CTLPXFJFMBDPEE-NEBZKDRISA-N 454.936 0.521 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)[C@@H]2C1 1801899473 LOCULXXBEWCAQQ-AEUURAPJSA-N 483.374 0.731 50 20 JCGD C[C@H](CBr)C(=O)N1CC[C@H](CNC(=O)C[C@@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1804343110 WEYVPHAQRUXPFL-OEYIWLLWSA-N 466.336 0.717 50 20 JCGD CC(=O)O[C@H](C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)C(C)C 1807360004 GDGRGCLOXVZUOD-FCEUIQTBSA-N 467.331 0.669 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)Cn2cncn2)[C@@H]1c1cccnc1 1807595042 DMEQQTFSVQBZAD-RYUIIRDCSA-N 463.502 0.513 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1 1808110166 PYSPLWNNTZXOIV-QRWLVFNGSA-N 485.508 0.985 50 20 JCGD COCCn1nccc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1808639876 TTZATMPQYUNOMQ-PGRDOPGGSA-N 471.562 0.617 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cc(-n2ccnc2)ccn1 1811581242 AUZMJTONWJBGLW-GBXCKJPGSA-N 496.336 0.976 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1cncn1 1813400818 WBHLRAZJUVWFEC-SIXWZSSISA-N 463.502 0.252 50 20 JCGD O=C1Cc2cc(C(=O)N[C@@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)ccc2N1 1815344087 GXIPWJZRMNQAGT-MRXNPFEDSA-N 476.323 0.857 50 20 JCGD COc1cc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)ccn1 1815360751 MZCCQSHOBCOQBI-HNNXBMFYSA-N 452.301 0.766 50 20 JCGD CC(=O)N(C)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819793749 SHDMXLXRQFUMRJ-GFCCVEGCSA-N 459.532 0.236 50 20 JCGD CCN1CCC(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1 1828348149 DRIIFDQHZMHNJN-KRWDZBQOSA-N 456.377 0.781 50 20 JCGD Cn1nncc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828548025 CKZGKJRCYYRYDT-GCJKJVERSA-N 490.948 0.481 50 20 JCGD Cc1ccc(F)cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1830071383 PXRISEXXFAVQQI-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD CCc1c(Br)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)nn1C 1830722576 DLCKQCUILZHVGN-SCLBCKFNSA-N 493.786 0.415 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CC(=O)N(C3CCCC3)C1)CCO2 1832360457 UKDZZTPPDRNFSP-ZJBJCVSYSA-N 471.982 0.488 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1C 1832399709 FLGIMRAIJVUQGP-VWLOTQADSA-N 481.553 0.615 50 20 JCGD Cn1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)cn1 1832549717 ZSMBGXMGHHVWAK-KKSFZXQISA-N 485.969 0.622 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832872335 AQVGXQUUOZUMBA-YWZLYKJASA-N 485.379 0.622 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1)c1cccc(B(O)O)c1 1834800659 WEAXRFIYUYICHR-UHFFFAOYSA-N 470.291 0.367 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)[C@@H]1SC(=N)NC1=O 1834821594 OOXPKFJJXWOHSD-BNLOLNQZSA-N 477.381 0.030 50 20 JCGD CCOCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1834981821 SLZRNYGSAYXSHB-MGPUTAFESA-N 463.959 0.611 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](N)c1ccccn1)CCO2 1835707605 KTIZLFWUMPYJEC-QOKNQOGYSA-N 455.353 0.711 50 20 JCGD Cc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737239 ZLVFZJFRVNFURQ-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccccc3N)CCO2)C1 1835781147 LZKFDNRYCAHFMQ-WCYCAPIHSA-N 459.547 0.111 50 20 JCGD Cc1cc(F)ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835933891 IEHMWZUYVCUKCC-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD Cc1cc(Cl)ccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835934355 XJTKXKFBENBFKJ-HSZRJFAPSA-N 472.734 0.712 50 20 JCGD CN(CC(=O)NC1CCN(C2CCN(C(=O)C3CC(=O)C3)CC2)CC1)NC(=O)NCc1ccccc1 1836343905 OTTLRAVTZCVPMJ-UHFFFAOYSA-N 498.628 0.883 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1csc3c1CCCO3)CCO2 1836387639 QTDGOGSDNZOAEQ-QHCPKHFHSA-N 486.355 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)[C@@H]3[C@H]4C=CS[C@@H]43)CC2)CC1 1836511510 CUVUMODGANCXIR-RLLQIKCJSA-N 470.599 0.745 50 20 JCGD Cc1[nH]nc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1F 1837330531 NLWRPYSJDMIXDF-UHFFFAOYSA-N 458.299 0.463 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc4c3OCC4)C2)C1 1837460025 ZKGZEFQNZOGNSH-XMMPIXPASA-N 481.509 0.004 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@H]3C[C@@H]4CC[C@H]3C4)C2)C1 1837460579 HLVLMUNXHDADPX-NDBKNAECSA-N 471.558 0.581 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc4c(n3)OCCO4)CC2)CC1 1837920351 OGOPVFHXSVDBLU-UHFFFAOYSA-N 495.341 0.459 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3nc(O)n4c3CCCC4)CC2)CC1 1838438322 PXUNDZPIFVKXEE-UHFFFAOYSA-N 490.605 0.910 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(=O)nc4cccnn34)CCO2)C1 1838503549 ZWIPYFVPTCYUJW-VBKZILBWSA-N 494.346 0.333 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1838568666 JTBHYIKHYUYCBT-UZLBHIALSA-N 458.870 0.440 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)CCO2)C1 1839450430 NNOFELUZTZVGBU-LAUBAEHRSA-N 484.937 0.985 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnn4c3CCC4)CCO2)C1 1839530675 DIIBCSKLRWLNQO-LIRRHRJNSA-N 455.353 0.930 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccc(F)c34)CCO2)C1 1839620436 LSJJNORUVPHVAP-QRWLVFNGSA-N 454.886 0.797 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn4ncccc34)C2)C1 1839964377 PWUHYMVKQBCBKU-BEFAXECRSA-N 466.336 0.973 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CC[S@@](=O)CC)C2)C1 1839965457 ZDZAXPGLOYFULO-CHLCXMBXSA-N 453.399 0.775 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nn[nH]c4c3)C2)C1 1840035196 JMIAKBRHHUQWOW-KZULUSFZSA-N 452.309 0.811 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1840152759 SFBNNUNBVWUKAM-VLIAUNLRSA-N 455.895 0.177 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4cc(F)c(F)cc4[nH]3)C2)C1 1840184342 HNIKFIOPAQEUQH-QHCPKHFHSA-N 493.511 0.889 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(F)c(F)c(Cl)c1)CCO2 1840753407 BUHXHCIEEQPKRD-JOCHJYFZSA-N 494.687 0.682 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)c1ccccc1 1840892208 NATBRUQTXGQHAI-BXKMTCNYSA-N 467.526 0.559 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C1 1841430313 FDQFZBAWQIAEEP-CIRUFVMISA-N 490.561 0.600 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C2)C1 1841505688 NRYPQOCJSYDELZ-LJQANCHMSA-N 455.559 0.612 50 20 JCGD O=C(c1cc(Br)ncc1F)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013882 ZGLRDNNOUZTQPP-UHFFFAOYSA-N 462.084 0.794 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)cnc2c1 1843787388 SWQSZWQDSSUUSC-UHFFFAOYSA-N 461.482 0.132 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)[C@H]2CN(Cc3ccccc3)CCO2)C1 1843924903 JMIXJSCQBYDEEI-OAQYLSRUSA-N 478.553 0.403 50 20 JCGD Cc1cc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)n(C)n1 1845038607 YCHSFFRHPLLCKJ-UHFFFAOYSA-N 453.547 0.892 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)CCOC1 1845208253 RANQMSWCUBWUCZ-HSZRJFAPSA-N 488.545 0.186 50 20 JCGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 1846904183 ISTFREZZMGSBCX-SFHVURJKSA-N 485.990 0.778 50 20 JCGD COC[C@@H](C)n1c(C)cc(/C=C(/C#N)C(=O)NCCN2CCN(S(C)(=O)=O)CC2)c1C 115999940 CWASVMMRSANRPT-VJOZSWGJSA-N 451.593 0.913 50 20 JCGD CCn1c(=O)[nH]c(=O)c2c(C(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc(C3CC3)nc21 116817075 WIEOBCBOYDDWAG-UHFFFAOYSA-N 475.465 0.304 50 20 JCGD COCCCNC(=S)N(C)NC(=O)CCc1nc2cc(S(=O)(=O)N(C)C)ccc2n1C 726076822 FLVILLVZIGEIDX-UHFFFAOYSA-N 470.621 0.630 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccc(Br)cc1)C(=O)NNC(=O)C(=O)NC(C)C 726614433 QEDWBKNJJSFCPC-ZDUSSCGKSA-N 495.421 0.521 50 20 JCGD COc1cc(OC)cc(C(=O)Nc2ccc(C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)c(O)c2)c1 728203203 HZOYTINOYDCUHQ-LBPRGKRZSA-N 477.495 0.857 50 20 JCGD Cc1n[nH]c(C)c1S(=O)(=O)N1CCC[C@H](C(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)C1 728208761 RXAHDLWYOUTRPG-HNNXBMFYSA-N 483.572 0.292 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(N3CCCS3(=O)=O)cc2)c1 746501874 ATTGVSVKLCORMR-UHFFFAOYSA-N 466.541 0.552 50 20 JCGD Cn1c(=NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c2ccccc2)sc2ccccc21 798303917 HLTJSCCJAGEOPV-OAHLLOKOSA-N 482.609 0.954 50 20 JCGD C[C@@H](NC(=O)c1ccc(S(=O)(=O)N(C)C)cc1)C(=O)OCC(=O)NNC(=O)c1ccccc1 811677595 DBUCNVBRVPUEQY-CQSZACIVSA-N 476.511 0.060 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)CCCNS(=O)(=O)c2ccc3c(c2)OCCO3)cc1 825229330 YHSDGOHANYWPGY-UHFFFAOYSA-N 491.522 0.829 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CS(=O)(=O)Cc1ccc(C#N)cc1 916134484 MTBXFSIGQMZTOH-UHFFFAOYSA-N 463.541 0.536 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1)N[C@H]1CCS(=O)(=O)C1 919885981 OPIUVNDSKHJCGC-QWRGUYRKSA-N 459.322 0.320 50 20 JCGD C[C@@H](Cc1ccc(O)cc1)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 919911479 OCAIFIMDLURWFL-HNNXBMFYSA-N 462.528 0.988 50 20 JCGD Cn1nc(C(=O)NNC(=O)CNC(=O)[C@H]2c3ccccc3C(=O)N2C2CC2)c2ccccc2c1=O 920275723 IEXVYRVFMMSSGR-HXUWFJFHSA-N 474.477 0.170 50 20 JCGD Cn1c(C=NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)nc2c1c(O)nc(=O)n2C 920362113 MKPSRWFXEWOOKB-UHFFFAOYSA-N 484.480 0.838 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)[C@@H](CO)NC(=O)c2cccc(Br)c2)cc1 920646592 IBDGFKOPCDLGTH-MRXNPFEDSA-N 478.299 0.853 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)C1CCN(S(=O)(=O)c2ccccc2C(F)(F)F)CC1 920827546 ZYZMORAIMVGTRI-UHFFFAOYSA-N 476.477 0.876 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)NCCc2cccs2)cc1 920888884 BRPSWHRJOSJEFE-UHFFFAOYSA-N 453.546 0.948 50 20 JCGD CC(=O)N[C@H](C)c1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)s1 1115981851 JFTUZOGORQHVKM-GFCCVEGCSA-N 452.562 0.961 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)NCC(C)C)C1 1778114918 YMADZPNRHORPRB-SJUPTTPXSA-N 474.562 0.407 50 20 JCGD CC(C)(C)OC(=O)CCCC(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779029760 YHQXEFZOBYDYLY-HSZRJFAPSA-N 475.546 0.641 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccn1 1779032304 ISAMMBXUVRPTID-QHCPKHFHSA-N 482.497 0.014 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](C)Cn3cncn3)C2)C1 1779221051 MJJLBDKGQNGSPJ-OYHNWAKOSA-N 486.485 0.891 50 20 JCGD Cc1c(C(=O)N2CC[C@@]3(CN(C(=O)CCBr)CCO3)C2)cn2[nH]cnc(=O)c12 1780020311 SEJMNNGILBZRTE-GOSISDBHSA-N 452.309 0.560 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2)c1cc(=O)nc2cccnn12 1780040487 NERUYQODHMHLJM-ACWOFJMJSA-N 482.310 0.908 50 20 JCGD Cc1ccn(CC(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n1 1780968377 FLDSRLVTYKCOHS-DEOSSOPVSA-N 483.573 0.368 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc(O)c([N+](=O)[O-])c3)C2)C1 1781541156 BKMLLNNDYBMKIB-OAQYLSRUSA-N 470.442 0.056 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1C(=O)CSC1=S)C2 1782178294 KHTDTTCBIRANOE-VEVIJQCQSA-N 464.009 0.614 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(Cl)nn1)C2 1782215057 QFBYMFRRYZZLIT-FOIQADDNSA-N 452.943 0.631 50 20 JCGD COc1cccc2c1C[C@@H](C(=O)N1CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C1)CC2 1782986040 BBEISIYQPYRUGG-FNZWTVRRSA-N 478.354 0.624 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1783538526 UYKHZVGBYWDQPR-APPDUMDISA-N 455.334 0.983 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)[C@H]2OCC[C@H]21 1783545526 HEHQYYZLMNOZFB-IPVGUQKPSA-N 487.981 0.440 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cc3cccnc3nc1O)CCO2 1783937449 RRQPLFGRPKIZTK-JOCHJYFZSA-N 456.503 0.152 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)C[C@H]3CCN(C(=O)OC(C)(C)C)C3)C2)C1 1784146793 DHSUEYKKCYVTBG-KOSHJBKYSA-N 495.621 0.836 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)Nc1ccc(C2(NC(=O)c3ccc(B(O)O)cc3)CCC2)cc1 1786335809 KHZBDROSWKEAMV-OAHLLOKOSA-N 473.360 0.442 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3c(F)cccc3Cl)C[C@@H]21)c1ccc(B(O)O)cc1 1786978640 GUGQEKYZRDHLTO-XERREHJYSA-N 474.725 0.995 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cscn3)C[C@@H]21 1787509095 RSGYCKWQSIXPBD-NGTHKXITSA-N 458.544 0.799 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)n1cccc1C=O 1788610672 OYBILCRRQYRWAM-QBTDHISASA-N 468.514 0.154 50 20 JCGD COCCOCCOCCOCCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C(Cl)Cl)C[C@@H]21 1789950390 JBWXYDOOEFJLPX-ULQDDVLXSA-N 485.405 0.856 50 20 JCGD C[C@H](Oc1ccccc1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1790949815 PULAJXBVHFGQRL-LRGYGIHKSA-N 467.526 0.746 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1 1791055054 GSBMODHQHCZBOK-QMVSFRDZSA-N 454.387 0.077 50 20 JCGD C=CC(=O)N[C@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1797946174 ARHIAJVKGIXAPA-ZCQATVAHSA-N 474.470 0.414 50 20 JCGD CCOC(=O)c1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C3)ccn1 1798684462 CFOYHNVCGWRWRZ-VYKSVWDLSA-N 496.524 0.596 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(-n2cccn2)nc1 1798900502 XEPANJRVMZMQSD-BJWYYQGGSA-N 460.498 0.831 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)c1cccn1C)C2)NC(=O)NCc1ccccc1 1799098202 BHZBVKBRHFDMTM-HATOLVCRSA-N 496.568 0.144 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Br 1799341980 AYZOBXIVSOITMX-MLGHIDQZSA-N 468.320 0.152 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)c2cc(O)n(C)n2)[C@@H]1c1cccnc1 1804894241 YQDWAEQYDHAKTB-RVGDNOHSSA-N 478.513 0.974 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCCC2(CCN(C(=O)c3cccc(B(O)O)c3)CC2)C1)C(C)(C)C 1805804523 BBSYACQTVFKWIR-FQEVSTJZSA-N 457.380 0.762 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@@H](CNC(=O)CN2CCOCC2)[C@H]1c1cccnc1 1806907101 PVRFDNUPFMLVIE-DXNGAEDLSA-N 481.557 0.554 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cn1 1807369482 LONSXWIGHNEOBG-AVRDEDQJSA-N 475.314 0.584 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1C 1807376179 UCUTUSDLKQUCBY-UTKZUKDTSA-N 463.303 0.137 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)c2cnnn2C)[C@H]1c1cccnc1 1808409967 PZIJNPJSTJXUJN-YRJCQSRDSA-N 463.502 0.664 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)COC(=O)C(F)(F)F)[C@@H]1c1cccnc1 1810187148 HBUVNUDHZBFMIB-KDOFPFPSSA-N 473.452 0.566 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cnsn2)[C@H]1c1cccnc1 1810297372 BTERLRMXNBRBKA-GUYCJALGSA-N 452.500 0.565 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1 1810302241 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C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)N(C)C(=O)OC(C)(C)C 1830732807 ATBAUBMFTKBIFS-SXGZJXTBSA-N 463.959 0.298 50 20 JCGD C[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1)[S@](=O)c1ccccc1 1830736578 TYHITKHYGNNNMS-XUAWYVHWSA-N 458.964 0.239 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1 1830739123 ZDPJJUHFRHYKCD-MIZPHKNDSA-N 465.978 0.707 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1831164127 IAWQMTZEKVGMEK-FDDCHVKYSA-N 478.615 0.997 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCNC(=O)c3ccc[nH]3)CCO2)C1 1832872523 CSXMTYOEWSOLHC-KKSFZXQISA-N 454.955 0.999 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc(Cl)n3)CCO2)C1 1833177568 DUKAOIQOHUEXTK-QFIPXVFZSA-N 488.932 0.046 50 20 JCGD COC(=O)[C@H]1CC[C@H](C(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)C1 1833307498 VREPGLATRPDMFI-ROUUACIJSA-N 479.622 0.520 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(C(=O)O)ncn3)CC2)CC1 1833967997 CQFJYJFSVSHWOX-OAHLLOKOSA-N 453.927 0.614 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)nc1)CCO2 1834274401 FGOCBLDDUNIDTF-OAQYLSRUSA-N 493.247 0.164 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnccc3Cl)CC2)CC1)c1ccc(B(O)O)cc1 1834798360 LYKQQHVZIUAUAI-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)c3cnc4c(c3)CCNCC4)C2)C1 1834824862 NYTOFOQLJMLZAT-OAQYLSRUSA-N 481.391 0.625 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)C3(C(F)(F)F)CCC3)C2)C1 1835929116 ABGYLCCADLNFKQ-LJQANCHMSA-N 470.253 0.169 50 20 JCGD O=C(c1ccc(F)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835931266 KMBCZSLBBAAMRG-JOCHJYFZSA-N 460.242 0.028 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835934150 NDKWXSTXWKTZDH-GAJHUEQPSA-N 485.371 0.012 50 20 JCGD C[C@H](Sc1ccccn1)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1835939992 RRLSOSZMSZTHBW-GAJHUEQPSA-N 485.371 0.012 50 20 JCGD N#Cc1cccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1836258448 KUHKTACWBSAHRA-UHFFFAOYSA-N 460.343 0.737 50 20 JCGD O=C1COc2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)C(Cl)Cl)C4)C3)cc2N1 1836994590 QREIACXEBZINKN-IBGZPJMESA-N 458.298 0.891 50 20 JCGD Cc1cncc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1837498519 XMNBAUWCTBKMAR-UHFFFAOYSA-N 451.332 0.996 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](N)Cc3cccnc3)C2)C1 1837711282 BJYHHUDRWQBVSY-RXVVDRJESA-N 450.612 0.259 50 20 JCGD CC(C)NCCC(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837910138 RPBQUFJRJZHNMF-UHFFFAOYSA-N 460.579 0.685 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)c3[nH]nnc3C)CC2)CC1 1838001206 YAUOJZSIJGMLNN-BUVRLJJBSA-N 470.534 0.859 50 20 JCGD O=C(CN1C(=O)C=CC1=O)N1CCC(OC2CCN(C(=O)[C@@H](F)Br)CC2)CC1 1838648548 YSDPOAXDMWXORI-QGZVFWFLSA-N 460.300 0.601 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nn[nH]c1C(F)(F)F)CCO2 1838765050 BROUHYQJZNKWAS-INIZCTEOSA-N 465.505 0.745 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1838934312 NTNBIARIGNCBPQ-DEOSSOPVSA-N 499.524 0.086 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc(S(C)(=O)=O)c3)C2)C1 1839151141 JHJNHLZZXLYDJU-OALUTQOASA-N 494.397 0.791 50 20 JCGD O=C(c1cnn2c1OCCC2)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839518080 HKCPWVPGNQDRIE-DYVFJYSZSA-N 461.288 0.426 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc31)CCO2 1840256778 BVGZEZVBUHDIMY-RCZVLFRGSA-N 464.327 0.166 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(Cl)c1 1840734296 FVIMBCSPIGAEOG-QHCPKHFHSA-N 488.733 0.412 50 20 JCGD COc1cc(CC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc(OC)c1OC 1844263434 FLSNQLRROQKRKC-UHFFFAOYSA-N 483.525 0.771 50 20 JCGD O=C(COc1ccccc1F)NNC(=O)NCc1ccc(S(=O)(=O)N2CCOCC2)cc1 9750787 RQOBEMGKCYVDQG-UHFFFAOYSA-N 466.491 0.756 50 20 JCGD CS(=O)(=O)c1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-] 15314497 LXHSONLJGSSJPT-UHFFFAOYSA-N 475.527 0.972 50 20 JCGD O=C(CSc1ncccc1C(=O)NNC(=O)[C@H]1CCS(=O)(=O)C1)Nc1ccc2c(c1)OCO2 16785859 ZVTMADKTBWADNW-LBPRGKRZSA-N 492.535 0.737 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)c2cccc(CS(C)(=O)=O)c2)cc1OC 17833257 RJBMHTRHQRWKLR-UHFFFAOYSA-N 450.469 0.866 50 20 JCGD COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1 21191533 DHVIWDKGIORWAS-BEFAXECRSA-N 491.522 0.216 50 20 JCGD CC(C)NS(=O)(=O)Cc1ccc(CNC(=O)NNC(=O)CNC(=O)c2ccco2)cc1 725870767 QYIPMOMFYSTHPZ-UHFFFAOYSA-N 451.505 0.368 50 20 JCGD COc1ccc(C(=O)NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)cc1OC 727063377 VJIXHAVRGNIFJF-UHFFFAOYSA-N 465.264 0.371 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)[C@@H]3CC(=O)N(Cc4ccccn4)C3)cc2)CC1 728214788 SJQTUXYCAGWZBF-QGZVFWFLSA-N 472.571 0.510 50 20 JCGD O=C(COC(=O)CCS(=O)(=O)c1ccc(F)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 728313593 JPHFWIVQHZOVHN-KRWDZBQOSA-N 466.443 0.520 50 20 JCGD O=C(COC(=O)[C@@H]1CCN(c2ccc(F)cc2)C1=O)NNC(=O)[C@@H]1COc2ccccc2O1 728335858 RUUWPTUJAMVYDR-QAPCUYQASA-N 457.414 0.709 50 20 JCGD CC[C@H](C)[C@H](NC(=O)c1cc(S(=O)(=O)N(C)C)ccc1Cl)C(=O)NNC(=O)c1cnn[nH]1 729456577 UAVMCCNTOPLJRJ-BONVTDFDSA-N 485.954 0.314 50 20 JCGD O=C(CCCS(=O)(=O)c1ccc(Br)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1 730958943 IRRSSDJZPWARLK-NSHDSACASA-N 467.363 0.585 50 20 JCGD CC(C)NC(=O)NNC(=O)CCc1nc2cc(S(=O)(=O)N3CCOCC3)ccc2n1C 745139948 ZPJPIUUWZCVSPA-UHFFFAOYSA-N 452.537 0.266 50 20 JCGD C[C@@H](CN1CCOCC1)C(=O)NN=C1C(=O)N(CC(=O)N(C)C)c2ccc(Br)cc21 750935264 PZPOCNQRTYGAQY-ZDUSSCGKSA-N 480.363 0.673 50 20 JCGD COc1ccc(C(=O)NNC(=O)CN2CCCC2=O)cc1S(=O)(=O)N[C@@H]1CCCC[C@H]1C 789856209 ATDRQYXRONMZLW-GDBMZVCRSA-N 466.560 0.936 50 20 JCGD CNS(=O)(=O)c1ccc(C)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 811826693 ZKGIVALCJRVWFQ-QGZVFWFLSA-N 463.468 0.047 50 20 JCGD C[C@@H](Oc1ccc(F)cc1)C(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 912860933 NSSRFNOYBLWKTB-CYBMUJFWSA-N 467.475 0.880 50 20 JCGD CCNS(=O)(=O)c1ccc(F)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c1 917909547 YHTHZIGKVQYLGG-UHFFFAOYSA-N 472.520 0.449 50 20 JCGD COc1ccccc1N(C)S(=O)(=O)c1ccc(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1 919883781 CQEUTSSTGHBRRW-OAHLLOKOSA-N 496.567 0.651 50 20 JCGD CCN(CC)C(=O)CNC(=O)NNC(=O)C[C@@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 920814047 KGEQMIRRRSZHNW-MRXNPFEDSA-N 499.590 0.152 50 20 JCGD Cc1ccc(S(=O)(=O)N2Cc3ccccc3C[C@H]2C(=O)NNC(=O)CN2CCCC2=O)cc1 920826720 OIQZBOTZXMLRMT-FQEVSTJZSA-N 470.551 0.880 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C2)C1 1778114253 BFUSVRKTBSZXED-MSOLQXFVSA-N 470.419 0.724 50 20 JCGD COc1ccc(OCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779029214 NVZUEQXZLXUSTQ-QHCPKHFHSA-N 469.498 0.216 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cn4ccc(Cl)cc4n3)CCO2)C1 1779032548 SJFSOFZQZUGCOQ-JOCHJYFZSA-N 483.916 0.744 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CO[Si](C)(C)C)C1 1779545474 PUQCIOSURWIXKM-DBXWQHBBSA-N 472.611 0.847 50 20 JCGD COc1ccc(CC(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c([N+](=O)[O-])c1 1781414404 NLGPRNAGMRDXPC-JOCHJYFZSA-N 477.518 0.349 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1Cc3ccccc3CN1C)C2 1782208992 FUTBHLOGOGENBD-XLGIIRLISA-N 485.629 0.930 50 20 JCGD CN(C)CC[C@](Cc1ccccc1)(C(=O)O)C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1782802225 FIRPCLTWXXVRQQ-CTUHWIOQSA-N 496.004 0.681 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc3sc(N)nc3c1)CCO2 1783934000 RHDAZAMTYJPRMA-OAQYLSRUSA-N 460.560 0.695 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)nc1 1783935681 XAFIZDJRMIUFEA-QHCPKHFHSA-N 461.563 0.750 50 20 JCGD C[C@H](NC(=O)c1ccccc1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783939336 CWFHJWNOBALHMX-SBUREZEXSA-N 459.547 0.008 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CCC(=O)N3C(=O)OC(C)(C)C)C2)C1 1784191243 XAZAGRHRBLLXRM-WAIKUNEKSA-N 495.577 0.115 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CCCN3Cc3ccccc3)C2)C1 1784237532 UGYLTLOUQLDBFD-JYFHCDHNSA-N 477.370 0.475 50 20 JCGD 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CC(C)(C)OC(=O)N[C@H](CCCNC(N)=O)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H](O)CCl 1793117682 YFOVLVUZRVFXRF-JKJDWNRSSA-N 490.001 0.566 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cn1ccc3ccc([N+](=O)[O-])cc31)C2)c1cccc(B(O)O)c1 1795737699 KYSUSMGLLLPIMQ-FEJSZKPUSA-N 492.297 0.133 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2scnc2c1 1797491971 QSPBNHURCLCSAS-CWPLJXCYSA-N 451.313 0.493 50 20 JCGD Cc1ccc(OCCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797748100 IGENRIHWSCEOOI-FAQVEIGNSA-N 467.526 0.666 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C 1799798396 YVAZTERQEOGYCO-USGNIVHTSA-N 476.534 0.237 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)c1 1801012915 MYJPSACXNBWLSL-FAQVEIGNSA-N 469.546 0.152 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccc(O)cn1)NC(=O)NCc1ccccc1 1801463567 INSZWMFLDTWEAA-NHKMSHSESA-N 496.568 0.266 50 20 JCGD CSC[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1801945346 UVGFGPXMHMCPGX-AICCOOGYSA-N 466.000 0.432 50 20 JCGD O=C(COc1ccc(O)cc1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1802888165 OTFDXIDVKJMBMS-YADARESESA-N 475.310 0.866 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C(=O)c2ccccc2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807371211 RCXQMCIYNANFBG-UNMCSNQZSA-N 457.295 0.964 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807375757 QBUKIKADNNEGJD-NQIIRXRSSA-N 455.396 0.933 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)[C@H]2CCC(=O)N2)[C@H]1c1cccnc1 1808414367 IBAHBTRGHZTCSU-VFFUBVFWSA-N 465.514 0.500 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(CO)o2)[C@H]1c1cccnc1 1810303766 YBDMFETVMALKGS-YWZLYKJASA-N 464.482 0.799 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1812865843 YDOOWXNDRRQMTC-ZVZYQTTQSA-N 487.420 0.601 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C[C@@H](N)c2cccnc2)[C@@H]1c1cccnc1 1813070462 GZBJMYKWQKGDFK-DCLXLUIPSA-N 467.574 0.946 50 20 JCGD Cc1cc(C)n(CC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1 1815926484 UPCYMIYGGVSIFD-LJQANCHMSA-N 450.308 0.909 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817477414 YVSGHSUOQOHJRT-SUMWQHHRSA-N 458.280 0.957 50 20 JCGD C[C@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1)C1(O)CCC1 1819791626 QRZCEUFNZPMNSQ-NEPJUHHUSA-N 458.544 0.919 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3nc(O)n4c3CCCC4)sc2C1 1820236716 LYSNVWPUBRYZKN-LLVKDONJSA-N 496.553 0.920 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1)[C@H](F)Br 1820937808 VJRGMHFVBXQJTA-DOMZBBRYSA-N 450.309 0.379 50 20 JCGD Cc1cc(C)n(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)n1 1826577145 JARAMQKGUUMHAB-QGZVFWFLSA-N 467.360 0.952 50 20 JCGD COCCOCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551570 RAFQOZUNVVWSQV-AUSIDOKSSA-N 497.976 0.701 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1829026064 NCGVDWJGMRANQI-HTAPYJJXSA-N 493.373 0.208 50 20 JCGD COCC(=O)N1CC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCN2C(=O)OCc2ccccc2)C1 1829356121 LNSBEWIGZBSDOI-XMMPIXPASA-N 489.573 0.458 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830545283 IWTPCPJXZWOTJI-URLQWDBASA-N 462.385 0.779 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3cnccn3)C2)C1 1830546663 VHXZTXMLHOXFRX-JDDKEMAESA-N 453.337 0.977 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2c1 1830731899 RQPMDJSFOFOPQX-NQIIRXRSSA-N 451.907 0.846 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCCN1C)CCO2 1830755011 WYIVQSXKFSZPKE-YWFPPSRZSA-N 474.562 0.061 50 20 JCGD C[C@H](C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1)[C@@H]1SC(=N)NC1=O 1831870735 DEXIDIJTHHUVQS-GMBSWORKSA-N 480.635 0.782 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1832296493 LUMHDRFXCYOLDK-HXUWFJFHSA-N 451.332 0.821 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCC3)C2)C1 1832549376 KCSZCHKFKYZLGX-HTAPYJJXSA-N 489.013 0.671 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCc3ncc[nH]3)C2)C1 1832552060 XBCJCLILQKJEOE-KSFYIVLOSA-N 499.996 0.931 50 20 JCGD O=C(/C=C/c1cc2ccccc2o1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930772 YXOZHBKVATVACD-OGJPMFGRSA-N 490.321 0.896 50 20 JCGD O=C(c1cc2cn[nH]c2cn1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837199220 CJWUXEVNPZRJFX-PBHICJAKSA-N 456.272 0.718 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@H](N)c3cccnc3)C2)C1 1837711252 AFRWDJVZTKMNIC-WIYYLYMNSA-N 450.612 0.779 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(O)cc(O)cc3O)C2)C1 1837714423 FGNTYIUFLNQTTD-FQEVSTJZSA-N 454.552 0.725 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)[C@H](O)Cc3ccccc3)CC2)CC1 1838764332 GQBZHLFUJLTFDY-JOCHJYFZSA-N 474.602 0.962 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1)c1ccccc1F 1839233881 PNJSWYYDZQXWLP-BWAGFHJFSA-N 485.940 0.233 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(OC)c(OC)c3O)CCO2)C1 1839377578 JNXLEWBIJAKTEB-VFNWGFHPSA-N 472.922 0.733 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1[C@H]3SC=C[C@H]31)CCO2 1839697562 AWEJPXXMALTEMX-HGZGAAHFSA-N 473.555 0.452 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cccc(F)c3F)CCO2)C1 1839982547 ZJJDOWAICQQUHF-HSZRJFAPSA-N 489.479 0.276 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840142962 FIDIWVNZWPIJGJ-YGTYGHESSA-N 477.327 0.889 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncn(-c4ccccc4)n3)C2)C1 1840152928 YVFXCYHMFMYNKK-UWJYYQICSA-N 463.922 0.591 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3N(C)C)C2)C1 1840154736 FCXJFYFPTBRLRG-LAUBAEHRSA-N 484.937 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)C1 1840182672 POBNJNPNNBYJBI-YIEJHSOVSA-N 479.490 0.030 50 20 JCGD Cc1oc2cc(O)ccc2c1C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840184339 HNFWXVPPVKXTAW-DEOSSOPVSA-N 488.541 0.890 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCNC(=O)C1)CCO2 1840234310 WKYYWQDCAYIODG-PCYHPGSBSA-N 488.491 0.854 50 20 JCGD COC(=O)c1ccc(OCC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1 1840958202 VDJNFLRDXNANHK-YLJYHZDGSA-N 458.870 0.843 50 20 JCGD COCCn1ccc(C(=O)N2CC3(CCCN3C(=O)CN(C)NC(=O)NCc3ccccc3)C2)n1 1845038663 FQDSRAANULOQCM-UHFFFAOYSA-N 483.573 0.693 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)CCn2c(=O)[nH]c(=O)c3ccccc32)c2ccccc2c1=O 17197717 WRQWWCQJSMENEG-UHFFFAOYSA-N 462.466 0.832 50 20 JCGD O=C(NNC(=S)Nc1cccc(Br)c1)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 27011435 RNJMJKPHUIBZFU-GFCCVEGCSA-N 488.389 0.932 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2cc(-c3ccccc3)on2)c1 28793119 AOXAGPGIGFGARB-UHFFFAOYSA-N 471.495 0.783 50 20 JCGD CC(=O)N(CCC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)Cc1ccccc1 728343412 QSEUWOJADNKVIM-HXUWFJFHSA-N 455.467 0.956 50 20 JCGD CCCS(=O)(=O)c1ccccc1S[C@H](C)C(=O)NNC(=O)N[C@@H]1CCS(=O)(=O)C1 730532876 BTYIKXHAXPEAIH-CHWSQXEVSA-N 463.603 0.868 50 20 JCGD COc1c(F)cc(Br)cc1S(=O)(=O)NNC(=O)CNC(=O)c1ccco1 730767550 ZSEVNEFWPDZHQD-UHFFFAOYSA-N 450.242 0.929 50 20 JCGD CN(C)S(=O)(=O)c1ccc(I)c(C(=O)N2CC[C@@H](B(O)O)C2)c1 864233702 JSANHETZDWVBAJ-SECBINFHSA-N 452.079 0.230 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NN=C2C(=O)Nc3cc(N4CCOCC4)ccc32)cc1 915945766 YSTZZAZXEQJJLT-UHFFFAOYSA-N 471.539 0.925 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(NNC(=O)NCCNS(=O)(=O)c2ccccc2)nc1 916295585 ONQSZNPWCNATII-UHFFFAOYSA-N 470.577 0.717 50 20 JCGD CN(C)S(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 916646657 GFOONBIMCKOADW-UHFFFAOYSA-N 458.500 0.328 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3cc(Cl)ccc3O)n[nH]c2n1 917393382 MCXMAKQTXKIPRR-UHFFFAOYSA-N 465.927 0.717 50 20 JCGD Cc1c(C(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)sc2nc3n(c(=O)c12)CCCCC3 919883814 FQPWXZXELJFIPR-LLVKDONJSA-N 453.546 0.624 50 20 JCGD Cc1cc(N2C[C@H](C(=O)NNC(=O)N[C@@H]3CCS(=O)(=O)C3)CC2=O)ccc1Br 919884065 DPTPEHAKGNHVSH-VXGBXAGGSA-N 473.349 0.628 50 20 JCGD NC(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2C(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1 920017796 DVWXEJJMAQYBRZ-GGFYYBSYSA-N 464.478 0.777 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@H]2CC(=O)N(c3ccc(C#N)cc3)C2)cc1 1318069702 UMBJDIOICQWGIR-KRWDZBQOSA-N 469.523 0.688 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)CCO2)C1 1779028787 KKGKWJRKDZAQIQ-QMYPENSCSA-N 470.442 0.343 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)ccn1 1779557884 ONHCGNNEVVOPSQ-BHSKHCGUSA-N 454.487 0.668 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(CO)o1)CCO2)NC(=O)NCc1ccccc1 1780968217 GRLXAXAOEHAMGE-DEOSSOPVSA-N 485.541 0.562 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](N)c1ccccn1)CCO2)NC(=O)NCc1ccccc1 1780969427 GPVQQZMLUPZIFZ-RCZVLFRGSA-N 495.584 0.258 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2c(c1)C(=O)CC2 1781277534 KFEIJLLSTQNASR-ZEQKJWHPSA-N 476.338 0.937 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](O)NC(=O)OC(C)(C)C)C2)C1 1781862281 XZGIJJCTZXNQOP-XWCIJXRUSA-N 450.330 0.443 50 20 JCGD C[C@H](Cc1ccccn1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782418629 SMHHZNVDPSZMCN-YBGOQADZSA-N 465.359 0.768 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCO[C@]2(CCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1782868006 XFMUFTZKZSMLLJ-SNDXAZSDSA-N 476.480 0.853 50 20 JCGD CC(C)C(=O)Nc1nc(O)c2ncn(CC(=O)N3CC[C@]4(C3)CN(C(=O)[C@@H](F)Cl)CCO4)c2n1 1782885708 KLENDDRDQBDQRF-VLIAUNLRSA-N 497.915 0.491 50 20 JCGD Cc1cn(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C3)c(=O)nc1O 1783116067 HOKQLVFELSFSRP-IIBYNOLFSA-N 466.611 0.623 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cccc(N4CCCNC(=O)C4)n3)CCO2)C1 1783872506 ADHJDVQXZWMHAK-KSFYIVLOSA-N 479.965 0.105 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)CN(C)C(=O)OC(C)(C)C)CCO2 1783933830 HYLAIWQINHSHEX-NRFANRHFSA-N 455.556 0.056 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](F)Br)CCO2)C1 1785609105 OIHOSYCDLFCHCZ-WHWRDJHUSA-N 495.346 0.276 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C[C@@H]21)c1ccc(B(O)O)cc1 1786980989 IXUXYRHLKRBDDJ-IXDGSTSKSA-N 483.721 0.198 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)C1CC1 1787441668 YQUYSOBWVNEWRS-KSWRQPAISA-N 459.971 0.869 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc(C)c(C)[nH]c3=O)C[C@@H]21 1787506904 UFSOIWKETSOJOO-UHFARAQSSA-N 483.529 0.114 50 20 JCGD COc1ccnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)c1OC 1787508879 ZDQYAKABGROMGP-BRZMCFHBSA-N 498.540 0.826 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc2scnc2c1 1788398145 VPLATLXFOBHJQZ-QRFRQXIXSA-N 465.340 0.883 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(F)n3)[C@H]2C1 1788867803 XZWFTHZDLNAJRL-XGBLWMCESA-N 456.478 0.948 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3CCN(C)CC3)C[C@@H]21 1790962874 FIOCQGCWSDMKII-ATIWLJMLSA-N 459.429 0.776 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](N)c3cccc(Cl)c3)C[C@@H]21 1791289028 CMWLPLROPMVQHO-DBSRCYSRSA-N 465.982 0.693 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCN(C(=O)OC(C)(C)C)C3)C[C@@H]21 1791291546 YUWIWQLWMZZVEG-XWSJACJDSA-N 495.621 0.596 50 20 JCGD CC(C)C(=O)Nc1nc(O)c2ncn(CC(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)c2n1 1793113041 YVWGZFBLJVSOLW-CRWXNKLISA-N 493.952 0.364 50 20 JCGD CC[C@H](Cl)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cn1cnc2c1c(=O)n(C)c(=O)n2C 1794252510 AZGOQXUTMBRGPQ-CRWXNKLISA-N 450.927 0.089 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1C[C@@H]1c1ccc(F)cc1)C2)c1cccc(B(O)O)c1 1795737759 QFIWQGQLXXEATP-PNBTUHDLSA-N 452.291 0.512 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(F)c(F)ccc3c1)C2)c1cccc(B(O)O)c1 1795741184 MMFXSWHVDAHREK-UPHUGPLXSA-N 481.264 0.710 50 20 JCGD CC(C)(C)OC(=O)N1CCOC[C@H]1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796191080 WUSFZZLUDXEMDG-YRPNKDGESA-N 487.362 0.254 50 20 JCGD COC(=O)C[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796368030 BDGKKPIWOGIYFM-BUONHZGMSA-N 465.906 0.567 50 20 JCGD COc1cccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)n1 1796440855 CBNFVJFHGUUZIM-DHMDNZFNSA-N 454.487 0.427 50 20 JCGD CC1(C)Cc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)c2O1 1797750460 GGVHBLHQCGUTNX-CWPLJXCYSA-N 479.537 0.916 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc(Cl)n1 1797751560 GROMQVIDYZCVPH-IVWMJMPLSA-N 474.905 0.259 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)Cn1nccn1)C2)NC(=O)NCc1ccccc1 1799869242 FCGKWSBMHZOPDL-REPLKXPHSA-N 454.535 0.263 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2c(Cl)cccc12 1799902522 UBQNRPLMFDRTRH-IVWMJMPLSA-N 462.938 0.793 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c(=O)cn1)C2 1800333444 UXOPYWFSKTWGEH-SDGGPSBXSA-N 455.421 0.858 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Cc1cccc(F)c1)NC(C)=O)C2 1800982290 BXDMIGFSQOPUDI-DLRXZHIHSA-N 469.941 0.716 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc3c(O)cccc13)C2 1801013118 VWZIURYMSAJJKS-USGNIVHTSA-N 455.515 0.517 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)COc1ccc(O)nn1 1801265786 VULFMFOQBGRXKV-NGYDUSEUSA-N 455.475 0.333 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)C2CCOCC2)[C@H]1c1cccnc1 1806703380 UOFOVHNMEHPRBU-FXAWDEMLSA-N 452.515 0.826 50 20 JCGD CN(C)c1cncc(C(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c1 1807363472 PFWJFHCVGIWWQY-WMZHIEFXSA-N 473.342 0.856 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(C)(C)C 1807364049 HKHDFMILXMUATK-CEMLEFRQSA-N 480.374 0.632 50 20 JCGD CC(C)c1nc(CC(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)no1 1807369277 DRZDILNTWKWUFB-XMSQKQJNSA-N 477.330 0.830 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2nc3ccc(F)cn3n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807372349 DNNKQRUOSDZOTL-UTKZUKDTSA-N 488.288 0.577 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)C#CC(=O)O)[C@@H]1c1cccnc1 1808416347 NKMAWJQHJYWEPS-ZGFVEPFRSA-N 450.455 0.309 50 20 JCGD CC(C)c1nc(CC(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)no1 1809968879 HAVHDCQFGWEUFC-UHFFFAOYSA-N 454.336 0.960 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CC[C@H](CNC(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1810350530 CKJAOMQZNIJUPN-JMVFIXPQSA-N 459.374 0.974 50 20 JCGD COCCOCCOCCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1812931575 LKTTXOVUOSCELR-XUZZJYLKSA-N 499.373 0.151 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCC3)[C@H]1c1cccnc1 1813072907 HXEWWKPCQQERKV-VGSWGCGISA-N 453.547 0.917 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1813419666 QUULGFRSYKHPRC-WZONZLPQSA-N 490.568 0.993 50 20 JCGD O=C(CCC(=O)N1CCCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815638797 UCBIZLCADKPGLQ-IBGZPJMESA-N 467.335 0.798 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cccn4c(O)nnc34)sc2C1)c1cccc(B(O)O)c1 1816964648 RUAFYKXUKWGSTB-ZDUSSCGKSA-N 478.299 0.111 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822411026 XATTYIGXSORHFL-AWEZNQCLSA-N 454.553 0.681 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)c3cnc4c(c3)CCNCC4)sc2C1 1824642929 AMZZXFKLUIVCFN-MRXNPFEDSA-N 485.614 0.825 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](COC(C)=O)OC(C)=O)CC2 1826000587 WZMADWPLEARVLG-SGMGOOAPSA-N 461.924 0.804 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)C[C@@](C)(O)CC(=O)O)sc2C1 1826077625 LSZQKGJBRRZOLA-JEOXALJRSA-N 455.537 0.044 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051727 AZMPWJFDEGNDFJ-UZLBHIALSA-N 458.368 0.307 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)[C@H](O)N2CCOCC2)CC1 1827680193 FTQBDZKBYYNWTH-KRXPAMOESA-N 488.589 0.391 50 20 JCGD O=C1OCCN1CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1828386231 VZTSXGNRPXEFBJ-FQEVSTJZSA-N 457.336 0.442 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)CNC(=N)N)CCN2C(=O)OCc2ccccc2)C1 1828974949 QXKXYBXBIVWUAC-HTAPYJJXSA-N 494.980 0.175 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1 1829114594 JTJCCBNLTZSPDZ-YOGNZGIYSA-N 488.589 0.891 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCNC(=O)c3ccc[nH]3)C2)C1 1830535404 NSYHMNWNOOMEOF-FOIQADDNSA-N 485.379 0.622 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830735668 LKGQVMNHSYYBMO-APWZRJJASA-N 457.867 0.279 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1F)CCO2 1832126773 MGHSGAIXKDLMOV-KUDFPVQQSA-N 465.434 0.948 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1cccnc1Cl)CCO2 1832723598 MYGYJLNPDZBJEH-NRFANRHFSA-N 467.954 0.107 50 20 JCGD CC(C)c1nc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)co1 1833347489 VSFFSFDMPIVCFZ-QFIPXVFZSA-N 472.502 0.180 50 20 JCGD COc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1 1833734117 UKZXUVXUWHCOAC-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD O=C(CCNC(=O)c1ccc[nH]1)NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1833798382 XQDBCKZVHMSIEJ-SFHVURJKSA-N 453.971 0.306 50 20 JCGD Cc1c(F)ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1N 1834775511 KLZBEIMNWNQMEE-UHFFFAOYSA-N 482.365 0.895 50 20 JCGD CCc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1834799990 MAHMUMZMBJJZSY-UHFFFAOYSA-N 464.375 0.823 50 20 JCGD CCOCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1834986388 YEEJYFYEDYAYGC-OAQYLSRUSA-N 465.459 0.627 50 20 JCGD COC(=O)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)[C@@H](O)CCl)CC3)CC2)cn1 1835165553 IWTQQLSWCLDDFZ-SFHVURJKSA-N 452.939 0.653 50 20 JCGD Cc1ccc(COCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1C 1835937176 QZMQXAIOIPYEQS-AREMUKBSSA-N 496.369 0.270 50 20 JCGD O=C(c1cc2n(n1)CCCC2)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836979694 VWJQWUCYAXOTGJ-YJBOKZPZSA-N 459.316 0.980 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccnn3)C2)C1 1838528369 TVHYJLXIMRTBNM-QFIPXVFZSA-N 485.453 0.694 50 20 JCGD N#Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1Cl 1838595840 FBEKQEVZVNTUDW-QHCPKHFHSA-N 483.717 0.275 50 20 JCGD O=C(c1nc2ccccn2n1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839199384 NSWNFBGVJGPWKD-DYVFJYSZSA-N 456.272 0.490 50 20 JCGD N#Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c(Cl)c1 1839423545 JKMNLXFULXBHHL-QHCPKHFHSA-N 483.717 0.275 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839620494 GWJMAMKBKUYLMP-IERDGZPVSA-N 498.422 0.820 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccnc3)C2)C1 1839963076 ZCYUNHREOQKESL-UZLBHIALSA-N 483.363 0.441 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)N3CCN(C)CC3)C2)C1 1839966178 WUPSKJUDUNBJPW-FUHIMQAGSA-N 475.428 0.252 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1840036361 JDGYWIBWAVONSF-IQUTYRLHSA-N 455.353 0.754 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(CN(C(=O)/C=C/c3ccc(O)cc3Cl)CCO2)C1 1840110292 DTQGXJCBIPFJMM-ILHLOOHCSA-N 494.976 0.888 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccccn4c3C)C2)C1 1840152505 KDXYCDUZZRGUGP-IIBYNOLFSA-N 450.923 0.967 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ncn(C)c3C(F)(F)F)C2)C1 1840152598 NAPPNZRGRNHGQN-SJCJKPOMSA-N 468.860 0.763 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)N3CSCSC3)C2)C1 1840153340 KXSAVWSHXGWDHI-VKJFTORMSA-N 468.041 0.740 50 20 JCGD Cc1scc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1C 1840183503 IBBQSUIGYABTLX-OAQYLSRUSA-N 452.577 0.808 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3(c4ccc(F)c(F)c4)CC3)C2)C1 1840185059 GWVGQUILROFCMM-HSZRJFAPSA-N 494.539 0.826 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4occc4c3O)C2)C1 1840185837 YPBVYVUWKVHNAM-HSZRJFAPSA-N 474.514 0.581 50 20 JCGD COc1cc(Cl)cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840741774 GYHBQQPPQXQVTG-HSZRJFAPSA-N 488.733 0.412 50 20 JCGD COc1cc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)cc(OC)c1C 1840755538 ZRXKEPBFCRUHML-KKSFZXQISA-N 456.923 0.682 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Cc1cccc(F)c1)NC(C)=O)CCO2 1840857137 KZVCXGLQFAGWTH-JTAQYXEDSA-N 499.967 0.583 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1840897751 UUZAFRFZCGPTNS-ZARSWLQMSA-N 453.879 0.664 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843012776 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COc1cccc(NC(=O)COc2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2)c1 9930930 DILLWJJCKSGKIC-OAHLLOKOSA-N 461.496 0.908 50 20 JCGD COc1ccc([C@]2(C)NC(=O)N(CC(=O)NNC(=O)c3nn(-c4ccccc4)cc3O)C2=O)cc1 13082416 HVWSASZKRPUBQV-QHCPKHFHSA-N 478.465 0.815 50 20 JCGD CSC[C@@H](C(=O)NNC(=O)C1CCN(c2ncccn2)CC1)N1C(=O)[C@H]2CCCC[C@H]2C1=O 728845079 FZBOKHMEZODGJI-BBWFWOEESA-N 474.587 0.747 50 20 JCGD COc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1OC 728889865 RVSCNQPSEFZULT-UHFFFAOYSA-N 492.558 0.226 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1 728945814 KTEHXPAGOZZSFS-UHFFFAOYSA-N 491.574 0.148 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)CNC(=O)c3ccco3)CC2)c1 751202406 SNMYBDREBJDBAC-UHFFFAOYSA-N 458.471 0.726 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1F 751211284 PSLSFXOMYYKLCS-UHFFFAOYSA-N 470.504 0.099 50 20 JCGD COc1ccccc1NC(=S)NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)cn1C 761660726 YDFHAFJIKDNIER-UHFFFAOYSA-N 453.546 0.686 50 20 JCGD C[C@H]1Cc2cc(C(=O)OCC(=O)NNC(=O)[C@@H]3COc4ccccc4O3)ccc2N1S(C)(=O)=O 806001649 PIRHICBXDRNJMN-DJJJIMSYSA-N 489.506 0.541 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NNC(=O)c1c(C)nc2ccccn12 807114257 MHKPRFHPPJDIGE-UHFFFAOYSA-N 458.504 0.533 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1 914868812 FLBCSWFPSSGVJX-OLZOCXBDSA-N 459.471 0.722 50 20 JCGD Cc1nnnn1[C@H](Cc1cccc(F)c1)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 916124848 XCZBSOSLGOYBBF-QGZVFWFLSA-N 450.434 0.613 50 20 JCGD CN1CC(=O)N(CCCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)C1=O 921232482 PTVDCXBWENIASB-UHFFFAOYSA-N 465.532 0.296 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1n[nH]c2c1CCCC2 1777876123 VGJJZGVHZMPRRR-HYBUGGRVSA-N 466.347 0.410 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CCl)C2)C1=NN(c2ccccc2)C(=O)C1 1778126670 IHOWYAYQTXXREJ-JBYIUTFZSA-N 462.934 0.893 50 20 JCGD COC(=O)C12CCC(C(=O)N3CC[C@@]4(CN(C(=O)c5cnccc5C(=O)NN)CCO4)C3)(CC1)CC2 1778303311 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Cc1cc(NC(=O)CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)no1 1782211931 HBBCIXFMYFMUSO-OPAMFIHVSA-N 478.550 0.199 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1782786595 ASDMDSJPIASKDI-CZUORRHYSA-N 461.244 0.277 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)CCO2 1783339135 OXWQALWAGKRUQM-KSMMKXTCSA-N 478.384 0.875 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)c3ccco3)[C@H]2C1)NC(=O)NCc1ccccc1 1783563084 LDNSLWNFBSSWOA-YDWJEQILSA-N 499.568 0.639 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)C1 1784097232 WODIYXDDZOOADH-XQLPTFJDSA-N 463.934 0.525 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cncc(N(C)C)c3)C[C@@H]21 1787506870 RQXYRDUZOBDEFA-BORRTEJMSA-N 481.557 0.875 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(OC(F)F)cc1 1790101518 STVLGFQHZNMOMP-VDGAXYAQSA-N 474.269 0.875 50 20 JCGD 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CC(=O)NCCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1812659654 VTTJGHHVFBXJAP-OBPKGMNYSA-N 467.530 0.748 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)no1 1819403398 JNPMQVWKPFBTFG-KRWDZBQOSA-N 495.500 0.441 50 20 JCGD CN1CCCn2nc(C(=O)Nc3cc([C@H]4CCCCN4C(=O)c4cccc(B(O)O)c4)[nH]n3)cc2C1 1821593814 XIYLBESQQYVEHD-OAQYLSRUSA-N 491.361 0.741 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2C(=O)C=CC2=O)CC1 1824773841 JVGPGAFBIZNYTC-GOSISDBHSA-N 461.563 0.294 50 20 JCGD C[C@](O)(C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1)C(F)(F)F 1824832186 WXCQHKIZMIPSMJ-PXNSSMCTSA-N 456.270 0.913 50 20 JCGD C[C@H](CN)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828550793 AZAUGISFNLZLSW-NRJQMVOHSA-N 466.966 0.633 50 20 JCGD C[C@@H](C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CCC(=O)NN(C)C)CC1)N1CCN(C)CC1 1830243071 XCHLMDIRMZDSRF-PZJWPPBQSA-N 464.655 0.615 50 20 JCGD O=C(c1cc(Cl)c2nncn2c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830730556 BFRXGYFDKTZRQW-KDOFPFPSSA-N 458.302 0.052 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccnc(OC)c3)CCO2)C1 1832600132 CWCUOSHWWIDRFZ-UTKZUKDTSA-N 455.939 0.733 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1 1832770405 YKJONSOUHIRORL-AEFFLSMTSA-N 460.300 0.780 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cccnc3S)CC2)CC1 1833081734 XYLHNFBYQHABFP-UHFFFAOYSA-N 462.620 0.929 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)N(C)C)CC2)CC1 1833142108 AYRVNTAMYGGPGT-AWEZNQCLSA-N 460.417 0.860 50 20 JCGD Cc1onc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1C 1833605600 MIYKVKCRHPESOO-UHFFFAOYSA-N 469.546 0.789 50 20 JCGD O=C(c1ccnc(C(F)(F)F)c1)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1833792324 SHQKSEIVOQJGCA-DYVFJYSZSA-N 451.829 0.770 50 20 JCGD CN(C)c1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc1 1834010696 APLYBUSFBXIATL-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD CC[C@H](NC)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1835912980 SBAREXDIALDDIV-AVRDEDQJSA-N 478.502 0.588 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccn(C(F)F)n1 1835951818 MUDCOLZQPNHUNW-UHFFFAOYSA-N 475.305 0.457 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cc(F)cc(F)c3)C2)C1 1837457523 IBKVYDHVECPZAZ-QHCPKHFHSA-N 489.479 0.276 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)OC(C)C)CCO2 1837597728 IWRQKOVRPHMWAK-ITSXBRTRSA-N 463.535 0.390 50 20 JCGD O=C(CCBr)N1CCC(OC2CCN(C(=O)[C@H](O)N3CCOCC3)CC2)CC1 1837653728 NFKCVYRTAGOZCM-IBGZPJMESA-N 462.385 0.421 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)[C@H]1SC(=N)NC1=O 1837711429 HQKJZSZTMCRCKA-ZBQZNYHESA-N 472.640 0.097 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(-c3cnco3)c1)CCO2 1839366141 SABJGQYRRIFYNR-DEOSSOPVSA-N 485.541 0.785 50 20 JCGD C[C@H](Cc1ccncc1)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839659503 MWHJRPGVLIOYSY-OSPHWJPCSA-N 482.541 0.029 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)CSC(=N)N)C2)C1 1839743552 YABJYAYSPXYWRI-JMDQKNPTSA-N 479.509 0.955 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4nncn4c3)C2)C1 1839965264 SAIRIYOVBSROIK-KXBFYZLASA-N 466.336 0.973 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn4c(F)cccc4n3)C2)C1 1840154722 DSYZVSZVLAIYGE-XOBRGWDASA-N 454.886 0.797 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CCCC12CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1842948028 QLRSMGIQAQMEQF-JKSUJKDBSA-N 451.365 0.789 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)CN(C)NC(=O)NCc1ccccc1 1847825039 JEJKHGYQMQWWOA-OALUTQOASA-N 458.563 0.449 50 20 JCGD NS(=O)(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cc1 25400487 GKIOWIZNJHUUKY-UHFFFAOYSA-N 488.547 0.887 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)c1cnc2c(c1)c(=O)n(C)c(=O)n2C 29385969 VQSWCJGHYUDQHD-SNVBAGLBSA-N 476.287 0.623 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccccc2)c1 106038334 WBRDDMIDLWVDDB-UHFFFAOYSA-N 454.530 0.019 50 20 JCGD C[C@H]1CN(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)CCO1 726256587 OKWZHXAPWXSLLQ-KRWDZBQOSA-N 475.571 0.830 50 20 JCGD O=C(COC(=O)[C@H]1CCCCN1C(=O)c1ccco1)NNC(=O)[C@@H]1COc2ccccc2O1 728331225 GHVIUSSPXDMEKJ-KDOFPFPSSA-N 457.439 0.805 50 20 JCGD CNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c1 728890167 YOLNZSVLRDXWAW-UHFFFAOYSA-N 452.924 0.716 50 20 JCGD COCCNS(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)COc2ccccc2O)c1 730781838 ARVUFASCNSBKFM-UHFFFAOYSA-N 457.892 0.810 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cc(N(C)C)ccn1)N(S(C)(=O)=O)CC2 749721103 UYKQGPDYBKWUDC-GOSISDBHSA-N 491.570 0.875 50 20 JCGD CC(C)(C)OC(=O)N1CCC(n2cc(C(=O)NNC(=O)CNC(=O)c3ccco3)nn2)CC1 751199388 NPUQFBNIEMJHAB-UHFFFAOYSA-N 461.479 0.634 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)CCN2C(=O)[C@@H]3CCCC[C@H]3C2=O)cc1OC 784375824 UHFHIJPJAPDZRY-HUUCEWRRSA-N 461.471 0.573 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCNS(=O)(=O)/C=C\c2ccccc2)c1 913466091 HFVNQSUHXFBZMY-OWBHPGMISA-N 480.568 0.678 50 20 JCGD CC(=NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(S(N)(=O)=O)cc1 916258680 IORNCHSPWKHPIB-UHFFFAOYSA-N 466.541 0.509 50 20 JCGD CN1CCN(C(=O)CCNC(=O)NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)CC1 916433343 KNBCNONFFKIVHV-UHFFFAOYSA-N 494.599 0.657 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)NCCOc2ccc3c(c2)OCO3)cc1 916647273 YLVWGOVDPFURDW-UHFFFAOYSA-N 464.500 0.754 50 20 JCGD C[C@H](CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)N1CCCCC1 918120382 LXSYUPGCSHNALM-GOSISDBHSA-N 481.619 0.845 50 20 JCGD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)c2)C1 919886514 UNYNQZBFITUCPR-FMKPAKJESA-N 472.589 0.484 50 20 JCGD Cc1cc(C)n2ncc(C(=O)N3CC[C@@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)c2n1 1777779553 INGHPPVEOVTEGA-JOCHJYFZSA-N 457.535 0.163 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@]3(C)CCN(C(=O)OC(C)(C)C)C3)C2)C1 1778182074 IMJMVDGIYAZJND-RPWUZVMVSA-N 495.621 0.836 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc2nonc2c1 1778522857 OGAURJVNXYZWKM-NFBKMPQASA-N 464.287 0.344 50 20 JCGD Cc1nccnc1C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779779871 NZQRVYLTLDDKES-XMMPIXPASA-N 481.557 0.575 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnc3c2OCO3)C1 1780024328 NXICSCGPQJFVKE-UZUQRXQVSA-N 482.497 0.250 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)s1 1780896844 AFJKNHOBLAMIRV-QFIPXVFZSA-N 487.538 0.219 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(O)cc1F 1780939835 NXHKSIWPLJPOAU-NFBKMPQASA-N 456.279 0.652 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nc1 1780962686 MCYOQBGGAAZIRE-DEOSSOPVSA-N 467.331 0.371 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cccc4ccncc34)C2)C1 1782251144 HTTYJDPBVHPZMK-DEOSSOPVSA-N 460.494 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3cccc4ccncc34)C2)C1 1782251146 HTTYJDPBVHPZMK-XMMPIXPASA-N 460.494 0.991 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1783684249 DOFQRCQARMKCPD-RIEVBORMSA-N 499.373 0.209 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1(CNC(=O)OC(C)(C)C)CC1)CCO2 1783932750 CYMSTHYVSWGEPI-QHCPKHFHSA-N 481.594 0.494 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(C#N)nc1C(F)(F)F)CCO2 1783933942 OKSRTKFRACVEBP-HXUWFJFHSA-N 482.463 0.789 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784086127 UVGDRNTWOMLDTC-YTFOTSKYSA-N 468.378 0.698 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cccc(C(=O)N(C)C)c3)C2)C1 1785285168 MZYRWSLVKRXCHK-HSZRJFAPSA-N 459.547 0.205 50 20 JCGD COc1ncccc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)[C@H]2C1 1787508890 OMGFVBBSUUPDSD-YKNBRYRPSA-N 468.514 0.818 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cccnc3Cl)C[C@@H]21 1788611522 JDCAQRLCMWZJFK-WBAXXEDZSA-N 472.933 0.570 50 20 JCGD COc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1789539145 NULOFWWPFHNXIP-YSSFQJQWSA-N 453.499 0.601 50 20 JCGD CS(=O)(=O)CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C(C#N)=C/c3ccc(F)cc3F)[C@H]2C1 1790693363 HTUKOEDIWJIDIH-MEFGBEIZSA-N 467.494 0.896 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21 1791071095 ITMKRCVUXVAPRI-UNPPPGBBSA-N 471.982 0.965 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3c(F)ccc(O)c3F)C[C@@H]21 1791293974 UWINDOBBDJFDEH-XEZPLFJOSA-N 454.474 0.637 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccccc4F)CC3)[C@H]2C1 1792192640 YVYUKELZQMNCHP-JLMWRMLUSA-N 466.318 0.831 50 20 JCGD CCn1c(-n2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)cc2C)cccc1=O 1792976286 BRUNKEQUCFUAKE-MQJTVSLUSA-N 477.949 0.165 50 20 JCGD CC[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CCc2nc(O)nc(O)c2C1 1794111268 KHQNMRXMBOGASZ-APLFDDQLSA-N 483.363 0.756 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)C1 1796190702 ZYAZXVXZRHEKDD-ACDBMABISA-N 471.363 0.875 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C3CC3)on1)C2 1796439841 GQZRTSFVRHYJFV-UYNJTKMTSA-N 454.487 0.889 50 20 JCGD Nc1n[nH]c(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](Br)Cc2ccccc2)C3)n1 1797628111 QFMCVRJFFOLSNC-YYAJDYIMSA-N 491.390 0.915 50 20 JCGD CC(C)(C)OC(=O)N1CC(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1797713821 ABGAJHVKHOJHDO-REPLKXPHSA-N 457.336 0.485 50 20 JCGD CC(C)(C)c1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cn1 1797750717 OCUOXBKJCUJLSA-HBCWATKFSA-N 467.530 0.290 50 20 JCGD Cc1cccc2c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)n[nH]c12 1797754097 UQYLZBSRQYQDSG-HBCWATKFSA-N 463.498 0.387 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nccnc1C(N)=O 1798357039 OVKRUSGCHVHOCO-INHOUBOVSA-N 482.447 0.664 50 20 JCGD C=CC[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)NC(=O)OC(C)(C)C 1801932046 LCTBCOOBBFNFOS-WYADAEROSA-N 495.621 0.809 50 20 JCGD CN1CCC(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CC1 1802568228 YOKDYRQHVXBUCI-WIYYLYMNSA-N 465.558 0.742 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CCC(=O)NN(C)C)C2 1804376284 KJBMZWHDWZZLHI-XMTFNYHQSA-N 463.579 0.914 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCN2CCCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362937 KRHISKFDJKRILB-ZJSXRUAMSA-N 464.375 0.957 50 20 JCGD Cc1cc(C)n(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)n1 1807369665 RKJCTKDZTDXBSW-REWPJTCUSA-N 461.331 0.595 50 20 JCGD CCOC(=O)/C=C/C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810299588 SMZXTNLCIIXKSS-OFGRBQKGSA-N 466.498 0.519 50 20 JCGD COCCn1ccc(C(=O)N2CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)n1 1810301655 BIFWSTNLUZMYGG-DYESRHJHSA-N 492.540 0.556 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)[C@@H]2[C@H]3COC[C@H]32)[C@@H]1c1cccnc1 1810309589 SEQNFKAHFYGDCN-JIKAWYKTSA-N 450.499 0.292 50 20 JCGD CCOC(=O)C1(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)CC1 1812466441 MJSDBGZVPCRULJ-APWZRJJASA-N 480.525 0.743 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@H]1CCN(C(=O)[C@H](C)N2CCN(C)CC2)[C@@H]1c1cccnc1 1813032323 GTDMFQDDUVMKJP-OJAHFUOMSA-N 451.999 0.977 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813074734 WLXOHBUIVPFMRI-CECAUBDESA-N 496.572 0.069 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813619591 FQRSXJCKPCVESA-ACIOBRDBSA-N 464.375 0.954 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)[C@H]1Cc3ccccc3CN1)CC2)c1ccc(B(O)O)cc1 1815340613 NEXLJQAHKPCEIU-UYAOXDASSA-N 476.367 0.763 50 20 JCGD COCCn1nccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815354582 JXBMIPDHKLKYQY-OAHLLOKOSA-N 469.332 0.205 50 20 JCGD COc1ccnc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1 1815360649 LFLOCRGPKDZPEI-AWEZNQCLSA-N 452.301 0.766 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc3c(c2)CNC3=O)[nH]n1)c1ccc(B(O)O)cc1 1817472047 DRZYBBGRVBTFLR-HXUWFJFHSA-N 473.298 0.953 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)C1 1819793066 JPDVSFSAKLDLPG-XQQFMLRXSA-N 486.554 0.957 50 20 JCGD Cc1cc(C(=O)NCC(=O)N[C@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)no1 1819798082 UFCMZZUMCFZCGR-NSHDSACASA-N 498.525 0.094 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819801214 GXISQSBCSDBVQR-NSHDSACASA-N 474.543 0.957 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)n1 1820090116 WLQAUSIMZRJBNX-MRXNPFEDSA-N 495.370 0.349 50 20 JCGD COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CN2CCN(C(C)=O)CC2)[nH]n1 1822371825 ZZDXPUFSFYGHFU-DOTOQJQBSA-N 454.959 0.820 50 20 JCGD CSCC[C@H](O)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1822433557 IIUQCPIPKHDCDU-HOTGVXAUSA-N 461.548 0.828 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1824634614 GVJDRBHFOHNDOD-NRFANRHFSA-N 457.380 0.762 50 20 JCGD O=C(c1nc[nH]n1)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829033996 PWCCIWFWXQQPQW-HRAATJIYSA-N 476.921 0.470 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2nccnc2C(N)=O)CC1 1831873435 KRALTWICEFTBPH-INIZCTEOSA-N 459.551 0.182 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccnnc3O)C2)C1 1832549543 UGGHPHQQIWHBQV-BTYIYWSLSA-N 499.952 0.384 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833397061 RNZUNVNSLFBSTR-HXUWFJFHSA-N 473.979 0.820 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(=O)oc3)CC2)CC1 1834340162 IOFJRJPUJYCSSD-UHFFFAOYSA-N 468.514 0.137 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)CN3CCCC3=O)CC2)CC1 1834626159 IOJVXEYECNNWHP-WPWMEQJKSA-N 485.589 0.314 50 20 JCGD COC(=O)CSCC(=O)N1CCOC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1834819790 UZTVTFGUGSVJCO-MRXNPFEDSA-N 453.355 0.134 50 20 JCGD CN(C)CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1834938149 JSUXKFLCEDFRDY-YWZLYKJASA-N 462.975 0.137 50 20 JCGD Cn1cc(F)cc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835247766 VGIDXZFZSTWOCG-UHFFFAOYSA-N 456.327 0.343 50 20 JCGD CC(=O)N1CCN(CC(=O)NC2CCN(C3CCN(C(=O)C(Cl)Cl)CC3)CC2)CC1 1835513005 HHWLSEBECBDHDC-UHFFFAOYSA-N 462.422 0.526 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(F)n3)CC2)CC1 1835737861 IXTRTLPBYXISCW-UHFFFAOYSA-N 469.521 0.718 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(F)CCCC=C3F)C2)C1 1835933991 KVQQLLSRQXWCOB-FCHUYYIVSA-N 464.274 0.182 50 20 JCGD Cc1nc2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)c3cccc(B(O)O)c3)CCO4)ccc2s1 1835937447 XHBDSQXBDDJWRT-DEOSSOPVSA-N 495.366 0.668 50 20 JCGD CN1CCN(C2(C(=O)N3CCC(OC4CCN(C(=O)[C@H](O)CCl)CC4)CC3)CC2)CC1 1836717783 JMTPHMJQXNCQQX-LJQANCHMSA-N 457.015 0.365 50 20 JCGD Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1C 1836771176 NCCXHWCZVNUGHN-UHFFFAOYSA-N 468.363 0.263 50 20 JCGD CC(C)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCNC4=O)CCO2)C1 1836776605 VVSWXUJPTDEEKK-OAQYLSRUSA-N 467.954 0.352 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncc4cnccc34)C2)C1 1837459912 OXWUWEJTPHNYEP-DEOSSOPVSA-N 491.508 0.012 50 20 JCGD C[C@H](Nc1cnccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837483703 XOOPHILDSFNDEL-DXCKQFNASA-N 460.304 0.424 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1OC 1838931841 KHPNBNFUQMSTMX-QHCPKHFHSA-N 478.546 0.147 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)s1 1839034091 OWJJUVZNNNKWHU-AUUYWEPGSA-N 460.936 0.133 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CCO2)C1 1839414915 HPTMQSKZTVWIBU-APWZRJJASA-N 457.867 0.624 50 20 JCGD C[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1)Oc1ccccc1 1839748114 XDDRESKTHOGDKE-CJAUYULYSA-N 497.552 0.613 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1CCc3ccccc3C1)CCO2 1839992325 FVLHDXPEHWDMPZ-FQRUVTKNSA-N 493.564 0.560 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCO[C@@]2(COCCN(C(=O)CCBr)C2)C1 1840141015 SLOOXXFYQXBJMJ-JXXFODFXSA-N 473.364 0.983 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncn(-c4ccccc4)n3)C2)C1 1840152925 YVFXCYHMFMYNKK-DYESRHJHSA-N 463.922 0.591 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COCCNC(=O)OC(C)(C)C)C2)C1 1840154982 LZIOIKQYWWLYEV-KKSFZXQISA-N 493.985 0.238 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3ccc(C)cc3)C2)C1 1840156837 VNEYLCARSTZPEH-XMSQKQJNSA-N 467.950 0.435 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3=NO[C@H](c4ccccc4)C3)C2)C1 1840184357 HXKAZMJLZPAPRD-RDPSFJRHSA-N 487.557 0.333 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)CCCC#C[Si](C)(C)C)C2)C1 1840186043 ZRWHPMICKOGSJB-HSZRJFAPSA-N 480.682 0.867 50 20 JCGD COc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)cc1Cl 1840732729 SRMZONNGYKWJGL-JOCHJYFZSA-N 482.965 0.792 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@]1(F)CCCC=C1F)CCO2 1840949904 ZNYKSQUSEBHSNH-FGZHOGPDSA-N 479.484 0.501 50 20 JCGD CN1C(=O)Cc2cc(S(=O)(=O)NNC(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)ccc21 12969278 QQCQPVWXZMBYSS-UHFFFAOYSA-N 478.552 0.613 50 20 JCGD COc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)ccc1OCC(N)=O 24153970 BBAJHQNNNYBDFC-UHFFFAOYSA-N 490.538 0.809 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1cccc(C#N)c1 728873175 UVYPCUHQMMLKMN-KRWDZBQOSA-N 464.525 0.101 50 20 JCGD CC[C@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1nn(CC)c(=O)c2ccccc12 729281499 DPDRPRWTPGRIPY-KRWDZBQOSA-N 461.486 0.466 50 20 JCGD Cn1nc(SCC(=O)NN=Cc2ccccc2I)c(=O)n(C)c1=O 730568813 COUWCBXRSKMULR-UHFFFAOYSA-N 459.269 0.326 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C/c1ccccc1)C(=O)NNC(=O)c1ccncc1 821887172 NHWYXZZPOVRYIQ-RKCSUWQLSA-N 466.541 0.236 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@@H]2C(=O)NNC(=O)COc2ccc(C#N)cc2)o1 915188317 AWHMHUSABVCYIT-MRXNPFEDSA-N 490.494 0.707 50 20 JCGD C[C@@H]1CN(C(C)(C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)C[C@@H](C)O1 916234727 PGKCIWOLVFBHAG-HUUCEWRRSA-N 455.581 0.769 50 20 JCGD CCOCCNC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 916374728 RIOPYHYEDYMTPJ-HNNXBMFYSA-N 458.537 0.320 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)Cn2nc(-c3ccccc3)ccc2=O)cc1 916745951 UOKTZARSLFYHER-UHFFFAOYSA-N 469.523 0.687 50 20 JCGD O=C(NNC(=O)c1ccc2c(=O)n(Cc3ccco3)c(S)nc2c1)N[C@H]1CCS(=O)(=O)C1 919888959 IQXNDGRZEIUTBU-LBPRGKRZSA-N 477.524 0.458 50 20 JCGD Cc1cc(C(=O)O)c(O)c(S(=O)(=O)NNC(=O)c2sc(N3CCOCC3)nc2C)c1 920757935 TZVJABFDQQTEEI-UHFFFAOYSA-N 456.502 0.624 50 20 JCGD CCN1CCN(S(=O)(=O)c2ccc(Cl)c(C(=O)NNC(=O)NCCCOC)c2)CC1 920862431 CZZCSOGSVGXLEC-UHFFFAOYSA-N 461.972 0.647 50 20 JCGD COc1ccccc1CC(=O)NNC(=O)/C=C(\C)C(=O)NNC(=O)Cc1ccccc1OC 1263847263 BQSPOGSBYMEIQF-NTCAYCPXSA-N 454.483 0.730 50 20 JCGD O=C(NNC(=O)C1CCN(C(=O)CCOc2ccccc2)CC1)N[C@H]1CCS(=O)(=O)C1 1318048822 KROXWAGZPHXXSF-INIZCTEOSA-N 452.533 0.212 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4ccccc4n3)CCO2)C1 1779030731 VVVYORWKBWGJFI-QHCPKHFHSA-N 461.482 0.386 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cnc4ccoc4c3)CCO2)C1 1779030811 XQZLCHJDZPTHHI-JOCHJYFZSA-N 450.455 0.584 50 20 JCGD CN(C)C(=O)c1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1779035805 QAVZRMUKXSFHCT-DEOSSOPVSA-N 480.525 0.144 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1 1779235338 SAASOXNAEWPHBI-MSIOFZDNSA-N 497.556 0.251 50 20 JCGD N#Cc1c[nH]c(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)c3cnccc3C(=O)NN)C2)c1 1779372714 ZFXNMEGYABLKLK-XMSQKQJNSA-N 451.487 0.326 50 20 JCGD COc1ccsc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779917252 TZADHGPTLNHLEZ-XMSQKQJNSA-N 458.345 0.878 50 20 JCGD CN(CC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(C)COC1)C2)NC(=O)NCc1ccccc1 1780558727 HOLPPLCQTYPXRG-CJFMBICVSA-N 487.601 0.883 50 20 JCGD C[C@@H](Cc1ccco1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782593214 GMUNXEBFRKVVSP-XVWGUNQUSA-N 454.332 0.966 50 20 JCGD CN(C)[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccc(Cl)cc1 1782821771 MZKWMNQPJOAECI-QPPBQGQZSA-N 485.777 0.766 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)NC(=O)c1cnccn1)CCO2 1783534059 PBSRIVGBGMQOCG-LXIYXOSZSA-N 454.325 0.208 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783939219 BAXQCXKGVWYLLT-SBUREZEXSA-N 483.610 0.883 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783939374 DOORFUYLHOISQZ-GAJHUEQPSA-N 479.578 0.106 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c(C)c3F)[C@H]2C1 1785759421 OGLXVMNTVZTFMV-MIFGEAQISA-N 459.482 0.585 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc4[nH]ccc4s3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979702 MEJFCDIMTKJOBT-ZVZYQTTQSA-N 453.329 0.816 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ncccc3C(F)(F)F)C[C@@H]21)c1ccc(B(O)O)cc1 1786981112 SULPVLVCQHGNAC-ZVZYQTTQSA-N 477.248 0.687 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3=NO[C@@H](c4ccccc4)C3)[C@H]2C1 1788144537 QHTAWFMZPAUZBW-VHHKXPHXSA-N 492.536 0.796 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1)c1ccc(O)cc1 1788610395 YXPQKDUHKRLSHX-ACRWPFGISA-N 467.526 0.788 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790236698 FXYRPVXGYSXGPA-KNBMTAEXSA-N 485.277 0.629 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CNC(=O)O3)C[C@@H]21 1790694166 ZOFBPQGIKKKVBT-OKKJGQSOSA-N 460.437 0.960 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCO3)[C@H]2C1)NC(=O)NCc1ccccc1 1791034261 SBNNUBIOYFGEFI-TUFLPTIASA-N 473.574 0.491 50 20 JCGD COc1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)ccn1 1791287883 AHVHDLNRGPFCIN-FHWLQOOXSA-N 461.563 0.376 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cnc4ccccn34)C[C@@H]21 1791288033 OXNAFIFTHUETDD-WDSOQIARSA-N 456.547 0.230 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1cccc(Cl)n1 1794197212 MHGCTJDFKYKXJH-DBWKPXFBSA-N 458.906 0.179 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(-c3cnco3)c1)C2)c1ccc(B(O)O)cc1 1795736293 WTZZSLATKFSLAE-HATOLVCRSA-N 461.283 0.538 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)(F)F)cc1)C2)c1cccc(B(O)O)c1 1795739683 AEGKIBGKWXOVHT-HGKCTWBKSA-N 478.232 0.782 50 20 JCGD COc1ccc(OCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cc1 1796440288 PXTILEPCZQDGBB-UHHKBMQTSA-N 483.525 0.798 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CC[C@@H]3C)C2 1796441967 KLRMFWJPVNHZEV-RBMQSRLFSA-N 467.530 0.797 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(Br)ncc1F 1796622017 AJOKCAVGESQMKX-KSPBDQMDSA-N 486.342 0.559 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cn2ccsc2n1 1797482466 FVBQSHWRJMKGHV-LVTGYEAHSA-N 469.527 0.733 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)ccc21 1797503109 QXYKGQPTKJZAKF-MUJYYYPQSA-N 477.525 0.441 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797749817 VWWXQJBYWKAMCT-FVCICTRLSA-N 458.906 0.559 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc[n+]([O-])cc1 1798361835 NPOLGOFVGBINRY-CWPLJXCYSA-N 470.438 0.671 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1799039662 LXDKSNAWERZJNI-XEMDLRDOSA-N 474.363 0.328 50 20 JCGD Cc1cc(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CN(C)NC(=O)NCc2ccccc2)on1 1799094849 CNDJNZNILYJNHA-BBIADKPPSA-N 484.557 0.461 50 20 JCGD Cc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)cc1[N+](=O)[O-] 1799331529 NMAKIVKYRYXYRY-FAQVEIGNSA-N 461.519 0.408 50 20 JCGD O=C(/C=C/C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Br)NCc1ccco1 1799350421 ZRDJJPZGUJUUSK-WTPROCOBSA-N 458.284 0.732 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803585342 QYPCIPRNNAZXRD-SIXWZSSISA-N 488.570 0.080 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1cnnc(Cl)c1 1804723457 XMGLXHQQEJRMPH-OXQOHEQNSA-N 465.706 0.838 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)CCN2CCOCC2)[C@@H]1c1cccnc1 1806957717 YVTWGUIZXOEVTP-XXBNENTESA-N 460.579 0.183 50 20 JCGD CC(C)c1nc(CC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)no1 1807360605 CPDKNUGVQNWVKK-PGRDOPGGSA-N 477.330 0.830 50 20 JCGD COc1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)ccn1 1807375244 NOJNHLBIAAKEOC-KNQAVFIVSA-N 460.299 0.798 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@H]1c1cccnc1)[C@H](F)Br 1808660971 FNXMVONWRPCPGL-UBHSHLNASA-N 467.232 0.503 50 20 JCGD CCn1nc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1C 1811019600 HOLUMFLYOUGBJD-SIKLNZKXSA-N 461.331 0.920 50 20 JCGD O=C(CN(CCO)CCO)NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1 1812717754 WBIVGGWIODNRDL-XIRDDKMYSA-N 461.332 0.065 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1cccc(B(O)O)c1 1817476367 CJHSZAOLWMPFIP-INIZCTEOSA-N 452.236 0.946 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1 1818112749 JXPLYTGWGGWZCV-QCXKMSLLSA-N 453.463 0.412 50 20 JCGD CC(=O)O[C@@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2)C(C)C 1819486131 TXYYKMJQOKXNSD-YVEFUNNKSA-N 474.543 0.955 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2)N1C[C@H]2C[C@H]2C1 1819569810 MBBXKKAYPGWAQN-UTXMOHQDSA-N 454.361 0.389 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc3nn[nH]c3c1)CC2 1819800320 MZTDCRMGWJHMID-LLVKDONJSA-N 477.510 0.953 50 20 JCGD COC[C@H](Cl)C(=O)Nc1cc([C@H]2CCCCN2C(=O)Cn2cc(C)c(O)nc2=O)[nH]n1 1822376370 HIFUVLJDKXHCBJ-GXTWGEPZSA-N 452.899 0.927 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1823436415 CWRBUUAPWUODHI-IEBWSBKVSA-N 455.324 0.700 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1825397300 BEHIKPWZMAMZMA-FQEVSTJZSA-N 464.331 0.407 50 20 JCGD O=C(c1cnc2ncccn12)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059961 YOZFZVXALPLXMD-FQEVSTJZSA-N 461.331 0.956 50 20 JCGD CC[C@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828525564 SFMWMTGDYIFXET-KKSFZXQISA-N 453.923 0.767 50 20 JCGD COC(=O)NCC(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](O)CCl)C2)C1 1829381218 DOFUTDMHZOWRFM-VGOFRKELSA-N 496.948 0.394 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830733666 QQLSBZRUDSXLBJ-YCRPNKLZSA-N 462.971 0.801 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830734981 BPDIHJKOLVSNBI-OXGZWMJISA-N 469.872 0.928 50 20 JCGD O=C(c1ccc(N2CCCOC2=O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830736610 UYSNRJMEGRDADX-PGRDOPGGSA-N 481.933 0.703 50 20 JCGD C#CCO[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1831396282 DBRFYDFTMPHARS-QMHKHESXSA-N 489.481 0.628 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831873629 QPOJSOMMTIHAIE-WOJBJXKFSA-N 482.578 0.474 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1833449405 JKWZKCFKNZQHBS-CQSZACIVSA-N 481.457 0.671 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)CNC(=O)c3cccnc3)CC2)CC1 1833772933 OTUJTWXORNGHSJ-LJQANCHMSA-N 465.982 0.637 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccc4c(c3)OCO4)CC2)CC1)c1cccc(B(O)O)c1 1834800910 ALEPVQUAZFDNOP-UHFFFAOYSA-N 493.369 0.523 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)Cc3ccc(F)cn3)CC2)CC1 1835737101 WAHRYCGOSMINIY-UHFFFAOYSA-N 483.548 0.647 50 20 JCGD N[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccccn1 1837872974 CUPUSHPRIQQPQV-QFIPXVFZSA-N 466.347 0.074 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1838472662 WHXAOERMCNSSRN-FOIQADDNSA-N 496.362 0.575 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3nn[nH]c3C(F)(F)F)CCO2)C1 1838762220 FGLKCUFKRXTNQY-BONVTDFDSA-N 484.273 0.925 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(Cl)c1)CCO2 1838918035 FTHJWRIACGCZRX-QFIPXVFZSA-N 458.707 0.404 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(C#N)CCC3)C2)C1)NC(=O)NCc1ccccc1 1839054983 RARGZAAZIYUGFU-VWLOTQADSA-N 498.584 0.483 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@H](O)CN1)CCO2 1839080056 ZZLBPZHGBBIKNS-KIMVMUHBSA-N 476.480 0.051 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@](C)(Cl)CCl)CCO2 1839155511 VRWUPUAUJLPSSH-PMACEKPBSA-N 485.405 0.749 50 20 JCGD O=C([C@@H](F)Cl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1840037441 AGGVGDOYUAVUDI-IWMXFIMRSA-N 451.882 0.887 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c(C)cc(C(N)=O)cc3C)C2)C1 1840153538 SCZBMUYJCBNYQQ-JTSKRJEESA-N 467.950 0.726 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4cccc(F)c4)CC3)C2)C1 1840182882 WSPLNXFDRFZEMV-QHCPKHFHSA-N 476.549 0.687 50 20 JCGD Cn1c(=O)c(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)C(Cl)Cl)CCO3)nc2ccccc21 1840188626 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CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3cccc(S(=O)(=O)N(C)C)c3)cc2)CC1 728213018 AOKUWDYXTNUPRX-UHFFFAOYSA-N 481.600 0.630 50 20 JCGD C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C1 728262590 HAYPAUVHCNCGKW-GJZGRUSLSA-N 498.583 0.686 50 20 JCGD O=C(NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)C1CCN(c2ncccn2)CC1 728889848 RPHPBHNBHYIXIA-ZWKOTPCHSA-N 472.546 0.822 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2C[C@H](C)C[C@@H](C)C2)c1 729275704 QNFVTDBUAFGYGD-MCIONIFRSA-N 460.578 0.052 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC[C@H](C)N(C)C1CC1)N(S(C)(=O)=O)CC2 729617241 JTYXFXCDAQGWNS-KSSFIOAISA-N 497.618 0.766 50 20 JCGD CC(=O)N1CCN(c2ccc(C(=O)NNC(=O)COc3ccccc3O)cc2[N+](=O)[O-])CC1 730778375 HCWCJNZOHWVOON-UHFFFAOYSA-N 457.443 0.809 50 20 JCGD CS(=O)(=O)c1cccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)c1 903883755 YZTTVRCQCCGLEA-UHFFFAOYSA-N 487.581 0.498 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CC1CC1)c(=O)n2Cc1ccccc1 914756349 OUOKJLYAZZQEBT-UHFFFAOYSA-N 454.487 0.002 50 20 JCGD C[C@@H]1CCCN(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 916452463 LJSHABQSBMZSHN-MRXNPFEDSA-N 453.565 0.383 50 20 JCGD CNC(=O)COc1ccc(C(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)cc1OC 919690959 WVZMSMYQDMLBPM-UHFFFAOYSA-N 470.891 0.196 50 20 JCGD Cn1c(CC(=O)NNC(=O)c2cc(S(=O)(=O)N3CCSCC3)c[nH]2)nc2ccccc21 921019150 HSQKYNFXOMWZTD-UHFFFAOYSA-N 462.557 0.643 50 20 JCGD O=C(NNC(=O)c1cccc(CS(=O)(=O)c2ccccc2)c1)N[C@@H]1CCS(=O)(=O)C1 1318049161 NMNPDCFKDSDOFA-MRXNPFEDSA-N 451.526 0.792 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1c(C)noc1N)C2 1778091581 WBBUKHOQPXWJPH-APMZDYGOSA-N 471.518 0.827 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CN1CCCC1)C2 1778091874 WBKLBIQOGAUNTJ-RCBCJABQSA-N 458.563 0.730 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(Cl)cnc1O)CCO2 1779028830 KKMLQZXEMVKXOO-FQEVSTJZSA-N 460.878 0.196 50 20 JCGD COc1ccc([C@@H]2C[C@H]2C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1779029122 LMQVWAXZENPTOC-WZOHSFFVSA-N 479.537 0.941 50 20 JCGD C[C@H](Cn1cncn1)C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779222226 WWUCAEABGJCMOU-DVECYGJZSA-N 498.588 0.090 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](C)Br)C2 1779407676 PSNAYPVPZIGHPU-BGIGGGFGSA-N 477.352 0.779 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C3)n1 1779507636 JQWTVHSALNCDQG-HOYKHHGWSA-N 490.605 0.174 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(-n4ccnc4)ccn3)C2)C1 1780387086 QCRWMNUPWYDANF-QQNPRBCQSA-N 490.524 0.845 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)CCCn3c(O)nc4ccccc43)C2)C1 1780921311 KWFVYGSUJMXYNX-XMMPIXPASA-N 486.573 0.725 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@]34C[C@@H](CO3)N(C(=O)OC(C)(C)C)C4)C2)C1 1781063448 UKNWORIKLBCXSR-KFVVBQDRSA-N 487.981 0.849 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)N1CC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1 1785608009 NSDDNMZIIWVCBZ-YCRPNKLZSA-N 486.642 0.437 50 20 JCGD C[C@H]1CCc2c(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)c5cccc(B(O)O)c5)[C@H]4C3)n[nH]c21 1786983457 UFNBPFBHLDQWOR-BMIPRAEKSA-N 452.320 0.046 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc[nH]c4nccc3-4)[C@H]2C1 1787325214 CXOQGVFDGFBDCO-AGRHKRQWSA-N 463.498 0.420 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(C(F)(F)F)[nH]1 1788793384 YSKDXSZAEWLZHP-QRTARXTBSA-N 465.237 0.620 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1 1791056027 MBJKQLKJXMZBHC-QZXGQWDYSA-N 463.325 0.244 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)N1CCOCC1)C2 1794141959 GVSFDQNVASNDEY-ZHEXZJMTSA-N 474.986 0.407 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(C(N)=O)cc1)C2 1796446447 XLERSXWIGUYOLO-ALVKSGCDSA-N 466.498 0.123 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1occc1Br 1796544443 RBKGVAXVQMVTHO-YWVIFJGQSA-N 463.093 0.239 50 20 JCGD CCC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1CCN(S(C)(=O)=O)CC1 1797137121 RKVRASWQHZCVNZ-YYIAUSFCSA-N 450.001 0.655 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(F)(F)C(F)(F)C(=O)O)C2)[C@H](F)Br 1799344642 PHTMAHJTLDAAFC-YWIQKCBGSA-N 453.158 0.622 50 20 JCGD CC(=O)NCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1803716629 GZLMRPWJOJMRLM-PZJWPPBQSA-N 466.347 0.243 50 20 JCGD O=C(CCC(=O)N1CCCC1)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804152391 XOFAENLCYGTZSH-RDPSFJRHSA-N 478.358 0.484 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)C1 1804292646 NRTQGUTWHGTAIC-VBIBTDTNSA-N 471.363 0.922 50 20 JCGD COc1nccnc1C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1804971076 LNHMTAVGSOFDGE-PXNSSMCTSA-N 461.287 0.193 50 20 JCGD Cc1cc(CC(=O)N2CCCC3(CCN(C(=O)c4cnccc4C(=O)NN)CC3)C2)nn1C 1805714073 YHCHJAORHWQGER-UHFFFAOYSA-N 453.547 0.815 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2ccc(O)cn2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375636 UJWYKERLYBRQMU-FDDCHVKYSA-N 460.299 0.424 50 20 JCGD O=C1CCc2ccc(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@H]3c3cccnc3)nc2N1 1807938591 WIGJMFOOLLLIPW-XXBNENTESA-N 499.336 0.675 50 20 JCGD CC[C@H](NC(N)=O)C(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808418105 ZEPKZJHZFBDRQB-SRFIUDINSA-N 482.545 0.668 50 20 JCGD O=C1NCc2cc(C(=O)N3CCC4(CCCN(C(=O)c5ccc(B(O)O)cc5)C4)CC3)ccc21 1809972646 XRIUXHHSYMXKOP-UHFFFAOYSA-N 461.327 0.768 50 20 JCGD COc1ccc([C@@H](O)C(=O)N2CCC3(CCCN(C(=O)c4cccc(B(O)O)c4)C3)CC2)cc1 1809977918 MGBMBIUEQHAWOH-JOCHJYFZSA-N 466.343 0.953 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)CN2CCCC2)[C@@H]1c1cccnc1 1810294725 MYVUNRBFJCBMBV-DYESRHJHSA-N 451.531 0.496 50 20 JCGD CC(=O)N/C(C)=C/C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1812318211 FVXGJVVFQTWUAH-PHLAKWFUSA-N 450.304 0.121 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCc2cnn(C)c2)[C@@H]1c1cccnc1 1813070813 LAFFEVRERKLOEY-WMZHIEFXSA-N 455.563 0.827 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cn3cccnc3n2)[C@H]1c1cccnc1 1813071465 SQCDRDDKKZMURV-UTKZUKDTSA-N 464.530 0.817 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCc3nc[nH]c3C2)[C@H]1c1cccnc1 1813072347 ASDGWTGOGNLNEA-QSAZIKIQSA-N 467.574 0.989 50 20 JCGD COc1ccc(C(=O)N2CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1 1813072911 IAZVCPUBIDPYBT-IERDGZPVSA-N 455.519 0.573 50 20 JCGD COc1ncccc1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339617 KDTPCRZNVNKKGQ-AWEZNQCLSA-N 452.301 0.766 50 20 JCGD CC(C)N1CCC[C@H]1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347629 HPPAYWAXVUZUOP-WMZOPIPTSA-N 456.377 0.922 50 20 JCGD Cn1cccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1=O 1815350287 OHJRKTVYCOVQSV-AWEZNQCLSA-N 452.301 0.061 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCN1CCCC1)CC2 1819801283 HTUQDUNKHSOEMP-CYBMUJFWSA-N 457.560 0.853 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)[C@@H]1CC[C@H]2CCC(=O)N2C1 1820758274 HNNXTFCOWQZWSE-KPFFTGBYSA-N 479.346 0.796 50 20 JCGD CN1CCN(C2(C(=O)Nc3nc4c(s3)C[C@@H](NC(=O)CCC(=O)NN(C)C)CC4)CC2)CC1 1822721334 OOABHDMRKXBELY-HNNXBMFYSA-N 477.635 0.208 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)CCN2CCOCC2)CC1 1826751196 ZAFAHTBKQMLHOD-OAQYLSRUSA-N 472.590 0.641 50 20 JCGD O=C(Nc1cccnc1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827051800 FWHOATFDYHSFJV-NRFANRHFSA-N 464.331 0.633 50 20 JCGD CN(C)C(=O)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828550831 CWGANJSWQPRNRJ-VGSWGCGISA-N 480.949 0.126 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cccc([N+](=O)[O-])c3)CCO2)C1 1829627289 WOGVGZSOFPSWGD-PXNSSMCTSA-N 455.895 0.848 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccn(C)c3=O)C2)C1 1830536123 YMIGOOKEHWUIIE-IFXJQAMLSA-N 456.337 0.486 50 20 JCGD O=C(Cn1ccc2ccc([N+](=O)[O-])cc21)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830726172 OPBGMPXISCDPHU-RXVVDRJESA-N 480.905 0.606 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COCCOCCOCCOC)C2)C1 1831658532 WEEUPRDWRHEALP-SIKLNZKXSA-N 495.013 0.547 50 20 JCGD CCNC(=S)NCC(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831874103 AUVQOLBZDWGOFX-QGZVFWFLSA-N 454.641 0.463 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnc(C)c(C)c1)CCO2 1833297703 RWCAGIGUKVLONA-JZZXMACJSA-N 482.541 0.902 50 20 JCGD Cc1cncc(CCC(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1833815657 MXNNDMGZRNKSAC-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)Cc3ccc4c(c3)OCO4)CC2)CC1)c1ccc(B(O)O)cc1 1834797937 NPJWTHLAJNVHOF-UHFFFAOYSA-N 493.369 0.523 50 20 JCGD COC(=O)[C@H]1CC[C@@H](C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)C1 1834798173 ZIEZROMZVFHKOI-MOPGFXCFSA-N 485.390 0.141 50 20 JCGD Cc1ccn2ncc(C(=O)N3CCC(N4CCC(NC(=O)c5cccc(B(O)O)c5)CC4)CC3)c2c1 1834800217 YWYCXAJGBPXQNJ-UHFFFAOYSA-N 489.385 0.822 50 20 JCGD CN1CCCn2nc(C(=O)N3CCOC[C@]4(CN(C(=O)CCBr)CCO4)C3)cc2C1 1834825189 SPRBWPWHZAQMBB-FQEVSTJZSA-N 484.395 0.574 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]nnc4n3)CC2)CC1 1834973316 QJELZKGGYVMINH-IBGZPJMESA-N 485.376 0.234 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnn4ccncc34)CC2)CC1 1835406194 ISBGPIGXVIQFDP-UHFFFAOYSA-N 470.578 0.288 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)CCBr)CC2)CC1 1835643938 ICUPKYLMVICMIQ-QGZVFWFLSA-N 463.373 0.408 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738352 YUSOSBCBNBWCRO-GOSISDBHSA-N 466.970 0.124 50 20 JCGD CCOc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cnc2c1cnn2C 1836378263 UWRCLJLHARQHRQ-IIBYNOLFSA-N 481.937 0.037 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1n[nH]c3ccc(F)cc13)CCO2 1837042447 VLWVKZYWEVRIFN-HSZRJFAPSA-N 497.487 0.084 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3cc(C)on3)CCO2)C1 1837550355 ZYNHLEGDQPUFBJ-IFXJQAMLSA-N 487.351 0.343 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1837669423 URQPYCKNQSCNHO-KHYOSLBOSA-N 462.385 0.779 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCCNC4=O)CC2)CC1 1838302073 YAZSEIIFSPXSTN-KRWDZBQOSA-N 481.981 0.883 50 20 JCGD C[C@@H](Nc1cnccn1)C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1 1838399061 TUZPXYHRWPFSLI-QGZVFWFLSA-N 475.594 0.649 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(=O)nc4sccn34)CCO2)C1 1838414167 DGEXHUWIZSUQGW-DJJJIMSYSA-N 499.387 0.857 50 20 JCGD CCc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1838990199 QDNGMTWSFOKCSI-XMMPIXPASA-N 452.316 0.313 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3nc4ccccc4n(C)c3=O)C2)C1 1840032890 MTTLBFVXCJPALB-SZNDQCEHSA-N 493.358 0.787 50 20 JCGD CCc1cnc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)s1 1840185345 LRTDDRAWTLBEKF-FQEVSTJZSA-N 453.565 0.149 50 20 JCGD Cc1ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c(F)c1 1840185834 YEHBBSROSNIUCV-JOCHJYFZSA-N 450.511 0.577 50 20 JCGD C[S@@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1841230555 ABLIEVJPUQGIGC-YNMHVIMOSA-N 466.000 0.451 50 20 JCGD CC(C)N(CC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)C(=O)OC(C)(C)C 1843009797 KCIWHHIFCVKJFA-UHFFFAOYSA-N 459.352 0.829 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1)c1ccccc1F 1843011946 MGLZRLWMVTZXEM-HSZRJFAPSA-N 467.306 0.374 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1)c1ccccc1 1843012994 XPHAWOGXFWZLKE-LJQANCHMSA-N 451.288 0.281 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H](NC(=O)OC(C)(C)C)C2CC2)C1 1843360776 MMZVIYYZABPRRB-SFHVURJKSA-N 451.568 0.866 50 20 JCGD Cc1cc(C(N)=O)cc(C)c1C(=O)N1CCCC12CN(C(=O)c1cnccc1C(=O)NN)C2 1844255256 HITIWHQNAIQOPT-UHFFFAOYSA-N 450.499 0.532 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)c1ccccc1F 1844264853 PUDNOJXRLRYXEZ-HSZRJFAPSA-N 482.516 0.693 50 20 JCGD C[C@@H](C(=O)N1CC2(CCCN2C(=O)CN(C)NC(=O)NCc2ccccc2)C1)N1C[C@H]2C[C@H]2C1 1845038917 IOBCVKQXDWRBBA-SESVDKBCSA-N 468.602 0.876 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CC4(CCCN4C(=O)CCC(=O)NN(C)C)C3)ccc12 1846384500 AAOGGEATVQGLIX-UHFFFAOYSA-N 470.530 0.701 50 20 JCGD CCn1nc(C(=O)NNC(=O)c2ccc(CCNS(C)(=O)=O)cc2)c2ccccc2c1=O 17190724 XYUCQUUPWDDYCR-UHFFFAOYSA-N 457.512 0.583 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)OCC(=O)NNC(=O)c3cccs3)CC2)cn1C 726199988 GYXVEZILJNYKPO-UHFFFAOYSA-N 469.545 0.195 50 20 JCGD COc1cc(OC)cc(C(=O)Nc2ccc(O)c(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2)c1 728203774 NQOXDDPZIQMEAB-GFCCVEGCSA-N 477.495 0.857 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC[C@H]2C(=O)NNC(=O)Cc2ccccn2)o1 729395837 IWMDLKNWGRTRDT-AWEZNQCLSA-N 450.473 0.395 50 20 JCGD O=C(CNC(=O)c1ccco1)NNC(=O)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1 729499547 STNXCNLJVWQXAY-CQSZACIVSA-N 467.479 0.332 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)C1CCN(c2ccc3nnnn3n2)CC1 887337031 PFLJNEDREYFPKG-UHFFFAOYSA-N 475.307 0.725 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)c2ccc(=O)n(-c3ccc(F)cc3)n2)cc1 914846538 OVXUQQODHVDYLL-UHFFFAOYSA-N 473.486 0.762 50 20 JCGD CN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)cc2)CC1 916387758 GBVMTQUGDMBGFQ-UHFFFAOYSA-N 463.542 0.825 50 20 JCGD O=C(NNC(=O)c1ccnc(-n2ccnc2)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1 916734294 HIFKSGVFPLUFLY-UHFFFAOYSA-N 456.484 0.363 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cnns1)c(=O)n2Cc1ccccc1 917392569 JHRFUVBYDAJHFP-UHFFFAOYSA-N 482.526 0.377 50 20 JCGD COc1ccc(CC(=O)NCc2ccc(C(=O)NNC(=O)N[C@H]3CCS(=O)(=O)C3)cc2)cc1 919889241 WLSOWKIJPJBGKO-SFHVURJKSA-N 474.539 0.685 50 20 JCGD CC(=NNC(=O)N[C@@H]1CCS(=O)(=O)C1)c1ccc(S(=O)(=O)N2CCCC[C@@H]2C(=O)O)cc1 920385344 YCEGSUMIHPJHFK-NVXWUHKLSA-N 486.572 0.525 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)[C@@H]1COc2ccccc2O1 1317697941 BBEPTWNNDWSLHK-FQEVSTJZSA-N 475.523 0.628 50 20 JCGD Cc1c(N(C)S(=O)(=O)c2cccc(C(=O)N3CC[C@@H](B(O)O)C3)c2)c(=O)n(-c2ccccc2)n1C 1329670460 AVASJCNKMFXVTK-GOSISDBHSA-N 498.370 0.998 50 20 JCGD CCc1ccnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)c1 1777778050 CLDLKLYEWAMPOZ-ZJSXRUAMSA-N 451.332 0.765 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CC1(O)CCC1)C2 1778094970 PGOBZCKNQLSCPG-IINOVHIQSA-N 459.547 0.939 50 20 JCGD COC1(CC(=O)N2CC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)CN(C(=O)OC(C)(C)C)C1 1778136408 MQSIBVPCJSAXBG-QRWLVFNGSA-N 475.970 0.442 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3ON=C(c4ccccc4)O3)C2)C1 1778874332 LBROOLUQMKTJRZ-DWYQAMBJSA-N 494.508 0.685 50 20 JCGD Cc1cccc(/C=C/C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)n1 1779028668 HPKCDEBDGUINIX-AWUSRGSFSA-N 450.499 0.545 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)Cc3ccc(F)cc3F)CCO2)C1 1779034905 WVQUQAUCXAGDSM-JOCHJYFZSA-N 459.453 0.650 50 20 JCGD O=C(C[C@@H]1CNc2ccccc2O1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779302834 CTQSPYVIWRVZNI-ROSOWXQZSA-N 493.369 0.757 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cn(C)nc3C(F)(F)F)C2)C1 1779543743 LROXRBBJZJKSLE-SFHVURJKSA-N 460.457 0.255 50 20 JCGD C[C@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nccnc1C(N)=O)C2 1780714885 JLDUPKIGKQHGBF-ZUSMLRIVSA-N 458.346 0.939 50 20 JCGD CSCC[C@H](O)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968454 LUQSLFQJSZEWIR-CVDCTZTESA-N 493.630 0.277 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1781226058 UVMGXSBFZRDQBW-BKTGTZMESA-N 468.378 0.938 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)cc([N+](=O)[O-])c3)C2)C1 1781765091 AMLVSDUFPGBLAW-NRFANRHFSA-N 472.433 0.490 50 20 JCGD COC(=O)[C@@H]1CC[C@H](C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)C1 1782210540 YYCDWOMZQFKUKU-PMECCGAFSA-N 466.579 0.463 50 20 JCGD O=C(Cn1cccc([N+](=O)[O-])c1=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1782786597 ASDMDSJPIASKDI-XJKSGUPXSA-N 461.244 0.277 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1783103629 BSMKQPCLJAMLND-NTKDMRAZSA-N 489.378 0.409 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1783992464 VQHGHBYOKHLFRV-XQLPTFJDSA-N 478.384 0.637 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)C1 1784094958 WQPNQKPJCZIINM-GAMODTGLSA-N 471.982 0.823 50 20 JCGD O=C(CCc1cncc(C(F)(F)F)c1)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1784298586 KLKSKMGXUIXQEO-QFIPXVFZSA-N 491.275 0.857 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21)[C@H]1CCc2nc(O)nc(O)c2C1 1785330558 HYCVHZVHNVIZCG-YLHIVMMESA-N 487.326 0.663 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1C(=O)OCc1ccccc1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1785430203 QWADIAABCUZLNK-KEXUJGGDSA-N 495.960 0.188 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c([N+](=O)[O-])c1 1786984747 FHRZYBPJBZYJBK-XJABCFGWSA-N 497.313 0.119 50 20 JCGD COc1ccc(C)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786985019 KREOJLIKSFUMRV-HSQYWUDLSA-N 452.316 0.591 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@](C)(O)C(F)(F)F)C[C@@H]21 1787506555 GMHSYTDYCYBQQN-OARUALHXSA-N 473.452 0.413 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc4n(n3)CCCNC4=O)[C@H]2C1 1788256542 XTTOOHUQUBETHI-MPGHIAIKSA-N 463.611 0.461 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CSCC(=O)O)C[C@@H]21 1789221755 AVQUDLHHPTTZIP-OWQGQXMQSA-N 495.510 0.931 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)[C@@H]1CCc2ccccc2O1 1791225417 APVZOOYBJHPBMS-HMNCIZAVSA-N 464.327 0.354 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](Br)Cc1ccccc1)C2 1795637896 SNOAWZYLWWNQQU-FSNPWBFUSA-N 481.391 0.175 50 20 JCGD CCN(CC)[C@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1)c1ccccc1 1795741250 OMZFUFUVLZNVKY-DVKRWUGUSA-N 479.386 0.653 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@H]1CN(Cc2ccccc2)CCO1 1796191569 YJGLIXAWRXOLGB-UEQSERJNSA-N 477.370 0.519 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn3nc(N4CCOCC4)ccc13)C2)[C@H](F)Cl 1796363341 OWNLFVXEDCQYEP-VLWCASSMSA-N 466.901 0.304 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(F)cc3)CC1)C2 1797748458 CZUXKMUHYJNFOF-YVWYUNDQSA-N 467.501 0.759 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@](C)(Cl)CCl 1799277564 XZYYGXGPGBGBET-NCWRXXFHSA-N 458.346 0.421 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(C)nn1-c1cccc(=O)n1C)C2 1800975116 JFOFGGWHXSOODU-QOIOWGMHSA-N 477.949 0.336 50 20 JCGD O=C(COc1ccc(O)cc1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1802886159 BYJMPRSIMKECBH-NTKDMRAZSA-N 475.310 0.866 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1803139121 SXYIBVSTAVBTBH-BDXSIMOUSA-N 483.997 0.929 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]2c2cccnc2)n1 1803142767 ILRCYZKEFPTHFE-ZIFCJYIRSA-N 461.950 0.988 50 20 JCGD COCc1oncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807365626 YHOJNTRDQSJGMH-UTKZUKDTSA-N 464.287 0.529 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807374594 LKAIXZSJJBXAQL-XCRHUMRWSA-N 460.137 0.864 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807376456 ZSDXIAYAKLUWMM-NYDSKATKSA-N 474.326 0.944 50 20 JCGD CC(=O)N[C@H](C)C(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808416063 DBVLCHVJXGWRST-VTWCAIOSSA-N 467.530 0.746 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCC(N)=O)[C@@H]1c1cccnc1 1808416311 LURBEIVIQZFWLM-CUVSIRLISA-N 453.503 0.487 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H]2C[C@@H](O)C2)[C@@H]1c1cccnc1 1809505925 YWHRDSUBXIVCEY-YRNRYTTQSA-N 452.515 0.992 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810306141 URKKJDDKFNJSNS-SYNHAJSKSA-N 453.547 0.740 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](COC(C)=O)OC(C)=O)[C@H]1c1cccnc1 1810340667 KVPPZWPZFDAPJE-FCGDIQPGSA-N 469.922 0.836 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1810438090 ZLVSBKLWHJJQMV-IKICRFKJSA-N 460.922 0.296 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnn2c1OCCC2 1812117434 IWUBVYGMOURCBB-NQIIRXRSSA-N 475.314 0.374 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813415463 FACFGKXNGWQBNV-HYBUGGRVSA-N 475.358 0.674 50 20 JCGD Cn1c(C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cccc1=O 1815337974 YGNZNFCUYOVULL-AWEZNQCLSA-N 452.301 0.061 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1)c1cc(=O)n2[nH]nnc2n1 1817816246 AAMKKMWVQAUFCI-JOYOIKCWSA-N 468.247 0.532 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccn3c(O)nnc23)n[nH]1 1817966795 UDYVQTPKLZLMQM-INIZCTEOSA-N 490.484 0.776 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CCC(=O)NN(C)C)CC2 1820026805 UYJIOKBJRYPSGZ-QWHCGFSZSA-N 488.574 0.037 50 20 JCGD O=C(CN(CCO)CCO)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](F)Br)[nH]n1 1822026456 HRBZAMBZRYDRSV-IUODEOHRSA-N 450.309 0.379 50 20 JCGD CCOc1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)CCC(=O)NN(C)C)sc3C2)cn1 1826080528 PHSSYMWCFMCIFT-GFCCVEGCSA-N 461.548 0.931 50 20 JCGD O=C([C@@H]1C=CCN1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](O)CCl)C2)C1 1829039835 JRSNHLCENBQEBY-YDHSSHFGSA-N 476.961 0.566 50 20 JCGD C[C@H](Br)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](N)CN)C2)C1 1829330720 PEHLKTFZTONBLS-WJPUGNRLSA-N 496.406 0.508 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cc(=O)nc3cccnn23)CC1 1829620617 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Cc1ccc2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)sc2c1 1834568344 QUJQOQRRVLKLRD-XMMPIXPASA-N 495.366 0.668 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cncc4cnccc34)CC2)CC1)c1ccc(B(O)O)cc1 1834798396 PEIWJCBSECXYSY-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4ccccc34)CC2)CC1)c1cccc(B(O)O)c1 1834799907 CNLSXOZKUJBBMH-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cc1ccc(F)cc1)CCO2 1835052220 XVDYCFVFTFUUQI-QFIPXVFZSA-N 450.511 0.198 50 20 JCGD Cc1nnsc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835183026 RPZOREGSMVHAQM-UHFFFAOYSA-N 472.575 0.344 50 20 JCGD CC(C)N[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)C(C)C 1835736939 LIHFDXDJRBLVAF-JOCHJYFZSA-N 487.649 0.893 50 20 JCGD O=C(C#CC1(O)CCCCC1)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1835750426 ZYUXICQQAZAPPH-UHFFFAOYSA-N 481.402 0.250 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc(F)cn3)CC2)CC1 1837556151 KLDGJSMIFBDUNR-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)nc2nccn12 1837715740 GYCWWDRYISGKGP-OAQYLSRUSA-N 461.595 0.959 50 20 JCGD COC1(CC(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)CCC1 1837920986 OZYIHCWAVFVAPL-UHFFFAOYSA-N 458.364 0.938 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)n[nH]1 1838658538 SMWSTKIKSLIDIB-KKSFZXQISA-N 485.969 0.920 50 20 JCGD CCCc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)cc1 1839014672 DZGAGZQJSFMVEX-VWLOTQADSA-N 466.343 0.703 50 20 JCGD O=C([C@H](F)Br)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C2)C1 1839198293 BWTMVOJLPYWWDH-CFLQYTFWSA-N 490.370 0.924 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)c1 1839198408 ZLIQKCKXVFFEIH-PBHICJAKSA-N 494.339 0.246 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(F)c1Cl)CCO2 1839323583 VMUJAEBSORGRKS-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD CN(C)c1c(F)cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1F 1839468071 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Cc1ccc2nc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)sc2c1 1795737500 OQAKVLUOAKJSFD-CWPLJXCYSA-N 465.340 0.802 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1nc2ccc(C(F)(F)F)cn2n1 1795970968 VEEFIVWZVSJRCC-IVWMJMPLSA-N 497.478 0.324 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796189550 AZFKPDGIFKTLNM-REPLKXPHSA-N 459.352 0.923 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H]2C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)C1 1796190299 LVEMFFMKFASMFG-IYWMVGAKSA-N 483.374 0.875 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ncn(C)c1C(F)(F)F 1796603266 JDMJSUMVZVELNL-JXUYHFQDSA-N 495.462 0.776 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Cl)C3)C1 1797120785 HGGWPFKWVXERHC-ZTYXSZCMSA-N 463.934 0.728 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1nc(N)n[nH]1 1797624744 QJPVNDNWWCRWDQ-ZWUHOBOKSA-N 485.973 0.041 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3cccnc3n1)C2 1797751663 MQDCGXWDRAVIQK-CCWDJLKJSA-N 461.482 0.145 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797753766 FODMZFFFAIABND-RACNMONISA-N 469.517 0.906 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1799813695 UKTNRRPMRJBYGA-NKGKWGDASA-N 482.516 0.895 50 20 JCGD CN(CC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H]1CNC(=O)C1)C2)NC(=O)NCc1ccccc1 1799869485 QPNZGCJEOUYMBO-AKHDSKFASA-N 456.547 0.107 50 20 JCGD CC(C)C(=O)Nc1nc(O)c2ncn(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)c2n1 1800345186 JKPFIYSFYJVTIX-WJNVRWDZSA-N 497.915 0.250 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1801010562 GWMSPBWQCDOLOL-KRXQYRFLSA-N 490.001 0.081 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)ccc1F 1801712973 FBRQJDIKHPMXBD-HBCWATKFSA-N 457.462 0.350 50 20 JCGD CC(=O)Nc1ccccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1801777781 LSDCYPFNFMZPNS-FKWFMORESA-N 480.525 0.982 50 20 JCGD CNc1nsnc1C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1802481535 XCWMRLRWCZSWNU-KBXCAEBGSA-N 460.564 0.667 50 20 JCGD CN1CCC(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1802570789 ZFYVUCKAMSRRPZ-IFMALSPDSA-N 450.348 0.423 50 20 JCGD CN1CCC[C@H]1C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803940481 VEIXCWFHWYCOMM-VDGAXYAQSA-N 451.531 0.494 50 20 JCGD CC1CCN(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)CC1 1807367086 XEUJGQUYZTXSSH-XUZZJYLKSA-N 464.375 0.813 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)[C@H](F)Br)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374519 ZTMIYMKWIFCLGU-XIRDDKMYSA-N 464.100 0.772 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@H](CNC(=O)[C@@H]2C[C@H](O)CN2)[C@H]1c1cccnc1 1807704822 KYCSEZRKOHQRSF-JXYHXMIBSA-N 497.508 0.958 50 20 JCGD CNC(=O)CC(=O)N1CC[C@@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@H]1c1cccnc1 1808409543 NXXMQHAISBEUJC-IEAFUIEISA-N 453.503 0.358 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)[C@@H](F)Br 1808662135 WLGREJOQECTKLK-BHYGNILZSA-N 464.100 0.772 50 20 JCGD CCOC(CC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)OCC 1813204641 AGJPOHLHHWDMEZ-WMZHIEFXSA-N 469.347 0.870 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2ccc(C(N)=O)cc2)[C@H]1c1cccnc1 1813739782 SGMCWCMDMLGFCN-DENIHFKCSA-N 466.542 0.873 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815337992 YXSWYROCMCCNNW-HNNXBMFYSA-N 453.333 0.713 50 20 JCGD O=C(CN1CCS(=O)(=O)CC1)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1 1815671304 LUUTWSRRAZXXEA-AWEZNQCLSA-N 476.397 0.917 50 20 JCGD COc1nn(C)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1816310110 BYQUUUWYSDPJPM-QGZVFWFLSA-N 452.280 0.451 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CCN1C(=O)C=CC1=O)CC2 1817275988 KKAIRBHVPUHMKA-PKCARXMOSA-N 497.537 0.504 50 20 JCGD O=C(/C=C\C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)NC1CC1 1817471992 AQUQALFGEOKSFZ-LENZSSGSSA-N 451.292 0.230 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)C(C)(C)C 1817473836 BXPCXKWAARCNGS-QUCCMNQESA-N 469.351 0.946 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)c2ccccn2)[nH]n1 1819402101 NDGIDXZNYYHEAT-MJGOQNOKSA-N 463.502 0.809 50 20 JCGD COC(=O)CSCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822411027 XATTYIGXSORHFL-CQSZACIVSA-N 454.553 0.681 50 20 JCGD CN1CCC[C@@H](C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)C1 1822553020 ZCAHBXXIDHUERT-CHWSQXEVSA-N 457.560 0.709 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1 1823008083 QMDBCFHJSYETQU-ZKQGETEISA-N 453.290 0.810 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCC([C@@H]4CCCCN4C(=O)[C@@H](O)CCl)CC3)cc21 1824186485 NCDKCNNKLPPEET-WMZOPIPTSA-N 451.955 0.850 50 20 JCGD O=C(O)c1cnncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052050 NCHQSPQTJTYRMM-HXUWFJFHSA-N 466.303 0.402 50 20 JCGD O=C([C@@H]1C[C@H](O)CN1)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@H](F)Cl)C2)C1 1829206479 TYDONCIEOLQECM-ORGXJRBJSA-N 482.940 0.696 50 20 JCGD Cc1nc(Br)sc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830727652 ACUYNTIGQWJIFU-MEDUHNTESA-N 482.784 0.884 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)ccc1[N+](=O)[O-] 1830738497 QEKINSOUHJYGEZ-HNAYVOBHSA-N 457.867 0.273 50 20 JCGD Cc1ccc(S(=O)(=O)N[C@@H](C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)cc1 1830779137 NAZXJPOBKKSNGE-VPWXQRGCSA-N 491.969 0.653 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(O)ncn3)CCO2)C1 1831729280 NZFONDRCBHSDRK-BTYIYWSLSA-N 499.952 0.384 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3ccnc3)C2)C1 1832549099 FHDOOYWWGGDYCO-HRAATJIYSA-N 485.969 0.472 50 20 JCGD O=C(NCCC(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1)c1ccc[nH]1 1833308583 WDISQDBPCURFGJ-SFHVURJKSA-N 453.971 0.306 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cccs1)CCO2 1833934187 YSFBQILLAGCOKF-CPOKCXMASA-N 459.528 0.952 50 20 JCGD Cc1nc(N)sc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1834754394 SHTLRMIZLKTXJG-UHFFFAOYSA-N 471.392 0.213 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798283 CBOIJFXJONKZRZ-GOSISDBHSA-N 479.390 0.447 50 20 JCGD Cc1cnc2c(C(=O)NC3CCN(C4CCN(C(=O)c5cccc(B(O)O)c5)CC4)CC3)cnn2c1 1835562682 HPSBHXAZIPDSFL-UHFFFAOYSA-N 490.373 0.217 50 20 JCGD CC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738176 KSDXTICAJXMSJB-SFHVURJKSA-N 450.971 0.888 50 20 JCGD O=C(C/N=C/c1ccco1)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835778020 JVVLTGGUHSWUJX-WGOQTCKBSA-N 466.347 0.264 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)c3cc4c(s3)CCCC4)C2)C1 1835930641 RCPZCJRNJZNDMG-XMMPIXPASA-N 484.383 0.691 50 20 JCGD Cc1cc(C)cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)c1 1835930954 ATMZPICOOOIJNJ-XMMPIXPASA-N 452.316 0.367 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1836727794 ULBGXXJGQBONGF-IWMITWMQSA-N 493.960 0.392 50 20 JCGD CCc1[nH]nc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1F 1837344392 YUSRXHVYJBDUQB-UHFFFAOYSA-N 472.326 0.717 50 20 JCGD CC(C)(NCCC#N)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837868432 YURINYRCCLLLRF-UHFFFAOYSA-N 470.379 0.260 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)n1C 1838385232 FQGOJLXRRGRQBW-QHCPKHFHSA-N 470.530 0.024 50 20 JCGD Cc1cc(CC(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n[nH]1 1838394113 SVSJCGGUCJCXEO-UHFFFAOYSA-N 469.546 0.572 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4[nH]cnc(=O)c4c3C)CCO2)C1 1838468916 SEOUCVFCGIVXBW-IERDGZPVSA-N 465.938 0.809 50 20 JCGD CCOC(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2)OCC 1839202592 KNAAORIFWHMFGV-WBVHZDCISA-N 455.321 0.923 50 20 JCGD CC(=O)NCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839801999 JQFMRLUYXDWVOY-KNQAVFIVSA-N 496.402 0.975 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)N3C[C@H]4C[C@@H]4C3)C2)C1 1839965500 ZWNHMJIGEOAODT-NEHHDPPZSA-N 458.397 0.957 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839996014 LZVWPVGGCMRLPB-JOXKVKLASA-N 495.536 0.477 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1840033333 ARMUCXPHSKUCNC-VFNWGFHPSA-N 495.374 0.580 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1840033747 OVSRBAKVIORSCI-APPDUMDISA-N 457.281 0.028 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c(C)cc(C)nc34)C2)C1 1840152586 MVGCAHKYVPQPAC-LAUBAEHRSA-N 465.938 0.670 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)S)CCO2 1840162113 MLYCZFDBEDEFTO-RNODOKPDSA-N 467.500 0.908 50 20 JCGD CN(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1=COCC1)CCO2)NC(=O)NCc1ccccc1 1840562218 XBFBQWIBMCCZQG-XMMPIXPASA-N 487.557 0.093 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2OC[C@@H](C(=O)N3CC4(CCCN4C(=O)[C@@H](O)CCl)C3)[C@H]2C1 1841353664 JJDHNVIDVKVCRF-LVQVYYBASA-N 457.955 0.671 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)c1ccccc1 1844263221 GSKUCHUIUXTGSI-GOSISDBHSA-N 466.498 0.599 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCc1cn[nH]c1)C2)NC(=O)NCc1ccccc1 1845038618 ZSQGNKNAWMDWSD-UHFFFAOYSA-N 453.547 0.892 50 20 JCGD O=C(COc1ccc2scnc2c1)NCCC(=O)N1CCCC12CN(C(=O)[C@H](O)CCl)C2 1845828854 WLQNAVXMYLZZRC-MRXNPFEDSA-N 480.974 0.985 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]32)C1 1846155818 NXSRWNBXHQDSDZ-MNZLEMJZSA-N 463.579 0.676 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)c1 10791593 RLIQDWRTDMICDH-UHFFFAOYSA-N 450.429 0.463 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCc1c(C)nc2nc(N)nn2c1C 12702248 QVKCDBURXRMWRQ-UHFFFAOYSA-N 459.536 0.319 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCN2C(=O)COc3ccccc32)ccc1Cl 726153022 VZWBICBLVPMKKH-UHFFFAOYSA-N 452.876 0.564 50 20 JCGD O=C(NNC(=O)c1nccnc1C(=O)NCc1ccc(F)cc1)c1ccc(-n2cnnn2)cc1 726523132 JTNWTKUCEKLYFU-UHFFFAOYSA-N 461.417 0.596 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H]2CCCN(C(=O)OC)C2)c1 726717182 MVTGSYAXCDPLTQ-HNNXBMFYSA-N 455.537 0.892 50 20 JCGD Cc1ccc(C(=O)NNC(=O)COC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)cc1 727221825 AEKMSOSEBCNHJI-UHFFFAOYSA-N 477.275 0.205 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CN2C(=O)N[C@@]3(CCc4ccccc43)C2=O)n1 761119207 IKYVFJRCSSJEIP-OAQYLSRUSA-N 471.495 0.078 50 20 JCGD O=C(COC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NNC(=O)c1ccc([N+](=O)[O-])cc1 762944493 JBJDKKMDXBFXDY-UHFFFAOYSA-N 476.467 0.997 50 20 JCGD O=C(COC(=O)C1=NN(c2ccccc2)C(=O)CC1)NNC(=O)[C@@H]1COc2ccccc2O1 772840589 OPOGUMAXFZQKKS-SFHVURJKSA-N 452.423 0.700 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)[C@H]2CCCN(S(=O)(=O)c3c(C)noc3C)C2)cc1 825549126 KDHPPAISGJIOQL-HNNXBMFYSA-N 465.532 0.960 50 20 JCGD O=C(CNS(=O)(=O)c1cccc(Br)c1)NNC(=O)c1ccc(-n2cnnn2)cc1 913156167 YJIJCYHSKWVLLE-UHFFFAOYSA-N 480.304 0.164 50 20 JCGD Cc1nnnn1[C@H](Cc1ccc(F)cc1)C(=O)NNC(=O)c1csc(N2CCOCC2)n1 916136626 UIXOSYMKGRNSJI-MRXNPFEDSA-N 460.495 0.659 50 20 JCGD Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)cc1 916278534 SCOIOYSAYGSLDU-UHFFFAOYSA-N 483.572 0.168 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNS(=O)(=O)Cc2ccccc2)c1 916516958 QFWAMZJQMQKZEP-UHFFFAOYSA-N 483.572 0.001 50 20 JCGD C[C@H](CNC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cn1)CN1CCCCC1 918103443 CKWWOSZWLSYSCL-QGZVFWFLSA-N 453.613 0.766 50 20 JCGD O=C(NNC(=O)[C@@H]1CCCN(C(=O)c2ccccc2OC(F)F)C1)N[C@@H]1CCS(=O)(=O)C1 919887014 XHTFRBIBQIQMKL-CHWSQXEVSA-N 474.486 0.658 50 20 JCGD COc1cc(Br)c(S(=O)(=O)NNC(=O)N[C@@H]2CCS(=O)(=O)C2)cc1OC 919960911 LKDRZCSTHXUUJL-MRVPVSSYSA-N 472.339 0.146 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(N2CCCC2)ccn1 1778228310 UOZZDEJUHWOCAU-ZEQKJWHPSA-N 492.385 0.803 50 20 JCGD COc1ccc(F)c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1OC 1779037073 MKINDGIEDXFIKG-QHCPKHFHSA-N 487.488 0.599 50 20 JCGD CO/C=C(\C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968313 IMXKXQGEXMTWCK-ZGSOLVRCSA-N 459.547 0.713 50 20 JCGD O=C(OCCO)c1ccccc1C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](F)Br)C2)C1 1781334399 NHQCVNMAMBEYTH-HNAYVOBHSA-N 473.295 0.970 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1781900018 JPUAZUDOPHOVRD-SQGPQFPESA-N 467.169 0.667 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@@H](C[C@@H]2O)[C@H]1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1783580004 IFVAILBJUKYYGR-ZWBPQZFFSA-N 487.981 0.175 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4CCOCC4)cc3)C[C@@H]21)[C@@H](O)CCl 1784090796 NECAXWBVQRAIPS-LEAZDLGRSA-N 451.951 0.716 50 20 JCGD CN(C)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1785758288 SYLMNXKFNYJGNJ-DCPHZVHLSA-N 467.530 0.053 50 20 JCGD CSc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1O 1786984777 IGIGYNNLZIKOEF-SNRMKQJTSA-N 470.356 0.701 50 20 JCGD CC(C)[C@H](O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789725013 XGDVWUYYKAIKHY-XWUOBKMESA-N 475.590 0.329 50 20 JCGD CC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C[C@@H]21 1789866550 NKWDIKSACXQHIY-HNKHHVNMSA-N 454.980 0.889 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)Br)[C@H]2C1 1791064681 CQJONFUYROKGPE-UUAYOZFRSA-N 470.368 0.220 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C[C@@H]21 1791257472 ITACRKSDBVWGNB-FDPKGLCPSA-N 452.939 0.433 50 20 JCGD CC(=O)Nc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)cc1O 1791293705 CCWHUSMHYFTTGM-ZWOKBUDYSA-N 475.546 0.317 50 20 JCGD O=C(Cn1ccnn1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2 1795893088 DURMYQVZEQTKRI-ZMMAXQRCSA-N 462.348 0.874 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc2n(n1)CCC2 1797514136 PUPFUECERAPOFM-IHHIPJHASA-N 453.503 0.167 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1cnn(Cc2ccccc2)c1 1798149467 OSMXFECGYCMBML-IUTQVRIDSA-N 474.326 0.128 50 20 JCGD CN(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1ccccn1)C2)NC(=O)NCc1ccccc1 1799094718 GYMHOEMRFVBVAS-IRJINJETSA-N 480.569 0.560 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1cccc(O)c1 1800592355 MCXVTQRRYXRQLW-BZGPJFGBSA-N 451.483 0.307 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2c(c1)CCCO2 1801672968 OAIQYUDZHLVUTN-HATOLVCRSA-N 450.300 0.208 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1804555650 UBGBMEORFBPRHR-KNJMJIDISA-N 489.353 0.966 50 20 JCGD CN(C)c1cncc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1804849152 BVYZKJCKCGRCTP-AUSIDOKSSA-N 473.342 0.856 50 20 JCGD CN1CCC(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1807360187 OYAADBQQMWBUKG-QPPBQGQZSA-N 464.375 0.813 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccn3c(O)nnc23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807362617 MOMRZSPBQVNPAC-FXAWDEMLSA-N 486.297 0.143 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cnn2cccnc12 1809742629 ODJAFKNWLNYVHT-RXVVDRJESA-N 470.298 0.438 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1nc(O)n2c1CCCC2 1810591028 VCYASNNEUKWQTD-XMSQKQJNSA-N 489.341 0.633 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC2(CCCN(C(=O)c3cnn4ncccc34)C2)CC1 1810745464 DNKOPHYGTLUBEA-UHFFFAOYSA-N 462.514 0.886 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1812775467 HYKXOHNHXXQETF-IMBTUZDBSA-N 469.380 0.912 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1812811039 UCMUDVPQKDOWKB-RXVVDRJESA-N 482.346 0.606 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)[C@H](CO)NC(=O)OC(C)(C)C)n[nH]1 1817974215 HWSGLEXLPKBIEL-JKSUJKDBSA-N 495.581 0.660 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1820204787 LFUUVAACWKFLKU-BBRMVZONSA-N 465.344 0.944 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(S(C)(=O)=O)cn1)CC2 1826080337 BSJGUPRXUMQAKF-LBPRGKRZSA-N 494.599 0.540 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=N/O[C@H]1CCCCO1)CC2 1826088068 QXBNQEGKDCRJIZ-KGOMVVCDSA-N 466.564 0.957 50 20 JCGD COCCn1ccc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)n1 1827059381 OGIUOAMYLKBWIA-JOCHJYFZSA-N 468.363 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN2CCOCC2)CC1 1828925011 ATKFBFJDBDBCFJ-HXUWFJFHSA-N 458.563 0.251 50 20 JCGD CN(CC(=O)N1CCCC[C@@H]1C1CCN(C(=O)C(O)O)CC1)NC(=O)NCc1ccccc1 1830165093 LQTMBSPOFXFWHD-LJQANCHMSA-N 461.563 0.263 50 20 JCGD COc1nn(C)cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830535866 VMQAABBCMWLRTQ-FZKQIMNGSA-N 459.341 0.530 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ncccn4n3)C2)C1 1830539101 AZABNYBHCBJNJH-KUHUBIRLSA-N 466.336 0.830 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cnc[nH]3)CC2)CC1 1834166540 LPENJBPKYQIIEU-JFLMPSFJSA-N 454.535 0.729 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cn3ccccc3=O)CC2)CC1 1835118227 IZMFQZXRRYKLEP-MTDXEUNCSA-N 495.584 0.554 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccn2nccc2c1 1835629479 LJDISDAQHQQMNE-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD O=C(CCc1ccc(F)c(F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835925944 BWHHYGSBTVORPR-XMMPIXPASA-N 488.296 0.347 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3noc4ccccc34)CCO2)C1 1835981543 NQRKLMCXJYBFRL-XMMPIXPASA-N 494.508 0.139 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cc(F)ccc3[nH]1)CCO2 1836803766 WSVFBVMKLGSLEM-XMMPIXPASA-N 481.289 0.371 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)CNC4=O)CCO2)C1 1837153781 YDGNQGACPLGFEV-RNODOKPDSA-N 466.332 0.783 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1coc([Si](C)(C)C)c1)CCO2 1837425805 IJIZRQJPXNDYIC-JOCHJYFZSA-N 480.638 0.268 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Br)CC)C2)C1 1837679129 FJXCZYBYKHNDAE-VCBZYWHSSA-N 462.385 0.921 50 20 JCGD C[C@@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)n1ccccc1=O 1837715216 COGJVYXJVIMXBT-LAUBAEHRSA-N 451.596 0.717 50 20 JCGD O=C(CCCn1ccnc1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922219 YTEVOWUMLKBQCQ-UHFFFAOYSA-N 468.363 0.656 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCC4)CC2)CC1 1838341545 GCSMWWZYOOZSBN-UHFFFAOYSA-N 481.557 0.754 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)CNC(=O)C(F)(F)F)CC2)CC1 1838789747 YEZMZVDBFFXDER-UHFFFAOYSA-N 479.500 0.037 50 20 JCGD O=C(c1cnn2c1OCCC2)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839202897 SNMSMTGFIARZCI-GUYCJALGSA-N 461.288 0.426 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(F)(F)c1ccco1)CCO2 1839690149 VFNWWYUMRNZBTK-YNYZQSIGSA-N 493.467 0.962 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@@](C)(O)CC(=O)O)C2)C1 1839966723 ODOWUJHYZCJYDM-MORSLUCNSA-N 465.341 0.232 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 1840155605 BFVCCELWCVAUGE-OXJNMPFZSA-N 473.885 0.987 50 20 JCGD C[C@H](C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1)N1CSCSC1 1844264624 QSJVEAMMSHJXLJ-CYBMUJFWSA-N 450.590 0.545 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1847787442 IRZFZSUVGIUKLZ-AJNGGQMLSA-N 481.015 0.648 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)COc1ccccc1F 14843803 BZXZRGIUTOSBMD-INIZCTEOSA-N 487.531 0.134 50 20 JCGD Cc1ccccc1C(=O)NNC(=O)[C@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccccc1 15021652 DZPIPWJRXKNGGP-KRWDZBQOSA-N 453.542 0.538 50 20 JCGD COc1ccc(NC(=O)COc2ccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)cc2OC)cc1 15639478 JYERYFWOXMMOJG-OAHLLOKOSA-N 491.522 0.917 50 20 JCGD Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cc(-c2ccccc2)on1 28793451 RCQWXZNIGFGRSK-UHFFFAOYSA-N 459.484 0.776 50 20 JCGD Cn1nc(C(=O)NNC(=O)CCCOc2ccc(S(C)(=O)=O)cc2)c2ccccc2c1=O 116055866 JLCRPKBUCKIBPZ-UHFFFAOYSA-N 458.496 0.957 50 20 JCGD Cn1cccc1C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NS(=O)(=O)c1ccc(Cl)cc1 726540275 BYTFJDHZYHVWMT-CQSZACIVSA-N 476.964 0.221 50 20 JCGD C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(S(=O)(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C1 728262591 HAYPAUVHCNCGKW-HUUCEWRRSA-N 498.583 0.686 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)CCc1ccncc1)c(=O)n2Cc1ccccc1 729310599 QWDZUUFTYFVYOK-UHFFFAOYSA-N 475.509 0.603 50 20 JCGD C[C@@H]([C@@H](C)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1)N1CCOCC1 729624190 TXIZFMIGXOGTHP-SJORKVTESA-N 467.592 0.914 50 20 JCGD CCOC(=O)c1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)COc3ccccc3O)CC2)o1 730780080 OGKPXKDHKCQKOP-UHFFFAOYSA-N 495.510 0.789 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)CN(C)C(C)C)N(S(C)(=O)=O)CC2 742787466 XZKPOFXXLYZRGU-MRXNPFEDSA-N 456.565 0.440 50 20 JCGD C[C@H](COCC(F)(F)F)NC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 743340785 BASZKWJIJXQVIL-GFCCVEGCSA-N 468.454 0.619 50 20 JCGD CCc1cccc(NC(=O)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 748463424 ZZZUNRPACBXRTI-UHFFFAOYSA-N 489.554 0.853 50 20 JCGD O=C(NNS(=O)(=O)c1cccc2c1OCCO2)c1ccc(S(=O)(=O)N2CCCC2)cc1 751262468 PIDNWOJRAMWTDC-UHFFFAOYSA-N 467.525 0.866 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2ccc3c(c2)C(=O)N(C[C@@H]2CCCO2)C3=O)n1 761139229 FHDCOAZTINUKNG-AWEZNQCLSA-N 486.506 0.773 50 20 JCGD COc1ccc(C(=O)NNC(=O)CNS(=O)(=O)c2ccc(OC)c(OC)c2)cc1OC 767930865 ZFUYMWRFSZPWIO-UHFFFAOYSA-N 453.473 0.461 50 20 JCGD O=C(NNC(=O)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12)c1ccc(-n2cnnn2)cc1 789065730 OCYNDNVAHYFFBM-UHFFFAOYSA-N 470.496 0.349 50 20 JCGD Cc1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1S(C)(=O)=O 916030205 QWUPWRWKLDBGGO-UHFFFAOYSA-N 481.552 0.494 50 20 JCGD Cc1cc(C)nc(SCc2ccc(C(=O)NNC(=O)CN3CCS(=O)(=O)CC3)cc2)n1 916100652 BOADPZABZXVJEL-UHFFFAOYSA-N 463.585 0.877 50 20 JCGD Cc1ccc(S(=O)(=O)NCCNC(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1 916277012 OMEZROHDIQDNDJ-UHFFFAOYSA-N 488.614 0.816 50 20 JCGD COCCn1cnc2c1c(=O)n(CC(=O)NNC(=O)NC[C@H]1C[C@@H]1C)c(=O)n2Cc1ccccc1 916640663 OXEQXTNHLMMOAH-DOTOQJQBSA-N 483.529 0.041 50 20 JCGD COCCCNC(=O)NNC(=O)c1cc(S(=O)(=O)NCCOC)ccc1Br 920862450 GTHRLIVEBIPASM-UHFFFAOYSA-N 467.342 0.354 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnn3ncccc13)C2 1778091340 XELYPOFTCTWHPB-BMIDIIHHSA-N 492.540 0.991 50 20 JCGD Cc1cc(C(=O)N2CC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c2cc(O)ccc2n1 1778425635 JJOWPSLDLOXJOW-VWLOTQADSA-N 475.310 0.686 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCO[C@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c2c1 1779032380 PECATMMWHDYRAP-DEOSSOPVSA-N 478.509 0.932 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc4c(c3)COC4)CCO2)C1 1779032708 WEQMZULVCKAJIA-HSZRJFAPSA-N 451.483 0.473 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H]1CCCS1(=O)=O)C2)[C@H](F)Br 1780776861 LTMUBAGGLTUTOU-NFFDBFGFSA-N 455.346 0.768 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)C(=O)c2cccn2C)C1 1782607966 LVFJHJXRUWWABX-CAAOGRNVSA-N 482.541 0.856 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)CCO2)C1 1783527757 FZXFPFNOSIGKAK-ODEMNLNRSA-N 482.375 0.779 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](C)Br)C2)C1 1783534060 PBSRIVGBGMQOCG-VBHSOAQHSA-N 454.325 0.208 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1783555182 LKUVDDSYNTTXRS-XYHYBEPMSA-N 499.373 0.209 50 20 JCGD C=C1C[C@@H](C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)N(C(=O)OC(C)(C)C)C1 1784089914 JIBDQOAGIOBKEQ-NBGIEHNGSA-N 499.373 0.376 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1785524205 JPKLZTHFTDDVHD-JOCHJYFZSA-N 471.250 0.100 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnoc3C3CC3)[C@H]2C1 1786290033 RAOPGTROPVHKQE-KKXDTOCCSA-N 454.487 0.458 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)CCCC4=O)C[C@@H]21)c1cccc(B(O)O)c1 1786982778 BBDNHBCNQIFLTC-APTRMMRNSA-N 476.338 0.793 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)C1=NO[C@@H](c2ccccc2)C1 1788142791 ORRCNTRZIOGXTK-MHADKKCISA-N 477.326 0.477 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3n[nH]c4ccc(F)cc34)[C@H]2C1 1788388936 LZFRQMCNDSZZRB-KHDYIWLOSA-N 481.488 0.608 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1788960983 BILJJKWBIZBHNO-QRTARXTBSA-N 480.252 0.026 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1[nH]cnc1-c1cccnc1 1789195829 PAIYCUWTPRNOLH-IHPCNDPISA-N 475.314 0.059 50 20 JCGD CC(=O)N[C@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]2C1 1789872244 FJHAXFNHIXJVOJ-RAPQVLNZSA-N 474.389 0.673 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](Cc3cnc[nH]3)NC(C)=O)C[C@@H]21 1790964059 RCQSEYBKFQYJQP-FUJDEKNSSA-N 484.395 0.610 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(=O)nc4cccnn34)C[C@@H]21 1791059410 ZSHGGNJJMQLDNQ-ABHRYQDASA-N 464.320 0.466 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](C)[C@H]1SC(=N)NC1=O)C2 1792868285 TVQRMYKUAXCUPB-HDLKOFKZSA-N 461.382 0.409 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)CBr 1792871285 UGSAABWFZSBVEG-IPVBOJNNSA-N 468.352 0.216 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCC(=O)NN(C)C)C3)C1 1792958705 QWHHLBMGGBQAFN-JUZZZCAGSA-N 466.579 0.319 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(F)ccc1Br)C2)c1ccc(B(O)O)cc1 1795732943 UAJQSBSMQVHCPI-HBCWATKFSA-N 491.122 0.785 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1noc3c1CCCC3)C2 1796440457 MKCHDDONCDHESA-DHMDNZFNSA-N 468.514 0.891 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](C)[C@H]1SC(=N)NC1=O 1796874786 KJENRRGJZRWTCQ-FQLXKURJSA-N 473.559 0.561 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)[C@H]1CN(Cc2ccccc2)CCO1 1797247040 PJTBPXVIPMJKIT-YHDCXSKOSA-N 451.951 0.077 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cn2cc(Br)ccc2n1 1797477108 BJGGOTJEDRISOF-VAECKANCSA-N 471.739 0.900 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3n(n1)CCCN(C)C3)C2 1800762635 WEQSBOAUUZLEIA-VWPFQQQWSA-N 454.369 0.705 50 20 JCGD COc1cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)ccc1[N+](=O)[O-] 1801838264 XTGKZZQTFPGXSP-HBCWATKFSA-N 484.469 0.119 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)CCN2CCOCC2)[C@@H]1c1cccnc1 1806953330 RDNBZFOXILBBDB-GCJKJVERSA-N 481.557 0.122 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCC3)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807365103 VTJPMGOZYNWZAX-AUSIDOKSSA-N 473.342 0.928 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370421 DGBRIJIDLMKNOJ-HRAATJIYSA-N 462.271 0.201 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cc(O)nc(O)c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807370423 DGBRIJIDLMKNOJ-IIBYNOLFSA-N 462.271 0.201 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccnc(Cl)n2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375465 PEIAOENLJKGSBU-LPHOPBHVSA-N 465.706 0.838 50 20 JCGD CN1CCC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)C1 1807540235 FGYBANLSKBPUJI-ONTIZHBOSA-N 450.348 0.423 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1cc(O)nc(O)c1 1807995507 ZLDFMSMIWNRKMM-KKSFZXQISA-N 462.271 0.201 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccc2nncn2c1 1809910590 JKGWODCFVNOKBB-GCJKJVERSA-N 470.298 0.438 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cnn3ncccc23)[C@@H]1c1cccnc1 1810301926 DXESXFWBAYRKFA-IIBYNOLFSA-N 485.508 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1 1810303087 PDOJWZKIVDDJQA-FOIQADDNSA-N 485.508 0.985 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CCCOC2)[C@@H]1c1cccnc1 1810308103 JBIUHQHFJZPLBX-SQGPQFPESA-N 452.515 0.826 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CN2CCSCC2)[C@@H]1c1cccnc1 1813069023 SCQQGRKNLRWLRH-PGRDOPGGSA-N 462.620 0.509 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cccnc2C(N)=O)[C@@H]1c1cccnc1 1813069837 CQAMUHYIKNFSFE-IIBYNOLFSA-N 467.530 0.268 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815347675 JYUFHZFAMQRSNH-NVXWUHKLSA-N 458.349 0.354 50 20 JCGD COc1ccc([C@H](O)C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cc1 1815347694 KZPWXLKMPOYXAD-JXFKEZNVSA-N 481.339 0.791 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1cccn(C(F)F)c1=O)CC2)c1cccc(B(O)O)c1 1815360206 BPCBFBNKODKLGB-CYBMUJFWSA-N 488.281 0.919 50 20 JCGD Cn1cc(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)cn1 1815431176 KHMATSXCLSRERN-MRXNPFEDSA-N 453.333 0.415 50 20 JCGD Cc1cc(NC(=O)CC(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cnccc2C(=O)NN)CC3)no1 1817239340 KDPWRCBPMZQZMS-NSHDSACASA-N 498.525 0.693 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cc(C(=O)O)ncn2)[nH]n1)c1ccc(B(O)O)cc1 1817470922 MWNICDLWTBFUAJ-KRWDZBQOSA-N 464.247 0.197 50 20 JCGD COCc1oncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1817798489 AIGRWYSILCDGNX-CYBMUJFWSA-N 456.289 0.497 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819401523 GFTQWSSNBGKIEU-BLLLJJGKSA-N 492.562 0.042 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(=O)oc1)CC2 1819794646 AEOZCNZKNUAGHV-NSHDSACASA-N 454.468 0.634 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819801727 RMKJGUPWRHYTSB-CHWSQXEVSA-N 468.543 0.900 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)c1cc(=O)n2[nH]nnc2n1 1823005396 YVGGKMPGNVJGMF-RRAGMBSWSA-N 471.272 0.185 50 20 JCGD O=C(c1cn2cccnc2n1)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827057355 CPBVPLKMIUJHON-NRFANRHFSA-N 461.331 0.956 50 20 JCGD CN(C)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551066 HEDDTUDPCWELGH-WMZHIEFXSA-N 480.993 0.990 50 20 JCGD COc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](C)CBr)CCO3)n(C)n1 1830535842 UOAPFRMFSDDPIR-FZKQIMNGSA-N 459.341 0.530 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1830543918 HQORXMNCSDBHIG-VWKPWSFCSA-N 497.390 0.687 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)n1ccnc1)CCO2 1830976926 KVRQKJWWVKOBQH-LQDRLVSNSA-N 471.518 0.035 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CNC(=O)C2)CC1 1831416086 ASKDIRCXVIVNAR-HQJNDZGUSA-N 456.547 0.876 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2n[nH]c3c2CS(=O)(=O)C3)CC1 1831871605 VMLAFHDLNBKQNQ-SFHVURJKSA-N 494.618 0.444 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)CCCC(F)(F)F)CCO2)C1 1832260518 KTKKDDCTFTYVSS-LJQANCHMSA-N 473.452 0.488 50 20 JCGD O=C(CCN1C(=O)c2ccccc2C1=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1832534697 KSUQCDGLWVGXRF-DYESRHJHSA-N 467.881 0.664 50 20 JCGD CN1CCC[C@H]1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832549057 DBAICYUETYHFNA-HOIFWPIMSA-N 489.013 0.669 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)[C@H]1CNc2ccccc21 1834728431 LUJSFGOALYWHKP-QHCPKHFHSA-N 476.386 0.761 50 20 JCGD Cc1cccc(CC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834798064 PRVFAHHIALEUQQ-UHFFFAOYSA-N 464.375 0.498 50 20 JCGD COc1ccccc1CC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834799322 WFXGPRGLPWDJKE-UHFFFAOYSA-N 479.386 0.803 50 20 JCGD COc1ccc2oc(C(=O)N3CCOC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2c1 1835930516 LDTUDMCLOTUTRA-VWLOTQADSA-N 494.309 0.505 50 20 JCGD CCSc1cccnc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931003 BXWYJWPPXQEOBZ-QHCPKHFHSA-N 485.371 0.257 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cnc(Cl)s1 1835991372 QHMFHZUJMNOKNJ-UHFFFAOYSA-N 476.795 0.975 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3ccnn3)CCO2)C1 1836212473 MFNZQGZGOQMTPC-CQTHNFAISA-N 472.452 0.620 50 20 JCGD CCc1c(Br)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)nn1C 1836276440 OOESMSSXWLLWGY-ACJLOTCBSA-N 493.786 0.415 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836681137 SVHOEPQBVRWSNP-DLBZAZTESA-N 477.986 0.470 50 20 JCGD O=C1CN(CC(=O)N2CCC(OC3CCN(C(=O)CCBr)CC3)CC2)C(=O)N1 1837073776 CDTPZCGMYYMEDH-UHFFFAOYSA-N 459.341 0.322 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)Cn3cc([N+](=O)[O-])cn3)CC2)CC1 1837136032 XKNCNWFGEPGZHK-UHFFFAOYSA-N 479.538 0.163 50 20 JCGD COc1cc(C)ccc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1837460362 DFVIYVCVJRJOTI-XMMPIXPASA-N 483.525 0.386 50 20 JCGD Cc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)c(O)n1 1837919201 QCLDGMKJQLDOQW-UHFFFAOYSA-N 467.331 0.701 50 20 JCGD O=C(CCN1CCCC1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920990 PPLDZKRWRVEQMR-UHFFFAOYSA-N 457.380 0.465 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1c(F)cccc1Cl)CCO2 1838871288 OERTUPGHRYKERB-OAQYLSRUSA-N 470.929 0.922 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1839144988 PXSMARSUTMDZBP-AOMKIAJQSA-N 464.950 0.964 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCOC[C@@]2(CN(C(=O)[C@H](F)Br)CCO2)C1 1839198655 MJNWHLGTBZQDQB-SUMWQHHRSA-N 452.321 0.296 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)[S@](=O)c1ccccc1)CCO2 1839673873 DQTGTGDJKQDNGG-TZVAFLSISA-N 472.991 0.893 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2 1840114070 UQYGTBGGVQTRQM-RUZDIDTESA-N 478.354 0.558 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2CN(C(=O)OC(C)(C)C)CCO2)C1 1841428807 OZHBBFPQGSKBLR-INIZCTEOSA-N 467.567 0.199 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@](F)(C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014819 FGWFRFBDQMNPQL-XMMPIXPASA-N 489.353 0.923 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CCCC34CN(C(=O)CCC(=O)NN(C)C)C4)ccc12 1843125224 DLFGLKGZLBONMN-UHFFFAOYSA-N 470.530 0.701 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N1CCCC12CN(C(=O)C(F)F)C2 1843428943 YZITXSVISVDLSD-INIZCTEOSA-N 481.305 0.271 50 20 JCGD COc1cccc(N2C[C@@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3ccc(B(O)O)cc3)CC2=O)c1 1847213358 HZFYTCYERSQYPM-HSQYWUDLSA-N 477.326 0.244 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(Cl)c(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1 15639378 VFWLRNBJSPNDRO-LLVKDONJSA-N 451.954 0.566 50 20 JCGD CCn1nc(C(=O)NNC(=O)CCNS(=O)(=O)c2ccc(F)c(F)c2)c2ccccc2c1=O 17190911 RIFFAMOAYUKQCK-UHFFFAOYSA-N 479.465 0.824 50 20 JCGD Cc1cc(C)c(C)c(S(=O)(=O)N2CCC(C(=O)NNC(=O)C(=O)NC3CC3)CC2)c1C 17806008 VMRZKXPAHOKEOF-UHFFFAOYSA-N 450.561 0.747 50 20 JCGD C#CCNS(=O)(=O)c1ccc(C(=O)NNC(=O)c2nn(CCC)c(=O)c3ccccc23)cc1 26070041 YDQSJMQVJMFPBZ-UHFFFAOYSA-N 467.507 0.793 50 20 JCGD CCOc1ccccc1C(=O)NCC(=O)NNc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1 728213827 RKZMWLHGHFPXLP-UHFFFAOYSA-N 475.571 0.895 50 20 JCGD O=C(CS(=O)(=O)Nc1ccc(N2CCCCC2)cc1)NNC(=O)[C@H]1CCS(=O)(=O)C1 743844942 BPQBXQWHVICPSO-AWEZNQCLSA-N 458.562 0.001 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)[C@H]3Cc4ccccc4O3)CC2)cc1 748271765 GDEAGVLYMVJDHV-HXUWFJFHSA-N 458.540 0.452 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc2nc(O)cc(C(=O)NNC(=O)CN3CCCC3=O)c2c1 789857155 QEYPQPGOZDRFTI-UHFFFAOYSA-N 463.516 0.354 50 20 JCGD O=C(COC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1)NNC(=O)[C@H]1COc2ccccc2O1 793940259 FBBUYUQZCUONBB-QFBILLFUSA-N 453.451 0.566 50 20 JCGD Cc1ccc(NS(=O)(=O)c2cccc(C(=O)NNC(=O)CC[C@@H]3NC(=O)NC3=O)c2)c(C)c1 913168354 UNKITSGFKNRPPY-KRWDZBQOSA-N 473.511 0.853 50 20 JCGD Cc1c(/C=C(\C#N)C(=O)N2CCN(S(=O)(=O)N3C[C@H](C)O[C@H](C)C3)CC2)cc(C#N)n1C 914762798 XPAJGGIOYOCKOS-MDGUFXLVSA-N 460.560 0.610 50 20 JCGD COCCN(CCOC)S(=O)(=O)c1ccc(C(=O)NNC(=O)C2=S=C3CCCC3=C2)cc1 916122765 UWDISHQGGMHGLU-UHFFFAOYSA-N 481.596 0.933 50 20 JCGD CCC(=O)N1CCC[C@H](C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)C1 917542090 ZKTXNHLWKFBRSV-SFHVURJKSA-N 480.587 0.436 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)c2ccc3c(c2)S(=O)(=O)N(C[C@H]2CCCO2)C3=O)cc1 918781120 JGAHTVVZMFRDDB-QGZVFWFLSA-N 488.522 0.892 50 20 JCGD COc1ccc(C(=O)NNC(=O)COC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1OC 919128393 FOPWJWMCRQFORB-INIZCTEOSA-N 462.503 0.936 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)NCCc2cccs2)cc1)N[C@@H]1CCS(=O)(=O)C1 919884717 HKJBOKZCSSFXAH-CQSZACIVSA-N 486.597 0.400 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc4ncoc4c3)C2)C1 1778005005 KCFUAOSVKWZQOQ-JOCHJYFZSA-N 450.455 0.584 50 20 JCGD CO/C=C(\C)C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1778843319 CBVPHFSCCIFSCJ-KEWFZMHCSA-N 459.547 0.713 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)C3=NO[C@H](c4ccccc4)C3)CCO2)C1 1779032276 MLADUZUBYAIDFB-RDPSFJRHSA-N 478.509 0.646 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc([N+](=O)[O-])c3c1OCO3)CCO2 1779032673 QQCFQKGNGIZZGT-QFIPXVFZSA-N 498.452 0.079 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=C/c1cnc[nH]1)C2 1779375362 LOCAUZMPTUZOMN-SRIRNZLBSA-N 453.503 0.249 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc([N+](=O)[O-])cc1F 1780878829 CDOPDBITCAIGAS-NFBKMPQASA-N 485.277 0.855 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccccc1F 1781413952 JPFDWRXJWFKDSF-UIFIKXQLSA-N 455.914 0.607 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)CNC(=O)OC(C)(C)C)C2 1782172108 PCRUZPMZDIARQG-YJPQMCDFSA-N 477.986 0.640 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCNC(=O)OC(C)(C)C)C2 1782214068 LSLSDXHMEJMFAX-UZUQRXQVSA-N 483.610 0.788 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)/C=N/O[C@H]1CCCCO1)C2 1782214165 GYIPJHWVIKCLKJ-MLVQSYCXSA-N 467.567 0.402 50 20 JCGD Cc1cc2nnc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)CCC(=O)NN(C)C)C3)c(C)n2n1 1782215110 SYMORIBJVRZMIW-UZUQRXQVSA-N 486.577 0.242 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc([N+](=O)[O-])o3)[C@H]2C1 1783360455 AURRJHPQDLSSME-PJODQICGSA-N 458.431 0.093 50 20 JCGD C[C@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1783536597 LGFOPLBQUCQDKF-LIRRHRJNSA-N 454.369 0.946 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4ccccc4[C@@H]3O)[C@H]2C1 1784151037 CZBILTOABVTHTA-HNJSTEPSSA-N 493.564 0.574 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C[C@@H]3COc4ccccc4O3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978801 XIMQTMUNLXKDIA-USKVXJDGSA-N 480.326 0.190 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(C#N)nc3C(F)(F)F)[C@H]2C1 1787198113 NFIKRKNMSRNXQW-JQFCIGGWSA-N 496.490 0.938 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1 1787451351 KCXPMOZVNMREDP-LXFSFDBISA-N 479.933 0.957 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4ncnn4c3)C[C@@H]21 1787508223 ALPWKNKCALFKNO-MIRJYFFBSA-N 478.513 0.457 50 20 JCGD Cc1ccc(COCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)cc1C 1787531366 QPPCJLNUHITEAD-XWGVYQGASA-N 480.370 0.793 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1788779695 GGWZHSWQUHUGAT-PDWMJMLSSA-N 467.530 0.174 50 20 JCGD Cc1cn(CC(=O)NC2(c3ccc(NC(=O)c4cnccc4C(=O)NN)cc3)CCC2)c(=O)nc1O 1789523712 OWFYJWCFKLMTBN-UHFFFAOYSA-N 491.508 0.704 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc(N2CCOCC2)c1 1790120073 CXMBUJDDTWVOGZ-OYDLWJJNSA-N 493.369 0.110 50 20 JCGD C[S@](=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](O)CCl)C2 1792892426 OBGOCTKHOXPEAX-IXQBYZJESA-N 480.027 0.886 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1)[C@@H]1Cc2[nH]nc(C(F)(F)F)c2C1 1796193199 TXRJTFDOBWACGP-HNKHHVNMSA-N 476.264 0.775 50 20 JCGD C[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1COCCN1C(=O)OC(C)(C)C 1796336307 HOSDLVHFBAWJRB-RBGFHDKUSA-N 490.395 0.995 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnc(O)nc1O)NC(=O)NCc1ccccc1 1796788330 GUVIEQYMWOGXLY-BJWYYQGGSA-N 483.529 0.486 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnc(C(F)F)c1)C2 1797749671 JIUADSSGOCIVBJ-FVCICTRLSA-N 460.441 0.535 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)n1 1797908724 GHFHASJBSSESLE-NEBZKDRISA-N 459.316 0.567 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccn(C)c1=O)C2 1798522731 RWMDEPOECBDBEB-YVWYUNDQSA-N 484.465 0.736 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2O[C@H](C[C@@H]2C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)C1 1799151030 FZSYKVUEZJWCSZ-LSIGDULCSA-N 487.981 0.200 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cn1cccc([N+](=O)[O-])c1=O 1800285193 XYTYXYSRCVRJQZ-OQMKEHIESA-N 471.308 0.520 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(O)O)C2 1800334115 JQUZBQJYTHLYMD-HSUGLBASSA-N 450.289 0.256 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](F)Br)C3)C1 1802236199 LUUMLBOHNYJOPM-XLWJZTARSA-N 494.358 0.902 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1 1805028146 DHYCSDSOFLAHGP-FOIQADDNSA-N 494.487 0.809 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1807360955 DUTARWQDPFOWOV-GCJKJVERSA-N 488.309 0.576 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2CCCCC2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361452 ANYYGVNODVPLJU-REWPJTCUSA-N 450.348 0.567 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccccc2-n2nccn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807367142 QKQLGSZXGUAKMS-YKSBVNFPSA-N 496.336 0.976 50 20 JCGD CN1CCC[C@H](C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)C1 1807540699 JKNMEKZLKPOUPI-JAXLGGSGSA-N 450.348 0.423 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H](CNC(=O)[C@H](C)NC=O)[C@H]1c1cccnc1 1808362298 WVDRWLMLHUQOCG-MCEOFGCISA-N 453.503 0.356 50 20 JCGD C[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C1(O)CCC1 1810294274 JBWMFROHFYRJKS-SYNHAJSKSA-N 466.542 0.951 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810307547 DPZDZRUQPZTSAF-WZONZLPQSA-N 490.568 0.993 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1CCN(C(=O)[C@H](O)N2CCOCC2)[C@@H]1c1cccnc1 1810546130 OQEFFBYUISTADY-SXLOBPIMSA-N 450.612 0.590 50 20 JCGD O=C(CCBr)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339921 UTLUSDNFTMORHS-GFCCVEGCSA-N 452.139 0.834 50 20 JCGD O=C(Nc1nc2c(s1)C[C@H](NC(=O)c1ncn(-c3ccccc3)n1)CC2)c1ccc(B(O)O)cc1 1815340018 BGXHROQTZNJOKG-MRXNPFEDSA-N 488.338 0.943 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@@H](N)Cc2cccnc2)[nH]n1 1819403127 VMIGAYFKYYTVIB-PKOBYXMFSA-N 477.529 0.679 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)C3=NNC(=O)C3)sc2C1)NC(=O)NCc1ccccc1 1819670375 QAMGIESRVQCDFH-CQSZACIVSA-N 498.569 0.277 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2ccc(B(O)O)cc2)CC3)n1 1820089630 OTQJEIRNCNDXSB-MRXNPFEDSA-N 495.370 0.349 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1)[C@H](F)Br 1820937823 VJRGMHFVBXQJTA-WFASDCNBSA-N 450.309 0.379 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)sc2C1 1822627417 GCFPGVVZYWWWJM-MJBXVCDLSA-N 497.581 0.768 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)Cc2ccc3ncnn3c2)CC1 1830156723 GHYAQZPTGUGUTN-QFIPXVFZSA-N 475.358 0.885 50 20 JCGD COc1ccc(/C=C/C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(OC)c1OC 1830719696 HWWVJMZIWBSVTB-ADMRXCGISA-N 498.960 0.782 50 20 JCGD COc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c(F)c1 1830732376 WSNXHTXZSXCFNL-WIYYLYMNSA-N 458.914 0.823 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830737270 CSMKKLGGORWIBF-OSAWLIQMSA-N 493.960 0.390 50 20 JCGD CCCNC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1 1831202148 NSRVTOAEAKFRMI-OALUTQOASA-N 452.379 0.986 50 20 JCGD COC[C@@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1831629768 MDRBTIMOMIUCQB-DVECYGJZSA-N 491.589 0.072 50 20 JCGD Cc1csc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1831777806 MVTWPPOWFPNZNI-OAQYLSRUSA-N 459.528 0.439 50 20 JCGD CN1CCN(C2(C(=O)N3CCC([C@@H]4CCCCN4C(=O)CCC(=O)NN(C)C)CC3)CC2)CC1 1831874691 UIWQBWTXQCEWRP-NRFANRHFSA-N 476.666 0.759 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cnco3)CC2)CC1 1833595406 ATUOGJYRQRLRBO-CVKSISIWSA-N 455.519 0.994 50 20 JCGD Cc1ccc2nc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)sc2c1 1834568220 MHWXPKMDYKZJKN-XMMPIXPASA-N 495.366 0.668 50 20 JCGD Cn1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)CCBr)CCO3)C2)c2c1CCC2 1834821175 AEXGKYOPEYOOTR-LJQANCHMSA-N 455.353 0.764 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)/C=C\C(=O)NC3CC3)CC2)CC1 1835117944 ZYSBHVSEHHZOAB-OBQJUOPDSA-N 497.600 0.527 50 20 JCGD Cc1cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)ccn1 1837456416 MPDSZOPJIHVXAJ-DEOSSOPVSA-N 482.541 0.091 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc4ccsc4[nH]3)C2)C1 1837459576 KTRZQEYUOHZAHC-QFIPXVFZSA-N 484.538 0.612 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(N4CCOCC4)n3)C2)C1 1837713227 QALWLZMDQLOSTC-QHCPKHFHSA-N 492.649 0.840 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1837713276 SAECYZSVNGIAFX-JOCHJYFZSA-N 475.574 0.743 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCC4)CC2)CC1 1837919322 YHAPTTPYTYGXRN-UHFFFAOYSA-N 466.347 0.435 50 20 JCGD CSc1ncccc1C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1838287384 JULNCQMSJPBMBI-NRFANRHFSA-N 465.576 0.247 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](C)CC(N)=O)C2)C1 1838527475 VWKINFPFCKOOCY-PEBXRYMYSA-N 492.485 0.102 50 20 JCGD Cc1ccc(-n2ccnn2)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1 1839478017 XMJCMJLFAQQAMR-RXVVDRJESA-N 463.922 0.245 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c4c(nn3C)CCC4)C2)C1 1840035222 KDYSSMYDWVPFQF-YJYMSZOUSA-N 455.353 0.762 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(N4CCOCC4)n3)C2)C1 1840152820 VDXTUZHHLCLOPL-VGSWGCGISA-N 482.965 0.242 50 20 JCGD C[C@H](Sc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840182728 RDIAVRRFQVWLLY-MBSDFSHPSA-N 478.615 0.997 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840185125 LNOOFINGWBPJQV-CYFREDJKSA-N 460.575 0.695 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(CN(C(=O)C3=COCC3)CCO2)C1 1840561743 AOQGJOIYPQEUQM-QFIPXVFZSA-N 475.454 0.894 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)CCO2)C1 1840771533 CJNCKWGMVXXUJR-MBSDFSHPSA-N 491.928 0.440 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840881733 LJCFXPOMQVRCEQ-VCAMNPENSA-N 475.970 0.346 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC2(CCCN2C(=O)c2cccc(N3CCOCC3)n2)C1 1843527725 HPPMSAGGQBCNTB-UHFFFAOYSA-N 465.514 0.048 50 20 JCGD Cc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1C(=O)O 13348883 BDNUNHXAQOQYFL-UHFFFAOYSA-N 483.524 0.337 50 20 JCGD CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 26745844 YZUDUPBSDPNGQP-FQEVSTJZSA-N 476.555 0.918 50 20 JCGD CCCS(=O)(=O)N1CCCC[C@@H]1C(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 108789582 TZPWGRNJSIJFDP-CQSZACIVSA-N 459.594 0.643 50 20 JCGD Cc1csc(=O)n1CCC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 725897098 UZPQUHFRJRPBIA-UHFFFAOYSA-N 454.530 0.090 50 20 JCGD O=C(NNC(=O)[C@@H]1CCS(=O)(=O)C1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1 728385737 PDWUUAFQSUQZAN-KMGMULKOSA-N 455.558 0.281 50 20 JCGD C[C@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1ccc(Br)cc1Br 728509516 HDFPDKFYSCFQCO-LURJTMIESA-N 479.172 0.459 50 20 JCGD Cc1nc(S(=O)(=O)N2CCC(C(=O)NNC(=O)COc3ccccc3F)CC2)cn1C 747695853 OJVBPLSJHWRQIL-UHFFFAOYSA-N 453.496 0.495 50 20 JCGD Cc1cc(S(N)(=O)=O)sc1C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 751280342 HKRLWSLUFUGVKS-UHFFFAOYSA-N 486.597 0.953 50 20 JCGD COc1ccc(CC(=O)NNC(=O)CNc2ccc(C)cc2)cc1S(=O)(=O)N1CCOCC1 913431295 CACGOWKKVLCUJX-UHFFFAOYSA-N 476.555 0.827 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNS(=O)(=O)c2ccc(C)c(C)c2)cc1 913500118 UBCDGFFHOLOFBG-UHFFFAOYSA-N 482.584 0.358 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)CN(C)[C@@H]2CCS(=O)(=O)C2)c2ccccc2c1=O 914531822 GLHFFPMCEHNLHM-OAHLLOKOSA-N 463.560 0.467 50 20 JCGD O=C(CCOC[C@H]1CCCO1)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 915636556 VFWANRCISYMLLO-GOSISDBHSA-N 469.560 0.373 50 20 JCGD CN1CCC(NC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)CC1 915898669 OYDLISAXCQVTCR-UHFFFAOYSA-N 453.565 0.065 50 20 JCGD COc1ccccc1NCC(=O)NNC(=O)CNS(=O)(=O)c1ccc2c(c1)OCCCO2 916986735 KEIFIQDJTIROTM-UHFFFAOYSA-N 464.500 0.394 50 20 JCGD CCNC(=O)NNC(=O)C1CCN(S(=O)(=O)c2sc(C(=O)OC)c(C)c2C(=O)OC)CC1 920858737 QKVJZYJCACJSNK-UHFFFAOYSA-N 490.560 0.381 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(CCN(C(=O)CN3CCN(C)CC3)C2)C1 1778261776 KXKRLJBQFOVYDW-QHCPKHFHSA-N 489.529 0.211 50 20 JCGD Cc1cc2nc(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)[nH]c2cc1C 1778922811 XSLDEJDNEBLGRV-XMMPIXPASA-N 462.315 0.617 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccnc3c2OCO3)C1 1780025701 UPDVSUOCFDHMEX-OPAMFIHVSA-N 461.519 0.311 50 20 JCGD CC(=O)c1cc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n[nH]1 1780969916 NBMZDIHEEGUTQZ-DEOSSOPVSA-N 497.556 0.402 50 20 JCGD CN(CC(=O)N1CC[C@]2(CN(C(=O)Cc3cnc[nH]3)CCO2)C1)NC(=O)NCc1ccccc1 1780970080 RKISFEDNBVDFDK-HSZRJFAPSA-N 469.546 0.128 50 20 JCGD CC(=O)N[C@@](C)(C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1F 1781413398 SXFDGPXCTQSKBV-RPBOFIJWSA-N 497.332 0.001 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COc2ccc(O)nn2)C1 1781498135 DQMFXHQTOUYLRV-SNUQEOBHSA-N 457.325 0.858 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCN1C(=O)C=CC1=O)C2 1781901876 ZMVCGVQXKRZBEZ-STXHMFSFSA-N 470.364 0.989 50 20 JCGD C[C@@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCS1(=O)=O)C2 1782002472 QIQIDAWJNDKOLS-UMPJEAMMSA-N 451.383 0.861 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(Cl)c3nncn3c1)C2 1782214207 HLMCQHURCCQFAL-VGOFRKELSA-N 491.980 0.883 50 20 JCGD C[C@H](NC=O)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783021828 FYKOXQFQSBXJRV-RIFZZMRRSA-N 452.349 0.957 50 20 JCGD CCOC(=O)C(C)(C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1783230373 WMZHBNQNDYJUNX-WZONZLPQSA-N 460.336 0.083 50 20 JCGD C[C@@H](NC(=O)OCc1ccccc1)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1783508075 PYFJNHWLIUFMKT-KUDFPVQQSA-N 453.923 0.731 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)CCO2)C1 1783533545 ZNSTWKXZYJOMLP-XGKMFUNXSA-N 490.395 0.970 50 20 JCGD COc1cccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1C 1783637461 AGIDKEUXHMUTIJ-DEOSSOPVSA-N 452.316 0.370 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnc(O)c3ccn(C)c13)CCO2 1783934841 IGCMINUNUHNPQJ-JOCHJYFZSA-N 458.519 0.095 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)C1=Cc3ccccc3NC(=O)C1)CCO2 1783935359 NLSSWHLJBMHBRD-DEOSSOPVSA-N 469.542 0.615 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C1)CCO2 1783935422 RWZVDIANANOCBX-SBUREZEXSA-N 481.594 0.446 50 20 JCGD Cc1cc2nc(C(=O)N3CCO[C@@]4(CCN(C(=O)CCC(=O)NN(C)C)C4)C3)[nH]c2cc1C 1783936251 SSNRSRGKRVYYPK-HSZRJFAPSA-N 456.547 0.996 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)cc1 1784090023 NSTHWRKVJHNUQY-OWLYRPNTSA-N 458.964 0.212 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]3C2)C1 1784092064 GPOSQBPAFGPSLZ-PCCRXHMLSA-N 489.997 0.184 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cncc(S(C)(=O)=O)c3)[C@H]2C1 1785589371 LNZMUDFXYHYXHK-KNPMLCFXSA-N 474.377 0.862 50 20 JCGD CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786986489 GMLMVMBQWGSVRD-FFGOWVMKSA-N 489.378 0.263 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc2nnc(Br)n2c1 1787148119 IEXZCWVYVQEMLH-XUXIUFHCSA-N 486.754 0.685 50 20 JCGD Cn1nc2c(c1C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@@H](O)CCl)CN(C(=O)OC(C)(C)C)C2 1792984054 RCLIPRXTDJQSJQ-RMHZUWNSSA-N 497.980 0.474 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1 1793082819 BUXHGKBVSYHBDA-BPKGMFCQSA-N 475.970 0.466 50 20 JCGD COc1cc(N2CCC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)CC2)ncn1 1793308530 LRSGNSWQHWKURV-REPLKXPHSA-N 487.605 0.713 50 20 JCGD CCOc1ccc(Cl)cc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795739733 HGZPXNUDGBOFLB-VPTLXERWSA-N 472.734 0.936 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(c3ccc(F)c(F)c3)CC1)C2)c1cccc(B(O)O)c1 1795739925 RGYZCORENOIBDU-VPTLXERWSA-N 470.281 0.580 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc1 1795747251 BHUFKNGGTFSYKW-ACDBMABISA-N 470.356 0.401 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ncn3c1CNS(=O)(=O)c1ccccc1-3)C2)[C@H](F)Cl 1796366501 YIWCGQGNQGTGTG-GWLLULGVSA-N 497.936 0.402 50 20 JCGD CCC[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)n1cccc1 1796386417 YOOOCRCVAHBUQZ-JSJNYSNDSA-N 454.531 0.731 50 20 JCGD CCOc1cnc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)cn1 1796440958 GWKLXCRBJDDOHW-RVQRMFQJSA-N 469.502 0.213 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)C[C@@H](F)C1 1797208704 OBPBVTUYLYXCIK-HAEOWDPNSA-N 477.961 0.771 50 20 JCGD CCOC(=O)c1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1 1797753616 BEJYUQUJZGQSEQ-XEMDLRDOSA-N 481.509 0.379 50 20 JCGD CCS(=O)(=O)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1 1798442844 KCLDGUPDZCMDTI-BCDXTJNWSA-N 499.593 0.973 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1(F)CN(C(=O)OC(C)(C)C)C1)C2 1800982984 MZNDPTNEAFSHHI-XGUBFFRZSA-N 463.934 0.789 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C2 1802338862 XMEBHFAGPVVOOS-YVSFHVDLSA-N 469.583 0.273 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN2CC(=O)NC2=O)[C@H]1c1cccnc1 1804190810 NZJQSMPSNFWEQY-JKIFEVAISA-N 466.336 0.813 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H](CNC(=O)CN2CCS(=O)(=O)CC2)[C@H]1c1cccnc1 1804193405 ACKJWNIGUCWZHN-WIYYLYMNSA-N 482.679 0.669 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)n1cccc1C=O 1807388008 NMINCLJCHRMWNA-DHJUGAMNSA-N 474.326 0.956 50 20 JCGD C[C@@H](C(=O)NC[C@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)N1CCN(C)CC1 1807903357 OSPXCKWAHOYRCY-NOXFTYBFSA-N 473.622 0.096 50 20 JCGD CC(C)(C)n1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1 1811551985 GCEIZGQMKVUOSI-WIYYLYMNSA-N 476.346 0.741 50 20 JCGD NC(=O)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1 1813736744 NUULKYVWZRRVON-RBBKRZOGSA-N 472.310 0.494 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CN2CCSCC2)n[nH]1 1814416830 HRCYJUKAZVBQFP-INIZCTEOSA-N 451.597 0.824 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2n[nH]c3c2CS(=O)(=O)C3)[nH]n1)[C@@H](O)CCl 1814869840 CYZUVZLEQFBLPY-OLZOCXBDSA-N 456.912 0.467 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)[C@H]1CC(=O)N(C3CCCC3)C1)CC2)c1ccc(B(O)O)cc1 1815336818 FRGCGNFQIAQAMO-RDJZCZTQSA-N 496.398 0.840 50 20 JCGD COCCn1nccc1C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815340288 HTQWCVFRAKEKPZ-OAHLLOKOSA-N 469.332 0.205 50 20 JCGD C[C@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)[C@H]1SC(=N)NC1=O 1818097944 BHSCIZGSNREYRG-XNJJOIOASA-N 484.347 0.198 50 20 JCGD CC[S@](=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)[nH]n1 1819264359 WKYCMKWIYZNZCH-FTDQSSOUSA-N 461.548 0.873 50 20 JCGD Cn1ccc(=O)cc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1821309251 BWRCQBHDANKNIM-AWEZNQCLSA-N 452.301 0.061 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@@H]2CCCCN2C(=O)COC(=O)C(F)(F)F)CC1 1828831976 SZIPGWFXQKDQHA-KRWDZBQOSA-N 470.253 0.705 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)cc1 1830221994 WVMAZJIPKROAOI-CFLQYTFWSA-N 471.348 0.968 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C(C)(C)CCl)CCO2 1830364425 KBVVNPLVBVEKTN-JXFKEZNVSA-N 462.927 0.203 50 20 JCGD CN(CC(=O)N1CCC([C@@H]2CCCCN2C(=O)[C@H](F)Br)CC1)C(=O)C(=O)O 1830382893 MYAHUJBBTLZZCN-JSGCOSHPSA-N 450.305 0.840 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H]1CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725178 GUENOUDTKJQYEU-JKSBSHDWSA-N 489.997 0.832 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)n1ccnc1)CCO2 1830976923 KVRQKJWWVKOBQH-GYBNKOMZSA-N 471.518 0.035 50 20 JCGD O=C(c1ncn(-c2cccc(F)c2)n1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833352039 KWSKIUIMTQHDNC-JXFKEZNVSA-N 467.885 0.076 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)o1 1834092777 JZTFFBSHDLWJBX-QFIPXVFZSA-N 457.487 0.279 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCC(N2CCC(NC(=O)CCBr)CC2)CC1 1834423652 BURHYTAWSFJHBZ-MRXNPFEDSA-N 463.373 0.408 50 20 JCGD Cc1cccn2ncc(C(=O)N3CCC(N4CCC(NC(=O)c5ccc(B(O)O)cc5)CC4)CC3)c12 1834799232 RWAUTRZIJSAMAL-UHFFFAOYSA-N 489.385 0.822 50 20 JCGD COCc1c[nH]c(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834801158 NZTRRTJZFPZZIQ-UHFFFAOYSA-N 468.363 0.340 50 20 JCGD NC[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1)c1ccccc1 1834822231 DUJGWKZSCOMISI-XLIONFOSSA-N 454.365 0.970 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)CCN3CCCC3)CC2)CC1 1835737414 RPZOEGOBHRPYFX-UHFFFAOYSA-N 471.606 0.356 50 20 JCGD Cc1oc(C(C)(C)C)cc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835929144 BVRHBCWLKOCMMZ-VWLOTQADSA-N 484.358 0.949 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835932204 TWIJCMGMRSPYHJ-CJAUYULYSA-N 484.333 0.454 50 20 JCGD COc1cc(F)c(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(F)c1 1835939545 RZKXABPLYLPHAA-QHCPKHFHSA-N 490.268 0.037 50 20 JCGD O=C(CCc1ccsc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836004789 RNOSCKUQEUCADK-QFIPXVFZSA-N 458.345 0.131 50 20 JCGD O=C(c1cnc2c(Cl)cccn12)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1836370330 OKBFGTFXNICVPT-DNVCBOLYSA-N 457.314 0.657 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1 1836842885 DTITXWORDWLHLH-AUUYWEPGSA-N 466.336 0.830 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@]2(C1)CN(C(=O)[C@@H]1[C@@H]3Sc4ccccc4[C@H]31)CCO2 1837471242 XURCRMYLYWGWMK-RCHULGBISA-N 452.960 0.930 50 20 JCGD CCc1cnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)C3)C2)s1 1837721425 VSLSGWDALQBJLO-BHSKHCGUSA-N 488.570 0.910 50 20 JCGD O=C([C@H](F)Br)N1CCC(OC2CCN(C(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1838404009 JXAWKGPTJURWJW-MAUKXSAKSA-N 466.348 0.326 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(-n4c(O)nnc4O)cc3)CCO2)C1 1838605139 QMWQFRDSGINESY-HRAATJIYSA-N 479.921 0.766 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCO[C@@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)c2n1 1839626906 AYCPZBWBUKPLNF-XMMPIXPASA-N 486.573 0.394 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](N)c3ccccn3)C2)C1 1839963471 LFMNUWYTPYQPEG-GMBSWORKSA-N 455.353 0.711 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4ccncc34)C2)C1 1839965487 ZQENIWLQALUZNS-HNAYVOBHSA-N 466.336 0.973 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)N3CCN(C)CC3)C2)C1 1839966180 WUPSKJUDUNBJPW-MBOZVWFJSA-N 475.428 0.252 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2ccnnc2O)C1)NC(=O)NCc1ccccc1 1844611472 NEEXPDSQWZUZAC-UHFFFAOYSA-N 453.503 0.345 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)CN(C(=O)OC(C)(C)C)C1CC1)C2 1846384076 ZWLNEMYHCDTSEX-UHFFFAOYSA-N 451.568 0.962 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@H]2C[C@H]3C[C@H]3N2C(=O)OC(C)(C)C)C1 1847083200 UBKPFVSJUVFVEQ-ZACQAIPSSA-N 463.579 0.961 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)NC2CC2)cc1S(=O)(=O)N[C@@H]1CCCC[C@@H]1C 9889322 WHABNKBBSFOTFP-SWLSCSKDSA-N 452.533 0.592 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1ccc2c(c1)SC1=NS(=O)(=O)CCN12 105281329 YEKGZHPCCFXVHX-UHFFFAOYSA-N 494.580 0.666 50 20 JCGD COc1ccc(NCC(=O)NNC(=O)CN2CCN(S(=O)(=O)c3ccc(C)cc3)CC2)cc1 108103200 VOMUEDVNPPEBNA-UHFFFAOYSA-N 475.571 0.569 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3cccc(C(F)(F)F)c3=O)cc2)CC1 728214459 PMQHYHIBQRSIBL-UHFFFAOYSA-N 473.477 0.947 50 20 JCGD CCn1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)c(=O)c2ccc(C)nc21 728317834 WIRZGHFMRWYSNV-SFHVURJKSA-N 466.450 0.869 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N[C@H]1CCCC[C@@H]1C 728381928 QWWVDZJQAIBDIX-IMJJTQAJSA-N 487.600 0.748 50 20 JCGD Cc1ccc(S(C)(=O)=O)cc1S(=O)(=O)N1CCN(C(=O)NNC(=O)Cc2ccccn2)CC1 729230921 DMYZRILZGLBXFA-UHFFFAOYSA-N 495.583 0.083 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1Cl 729274880 GKRZIEDJICNXAP-LLVKDONJSA-N 466.969 0.213 50 20 JCGD CC[C@@H](N=c1nn[nH]n1-c1ccccc1)C(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCC2)c1 729509746 DSSCAHMBULPBJK-LJQANCHMSA-N 498.569 0.520 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cnc2c(c1)c(C)nn2C 749371488 AURHCWVDDQRMDW-UHFFFAOYSA-N 451.534 0.502 50 20 JCGD CC(C)CCn1nc(C(=O)NNS(=O)(=O)c2cccc(S(N)(=O)=O)c2)c2ccccc2c1=O 817974312 KUVANYJYOGDBIX-UHFFFAOYSA-N 493.567 0.713 50 20 JCGD O=C(NNC(=O)c1sccc1S(=O)(=O)N1CCCCC1)c1ccc(-n2cnnn2)cc1 822199520 UTDLJTDZQOGJHY-UHFFFAOYSA-N 461.529 0.973 50 20 JCGD CCc1noc(C)c1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 849208708 MNCSGWUPMSJZJI-UHFFFAOYSA-N 479.497 0.748 50 20 JCGD O=C([C@H]1CCCN(S(=O)(=O)c2ccc(Br)s2)C1)N1CC[C@H](B(O)O)C1 864232602 ANRLWVBVOSRLIV-QWRGUYRKSA-N 451.173 0.987 50 20 JCGD Cn1cc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)cc1C(=O)O 912979430 SJFKLDMHOKMJCP-UHFFFAOYSA-N 456.502 0.131 50 20 JCGD NC(=O)[C@@H]1CC(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)=NN1c1ccccc1 913081156 CMBHIMRMDSJPAM-IBGZPJMESA-N 484.538 0.352 50 20 JCGD COc1ccccc1OCC(=O)NNC(=O)CNS(=O)(=O)c1ccc(NC(C)=O)cc1 913445869 APOQEXPOEMRSKW-UHFFFAOYSA-N 450.473 0.158 50 20 JCGD O=C(CCN1C(=O)[C@H]2CCCC[C@@H]2C1=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 913606406 HXJHIXSZDXRCOZ-ROUUACIJSA-N 476.555 0.797 50 20 JCGD Cc1csc(CNC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)n1 916232767 LPYLGZZEONVBRZ-UHFFFAOYSA-N 467.573 0.936 50 20 JCGD CN1CCN(C(=O)c2ccc(CNC(=O)NNC(=O)c3ccc4c(c3)OCCO4)cc2)CC1 916391051 ZDNGMUKLMGOXNI-UHFFFAOYSA-N 453.499 0.990 50 20 JCGD CCCn1nc(C(=O)NNS(=O)(=O)c2ccc(O)c(C(=O)OC)c2)c2ccccc2c1=O 917721616 AOBXKVFBSSEKAC-UHFFFAOYSA-N 460.468 0.922 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)[C@H]2CC(=O)N(Cc3ccccn3)C2)ccc1Cl 917919822 YISZNZHTPZIMPM-LBPRGKRZSA-N 451.892 0.192 50 20 JCGD O=C(NNS(=O)(=O)c1cnn(-c2ccccc2)c1)c1cccc(S(=O)(=O)N2CCOCC2)c1 921019706 GVCAEXZZSSPXIF-UHFFFAOYSA-N 491.551 0.517 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)Nc1cccnc1)C2 1778091201 QRJDZZZUHIUWKF-VFHFUPNESA-N 495.540 0.668 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ncn(C)c2C(F)(F)F)C1 1778254976 MIYLFQDSIHMLKC-JLTOFOAXSA-N 488.511 0.939 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCO3)C2)C1 1778281361 RIRIRFHEJCVSGI-SQJMNOBHSA-N 487.601 0.090 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc3ccncc13)CCO2 1779037124 OXTGYTQXXKRNIQ-DEOSSOPVSA-N 460.494 0.991 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1c[nH]c2cnccc12 1779174794 FGGKFDQSZMITLW-ZJSXRUAMSA-N 462.315 0.684 50 20 JCGD Cc1n[nH]c(C)c1C(=O)N1CC[C@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1 1779395595 FYPZLKAPWWZBGT-DEOSSOPVSA-N 483.573 0.816 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](COC)NC(C)=O)C1 1779559549 JFFQLIQTKROZDI-YIOZNXECSA-N 462.385 0.825 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(Cl)nn1 1779627143 IAAGBAXJSNHESB-DYESRHJHSA-N 458.711 0.251 50 20 JCGD CCn1nc(C(=O)N2CC[C@]3(CN(C(=O)/C(C)=N/NC(=O)c4ccc[nH]4)CCO3)C2)cc1C 1779715751 SUVFTEHIXOCLGX-ZHNJOBQTSA-N 455.519 0.789 50 20 JCGD O=C(C1=C2c3ccccc3C(=O)N2CC1)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780005787 YFGDUEFOPIPHCX-AREMUKBSSA-N 487.321 0.081 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2)[C@H](F)Br 1780771591 MRBCQMWYYRKXAQ-BTJLNZGRSA-N 471.287 0.236 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)C2)[C@H](F)Br 1780777141 SDTMLUFAJFPQIP-QIIPPGSGSA-N 489.298 0.961 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCO[C@]3(CCN(C(=O)[C@H](F)Br)C3)C2)c1 1781326453 PHCVYRXTELMZDV-BBRMVZONSA-N 464.313 0.619 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(CN(C(=O)CC[C@@H](N)C(N)=O)CCO2)C1 1782864514 NFLBLTVNVWGAGU-WTKXUXAGSA-N 461.469 0.294 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](N)CCC(N)=O)CCO2 1782864832 WCRRBJCSTFCLIT-RTBCXJIMSA-N 461.469 0.294 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CSCN3C(=O)[C@@H]3CCC(=O)N3)C2)C1 1782872483 SNVZCOVLMUCFKK-CMBDLQSPSA-N 487.022 0.404 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(O)nc3ccccc13)CCO2 1783934164 ASJCPFUMGVZAQV-QHCPKHFHSA-N 455.515 0.757 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C[C@@H]21 1783963929 FVKUOTVHHSUEBQ-YXMSTPNBSA-N 492.411 0.883 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)[C@@H]3SC(=N)NC3=O)C[C@@H]21 1783965752 OQPUQXILFLRBRR-ORWNZLQRSA-N 475.409 0.800 50 20 JCGD COC(=O)C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1 1784093535 AJSCTJMTIWNANJ-QXKUPLGCSA-N 491.969 0.022 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)/C=C/c3ccc(O)c(O)c3O)C2)C1 1785505913 RPLAELHUBSVADR-MEKCYUAKSA-N 497.508 0.781 50 20 JCGD CC(=O)Nc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)c1 1786981841 BRXBQNZAPVPTLS-NYVOZVTQSA-N 465.315 0.232 50 20 JCGD COc1cccc2c1C[C@H](C(=O)N1CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C1)CC2 1786983932 WSKISPIREVEUPM-YGDRIEADSA-N 492.381 0.773 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)c1ccc2nnc(Br)n2c1 1787148117 IEXZCWVYVQEMLH-FQUUOJAGSA-N 486.754 0.685 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3cc(C)cn3)C[C@@H]21 1787508645 FISJUEIQNSWOFX-BODMQJBDSA-N 455.519 0.305 50 20 JCGD COCCCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1 1789724981 VEULQILFHSVPSN-ACRUOGEOSA-N 475.590 0.739 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ccccc4n(C)c3=O)C[C@@H]21 1791253518 CHTYSCWITLGJLB-AFIMGQEJSA-N 462.934 0.781 50 20 JCGD CCOC(=O)[C@@H]1CCC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1792958607 YLUNLVSNMQROCB-PHSQPZKOSA-N 487.557 0.258 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792981363 KAUNGHZCQMERCM-ZTYXSZCMSA-N 463.934 0.523 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1793878239 IDKLOHJGKBNAGI-VJTDZRGJSA-N 454.351 0.308 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](F)Cl)CC1 1796371159 RDTMJSHEBGVNHR-FSDCSDTHSA-N 462.950 0.663 50 20 JCGD Cc1nc2cccc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cccc(B(O)O)c3)C4)c2s1 1796866794 KLXPJYUKXRHTCO-CWPLJXCYSA-N 465.340 0.802 50 20 JCGD C[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1797300565 QXHOVKKXSHWDQI-WBAHDQRJSA-N 459.971 0.679 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2ncnn2c1 1797560426 ASQDCSBMLSIWQU-GRTWCBPGSA-N 464.486 0.067 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(c2ccc(F)c(F)c2)CC1 1799066569 WBBJSFKPGIVSCI-VTEUUUEMSA-N 485.491 0.898 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1799260302 DLPURVAHBYAHQK-DABQJJPHSA-N 454.351 0.921 50 20 JCGD O=C1C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](Br)Cc2ccccc2)CN1 1800437270 TZYNGIWQWMAXOP-OGJJZOIMSA-N 464.360 0.718 50 20 JCGD COc1cccc(/C=C/C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)c1 1800681806 WJWBPVQPEOGEFT-BAHCYQSUSA-N 450.300 0.292 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)C2=NN(C)C(=O)CC2)[C@H]1c1cccnc1 1804123240 MERFIAAZHYZHNW-HRAATJIYSA-N 457.535 0.069 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCC(N)=O)[C@H]1c1cccnc1 1808416314 LURBEIVIQZFWLM-RVGDNOHSSA-N 453.503 0.487 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)c2cnc(O)nc2O)[C@@H]1c1cccnc1 1808417103 IXUZFVZPOPYDPC-WMIURUSNSA-N 492.496 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@H](CNC(=O)c2cnn3c2OCCC3)[C@@H]1c1cccnc1 1812119856 KDINGIDNMRPMBU-UWJYYQICSA-N 469.546 0.753 50 20 JCGD Cc1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)ncc1[N+](=O)[O-] 1815341262 VFERVHFLSBIVOI-CQSZACIVSA-N 481.299 0.974 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)N1C[C@H]2C[C@@H]2C1 1815356357 FJBAGUCVDLEORA-DNNBLBMLSA-N 454.361 0.389 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc4n(n3)CCCC4)sc2C1)c1ccc(B(O)O)cc1 1819127109 KCKYYFVRXIKMEU-HNNXBMFYSA-N 465.344 0.895 50 20 JCGD Cc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cnccc3C(=O)NN)n[nH]2)c(=O)[nH]c1C 1819401501 FELZHZPJUGODIS-INIZCTEOSA-N 479.501 0.728 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1CCc2nc(NC(=O)/C=N/O[C@H]3CCCCO3)sc2C1 1819908091 WEBBHJLVJACYBR-KGOMVVCDSA-N 466.564 0.957 50 20 JCGD CCn1nc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2ccc(B(O)O)cc2)CC3)cc1C 1820770165 VNOMMADIDQOMMD-HNNXBMFYSA-N 453.333 0.887 50 20 JCGD C[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1)N1CCN(C)CC1 1826088710 KEIUJSTZZZACCO-GJZGRUSLSA-N 465.624 0.064 50 20 JCGD C[C@@H](Oc1cccnc1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2 1826886157 IHDHBPMXQNIEGH-CJNGLKHVSA-N 466.328 0.911 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CCCC[C@H]3C3CCN(C(=O)[C@@H](O)CCl)CC3)cc21 1828499711 ZTPUYMXTNHNINX-WMZOPIPTSA-N 451.955 0.850 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccn3c(O)nnc23)CC1 1828926281 CRSXQWUSNXGKFU-IBGZPJMESA-N 492.540 0.981 50 20 JCGD CNc1nsnc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)CBr)CCO2 1830532977 CMLBLALYYZHOFV-MEDUHNTESA-N 462.370 0.681 50 20 JCGD O=C(c1nc(-c2ccccc2)ns1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830722472 CCOXTQGQHUMSLW-QRWLVFNGSA-N 466.947 0.875 50 20 JCGD COc1ccc(COCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1 1830738005 KZIQCMQTMSRJQV-RXVVDRJESA-N 456.923 0.268 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3ccnc3)C2)C1 1832549101 FHDOOYWWGGDYCO-KKSFZXQISA-N 485.969 0.472 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)n2)CCCN1 1833724202 LUFMNUYXRXIULZ-WIYYLYMNSA-N 483.928 0.012 50 20 JCGD CC[C@@H](Br)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)N3CCOCC3)CC2)CC1 1835765097 JCJNDVPXTWIMSS-YLJYHZDGSA-N 475.428 0.382 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@H](C)NC(=O)c3cnccn3)CC2)CC1 1835797913 IVTDVKUXYCNXAB-MAUKXSAKSA-N 480.997 0.420 50 20 JCGD Cc1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)n1 1837460689 JDRZITHFFDSIFH-RUZDIDTESA-N 496.568 0.400 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049608 MGQZDWJPTBLRNI-AUUYWEPGSA-N 466.336 0.512 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)N(C)C(=O)OC(C)(C)C)CCO2 1839075602 BAQLGQLQIHQHTK-XFQAVAEZSA-N 477.986 0.952 50 20 JCGD CCCNC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199437 WKCJODSFYXKJKS-RDJZCZTQSA-N 452.321 0.440 50 20 JCGD COc1c(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc(F)c1F 1839383852 GIOSVDOMIVCFOG-QFIPXVFZSA-N 484.500 0.416 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3occc3c1O)CCO2 1839564577 VNSDYGNTMAYYDP-XMMPIXPASA-N 480.282 0.202 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3ccc(O)nn3)CCO2)C1 1839652272 WHNRCYIZRAHRJR-RBUKOAKNSA-N 461.346 0.808 50 20 JCGD C[C@@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)Oc1ccccc1 1839746253 HMPJJFOSHPFEET-DFBJGRDBSA-N 482.342 0.294 50 20 JCGD C[C@H](CC(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)Oc1ccccc1 1839749131 ZLYIXDZKKJLTNM-NTKDMRAZSA-N 476.574 0.673 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncn(C)c3C(F)(F)F)C2)C1 1840152599 NAPPNZRGRNHGQN-SJKOYZFVSA-N 468.860 0.763 50 20 JCGD 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O=C([C@@H]1CCCN1C(=O)c1ccc(F)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1830607233 SWFSQNFZEQFFSQ-SFYKDHMMSA-N 497.951 0.486 50 20 JCGD CCOC(=O)c1ncn2cc(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)ccc12 1830722595 FINXQKBUMQGUBS-VGSWGCGISA-N 494.932 0.181 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)C[C@@](C)(O)CC(=O)O)CC1 1831868895 FSVMGEFBSMZPQB-HTAPYJJXSA-N 454.568 0.595 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)Cn3cc([N+](=O)[O-])cn3)CC2)CC1 1833787240 ZKJIQQYOLBCMTK-KRWDZBQOSA-N 456.931 0.617 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@@H](O)c1ccccc1 1834582355 YLPCPBFOCUSTRX-QHCPKHFHSA-N 465.359 0.285 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H]3C[C@]3(F)Cl)CC2)CC1)c1ccc(B(O)O)cc1 1834799026 KYJVHXOUXPQXFR-GHTZIAJQSA-N 451.735 0.476 50 20 JCGD CCOc1cnc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1834800074 SMQRMSOXRYDEQU-UHFFFAOYSA-N 481.362 0.054 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CCOCC1)CCO2 1835191245 VEKLEXLGCYTAIK-OLCUMFGGSA-N 461.519 0.003 50 20 JCGD Cc1cccc(C)c1SCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835930783 ZJZWUXVKRREEHA-VWLOTQADSA-N 498.410 0.846 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3c(F)cccc3Cl)C2)C1 1835939592 UWDYPPRJZVELDN-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD Cc1cnoc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836070948 QHPZLHSJSFYPKR-UHFFFAOYSA-N 455.519 0.481 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cnc3cc(Cl)ccn13)CCO2 1836370631 ZHPOGMLROFJLGW-QFIPXVFZSA-N 492.964 0.431 50 20 JCGD CC[C@@H](Cl)C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836396738 MXOCDGGAEWXFRK-GOSISDBHSA-N 450.971 0.888 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)COc3cccnc3)CC2)CC1 1837113169 CWWNXBCJHVELKF-UHFFFAOYSA-N 482.541 0.771 50 20 JCGD COc1cccc(C(=O)N2CCC(OC3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1837350135 PKCMRAPJTIYWMK-UHFFFAOYSA-N 467.331 0.696 50 20 JCGD CC(C)(C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1)c1ccccn1 1837461028 MRKZHLIJOHGKQE-XMMPIXPASA-N 482.541 0.128 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1CCC(OC2CCN(C(=O)CCBr)CC2)CC1 1837653823 SNUFLSRWWFTOSZ-INIZCTEOSA-N 464.357 0.835 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnncc3C(=O)O)CCO2)C1 1837949748 YRDHSWOXUDIRDY-APPDUMDISA-N 457.281 0.028 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)c1cnc3snnc3c1)CCO2 1838506318 JFDNPTOMHPARIM-QGZVFWFLSA-N 470.349 0.941 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc3ccncc13)CCO2 1839507465 AMRAJMBNBOPTRI-RUZDIDTESA-N 475.310 0.298 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3CCCS3(=O)=O)CCO2)C1 1839783915 OKCQSCSVWXRNRY-JQFCIGGWSA-N 457.376 0.256 50 20 JCGD O=C1NC[C@@H](C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Br)Cc2ccccc2)CCO3)O1 1839801589 RJELGBCVTSAUGI-LLGFUMIMSA-N 496.358 0.557 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)CNC(=O)OC(C)(C)C)CCO2)C1 1839986594 UHGJQKKSLPKTHP-KUHUBIRLSA-N 478.384 0.999 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C2)C1 1840032043 MFCWLFRSLDVCQR-XCLFUZPHSA-N 481.347 0.820 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4snnc4c3)C2)C1 1840034103 AGPBQZBJJPBLNS-APPDUMDISA-N 470.349 0.940 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3c4c(nn3C)CCC4)C2)C1 1840035219 KDYSSMYDWVPFQF-BFUOFWGJSA-N 455.353 0.762 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2 1840113563 HOUPXCHSZCFSAQ-VWLOTQADSA-N 478.354 0.558 50 20 JCGD COc1ccccc1CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCC(=O)NN(C)C)CCO2 1840182633 ORBAPLXFYRLGAT-DEOSSOPVSA-N 476.574 0.457 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(N(C)C)cc3)C2)C1 1840185755 WXRXSRRHHZFDEN-HSZRJFAPSA-N 461.563 0.196 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1840895013 AMVBGERTAIVHAV-SCLBCKFNSA-N 464.009 0.711 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@]2(C[C@@H]2C(=O)N2CC3(CCCN3C(=O)c3cccc(B(O)O)c3)C2)C1 1843014948 TWLURAAXUAUKGH-NTKDMRAZSA-N 483.374 0.831 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)CCc2ncc[nH]2)C1)NC(=O)NCc1ccccc1 1846515290 SSVPKSGCQMSYOV-UHFFFAOYSA-N 453.547 0.892 50 20 JCGD CCN1CCN(c2ccc(C(=O)N3CCCC34CN(C(=O)c3ccc(B(O)O)cc3)C4)cc2)CC1 1846897770 VFRHGGDEHFJWOF-UHFFFAOYSA-N 476.386 0.639 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCCCNC(=N)N)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847563223 KLPXGTVDUOBKFL-YHUYYLMFSA-N 489.017 0.335 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)C1=COCCO1)c(=O)n2Cc1ccccc1 10161565 JHJZZFSRALALOD-UHFFFAOYSA-N 482.497 0.100 50 20 JCGD CN1CCN(C[C@H](NC(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)c2ccccc2)CC1 727945860 OWCSGHKDMYPRJC-NRFANRHFSA-N 488.614 0.870 50 20 JCGD C[C@@H]1COCCN1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 729615019 VWORTZQUNAYWOF-QGZVFWFLSA-N 475.571 0.830 50 20 JCGD CCS(=O)(=O)c1ccc(N2CCC(NC(=O)NN[C@@]3(C)CCS(=O)(=O)C3)CC2)cc1 746971555 FHQRNSBVDIQTHQ-IBGZPJMESA-N 458.606 0.830 50 20 JCGD CS(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)ccc1Cl 783621805 VXCODVJULDGNNB-OAHLLOKOSA-N 468.871 0.888 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CNC(=O)c2ccccc2OC(F)F)c1 913465218 MJLSUFJFHJMDFG-UHFFFAOYSA-N 470.454 0.729 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCc2ccccc2CN2CCOCC2)c1 915927729 WDGGRVQAAJKRNN-UHFFFAOYSA-N 475.571 0.913 50 20 JCGD O=C(NNC(=S)NCCCN1CCOCC1)c1cccc(S(=O)(=O)N2CCCCC2)c1 916115691 VXQARYVYIKCDDA-UHFFFAOYSA-N 469.633 0.692 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)NC(=O)N[C@@H]2CCS(=O)(=O)C2)c1C 916420300 IPUSPKRNCMOOBQ-QRLCYMJDSA-N 480.543 0.775 50 20 JCGD COc1ccc(CC(=O)O)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 919954628 OKZATSOSXRISGY-UHFFFAOYSA-N 471.513 0.196 50 20 JCGD COc1cc(CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)ccc1OCC(=O)N(C)C 1317872259 SHZNITCKVYJKNK-UHFFFAOYSA-N 492.558 0.600 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccnc(Br)c3)CCO2)C1 1779032724 WZEOHWZIUDLKLD-FQEVSTJZSA-N 489.330 0.600 50 20 JCGD CCn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1C 1779833503 LGLIROSALUFNBF-NFBKMPQASA-N 454.336 0.333 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H]1CCC(=O)NC1)CCO2 1780094744 CGUVMEZCYZWPCJ-OYHNWAKOSA-N 474.470 0.490 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(F)c[nH]1)CCO2)NC(=O)NCc1ccccc1 1780968831 QNIKVWIRDXOTGT-QHCPKHFHSA-N 472.521 0.944 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@H](O)CCl)C3)c1 1781186464 KEAQDAFFDIMKFY-MBOZVWFJSA-N 476.954 0.956 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CCCS1(=O)=O)C2 1782002467 QIQIDAWJNDKOLS-SZOQZIPDSA-N 451.383 0.861 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1CN(C(=O)OC(C)(C)C)C1)C2 1782214955 NUIPOVQUBDXNPL-HOYKHHGWSA-N 495.621 0.740 50 20 JCGD C[C@@H](Br)C(=O)N1CC[C@]2(CN(C(=O)Cn3c(=O)n(C)c4ccccc43)CCO2)C1 1783534826 ZMKPBFDPQKLXTH-VLIAUNLRSA-N 465.348 0.953 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CNC(=O)O3)C[C@@H]21 1785075635 TYRAEISBOXTHSI-YTFOTSKYSA-N 474.942 0.207 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@]3(F)CCCCC3(F)F)C[C@@H]21)c1ccc(B(O)O)cc1 1786979855 UPASXPBIUFMKIH-QUJKESNLSA-N 468.281 0.877 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786985279 YBJFTVKHBUJMSG-PMVMPFDFSA-N 450.344 0.901 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CS(=O)(=O)N3CCCC3)C[C@@H]21 1788762463 ALSIHMGPTVRSQT-ULQDDVLXSA-N 461.657 0.243 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)CCBr)C3)C1 1793082778 XJEFJHARUNSSFW-IVSAIRAKSA-N 490.395 0.997 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnco1)NC(=O)NCc1ccccc1 1793565846 VLTIEOMJGNFMDR-XEMDLRDOSA-N 456.503 0.224 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1Cc2ccccc2CN1C 1793829940 XUBWGVUXKYARLA-GMFHNFPSSA-N 492.580 0.767 50 20 JCGD C[C@@H](CBr)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCc2nc(O)nc(O)c2C1 1794108684 PAWLESJSXVMIMM-BLXSCJOCSA-N 483.363 0.613 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)C(C)(C)CCl)C3)n(C)c1=O 1794249484 DBDZUPBTKWQMDI-BTTYYORXSA-N 464.954 0.337 50 20 JCGD CCn1c(-n2nc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](Cl)COC)C4)cc2C)cccc1=O 1795936244 QIRBUBKLVSPFBG-DLRJPAPCSA-N 491.976 0.819 50 20 JCGD CC(C)(C)OC(=O)NC(C)(C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796190188 ZEMDUVBULRXNQJ-BCDXTJNWSA-N 459.352 0.922 50 20 JCGD CC(C)(C)OC(=O)N1CCn2nnc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Cl)c2C1 1796366011 DMFNVJAZOPZBAW-FAXLKDOZSA-N 486.932 0.766 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1COc3ccccc3O1)C2 1796439554 KVFBXSFTGVAJOH-FVNYTLQLSA-N 481.509 0.550 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CCC(=O)N1C)C2 1798523096 RPBVGQYXDOURKC-ACNBBOPNSA-N 474.470 0.344 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(OCCCO)cc1 1798541038 CQZRZVLOWCTFCU-SZGIVFOPSA-N 497.552 0.785 50 20 JCGD CCSc1cccnc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1798776048 BZXPYGYOTSFTOD-ZSBFGKGUSA-N 470.555 0.709 50 20 JCGD CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccc(Cl)c1 1799070348 YQHOMFMWILBWHY-GMQQQROESA-N 499.760 0.100 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CN(C(=O)OC(C)(C)C)C[C@H]1O 1799196203 HZZZIGHNBYVUNJ-DBWAAGBOSA-N 475.970 0.058 50 20 JCGD C[C@@H](C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1)n1cnnn1 1800437051 UJGRYEAHHHUPQQ-MWTISTBLSA-N 477.363 0.830 50 20 JCGD N#Cc1ccc2[nH]nc(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cnccc3C(=O)NN)C4)c2c1 1800877061 XCYAJPYDFCQDMW-QDMKHBRRSA-N 458.482 0.999 50 20 JCGD C[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)n1cnnn1 1801438982 QHGZFDYUIQQRDR-JFMONLCZSA-N 477.363 0.830 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)n1ccnc1C 1801451482 DJTAUTVMLZHPOC-SHBUVVKZSA-N 455.519 0.476 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1802109283 DVFXUOPNOXEJGE-NEGDOWEVSA-N 465.271 0.191 50 20 JCGD Cc1cc(CC(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@@H]2c2cccnc2)nn1C 1803292311 NUVVSSIGTBWWKW-FDDCHVKYSA-N 455.563 0.745 50 20 JCGD C#CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1804373825 KQTSZXDBDWKKPH-YRPNKDGESA-N 469.347 0.535 50 20 JCGD COc1cccc(CC(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1804396238 BYSSYNNZWLQASJ-DVECYGJZSA-N 474.326 0.727 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1cnnc(Cl)c1 1804720449 DBKJLJKEMPDQKZ-UZLBHIALSA-N 465.706 0.838 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1807364927 UZNGFEPZCGVFCZ-GCJKJVERSA-N 475.314 0.584 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cnn(-c3cccnc3)c2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369308 FUNSXGORPJCXNM-RDPSFJRHSA-N 496.336 0.976 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)CNC(=O)c2ccco2)[C@H]1c1cccnc1 1807591212 OBEBYEDFSBKCII-HRAATJIYSA-N 491.508 0.423 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1CCN(C(=O)COCCO)[C@@H]1c1cccnc1 1808416134 FBZWAZNIZONDOX-YVIKVBFHSA-N 456.503 0.230 50 20 JCGD Cn1nc2c(c1C(=O)N1CC[C@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]1c1cccnc1)CCC2 1810306076 SIFUJPZYDJZCHG-IIBYNOLFSA-N 488.552 0.936 50 20 JCGD CC[C@H](Br)C(=O)N1CCC2(CCCN(C(=O)c3cc(=O)n4[nH]nnc4n3)C2)CC1 1810493905 ZPHCJCCCGABOTE-LBPRGKRZSA-N 466.340 0.831 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2cnc(O)[nH]2)[C@@H]1c1cccnc1 1810950004 FQFRORLUVHWROQ-GUYCJALGSA-N 450.459 0.142 50 20 JCGD C[C@H](Oc1cccnc1)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1813437065 LSJDHZASCSYLSJ-XTQVGHSUSA-N 474.326 0.944 50 20 JCGD CC(=O)O[C@@H](C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(C)C 1815343995 BACQTBVARQJPII-MAUKXSAKSA-N 459.333 0.636 50 20 JCGD CCOc1cnc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)cn1 1816133403 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C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1830539114 BIBAYMHQZUPRPC-SIFCLUCFSA-N 498.378 0.082 50 20 JCGD O=C(c1cccc(OCC(F)(F)F)n1)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830723941 ACXGMUIVZXOYSM-KSSFIOAISA-N 481.855 0.692 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)[C@H](O)CCl)CCO4)c2n1 1830731507 KGQRMUHZTYJYBZ-FOIQADDNSA-N 452.895 0.241 50 20 JCGD C=CC[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830738921 VKVIYEACSZWXSK-JLHGSKIFSA-N 489.997 0.902 50 20 JCGD N#Cc1ccc(CC(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1833106543 IASPNGZXFUBQET-UHFFFAOYSA-N 474.370 0.666 50 20 JCGD CC(C)c1nc(CC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)no1 1833785931 SANJMMJLERELSU-UHFFFAOYSA-N 477.610 0.680 50 20 JCGD O=C(CCBr)N1CCO[C@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1834826822 XSZNRQZQTBKSDB-MRXNPFEDSA-N 480.406 0.088 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3nc4ccccn4n3)CC2)CC1 1835736929 KSBLYJHNJCTMPY-UHFFFAOYSA-N 491.556 0.227 50 20 JCGD Nc1nc2cc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)ccc2s1 1835783360 FYNWLTZJXOAROQ-AUUYWEPGSA-N 454.936 0.548 50 20 JCGD CCOc1ccccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835931147 HLARLZSUWHHMJI-DEOSSOPVSA-N 468.315 0.149 50 20 JCGD C[C@@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)CN(C)C(=O)C(=O)O)CC2)CC1 1836673187 CFLALHWWEYNTHG-ZDUSSCGKSA-N 476.368 0.559 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)C(=O)Nc3cccnc3)C2)C1 1837715219 CSHAJJDUSRSDQT-FQEVSTJZSA-N 450.568 0.328 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc(Cl)ncn3)CC2)CC1 1837919309 WYUBENJORGGXCD-UHFFFAOYSA-N 472.738 0.736 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(N(C)C)cc1)CCO2 1838964069 OMFWCCQAHPEUML-HSZRJFAPSA-N 461.563 0.196 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nc3ccccc3o1)CCO2 1839503253 NCEMCOPFRJYCHJ-QFIPXVFZSA-N 459.503 0.271 50 20 JCGD C[C@@H](C#N)c1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c1 1840186662 CJWGTZUBWQPRMN-UUOWRZLLSA-N 471.558 0.757 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CCOC[C@]2(C1)CN(C(=O)C(Cl)Cl)CCO2 1840190377 UJQVZALKCJSRGZ-HNNXBMFYSA-N 456.373 0.107 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C#N)(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CC1 1843012015 VICUYWMFUMVHRY-UHFFFAOYSA-N 496.373 0.724 50 20 JCGD C#CCCC(=O)N1CC2(CCCN2C(=O)[C@H](Cc2ccc(B(O)O)cc2)NC(=O)OC(C)(C)C)C1 1843428863 VCKDJJKREXBNGZ-FQEVSTJZSA-N 483.374 0.419 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844264944 ATRCXBLSPUOTOP-UHFFFAOYSA-N 451.462 0.911 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@@H](O)CCNC(=O)OC(C)(C)C)C1 1845222121 NLMJTZAFZVBHLL-AEIQVQRHSA-N 490.561 0.600 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CN(C(=O)OC(C)(C)C)[C@@H]3CCO[C@H]23)C1 1846184771 LAXOOJVNGWBIDG-SQGPQFPESA-N 493.605 0.587 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)NCc1cccc(OCCN2CCOCC2)c1 725874328 YPVKZHCCFABVNB-UHFFFAOYSA-N 461.544 0.720 50 20 JCGD Cc1cccc([C@H](CC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)NC(N)=O)c1 728322464 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HJOFCCUCPWVVKF-UHFFFAOYSA-N 463.516 0.897 50 20 JCGD NC(=O)c1ccc(OCC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)cc1 920502119 JPCPKICDJMYHNB-UHFFFAOYSA-N 460.512 0.800 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1778165687 CRLSSWWYUNNJGW-BTYIYWSLSA-N 450.923 0.424 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2c(c1)OCO2 1778438872 HQGJYNJFEXKVJA-ZJSXRUAMSA-N 466.299 0.536 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)n1 1779033756 DHOUZRAONXQULP-DEOSSOPVSA-N 466.542 0.773 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](C)Nc2cnccn2)C1 1779389587 KKBLYKAFEWIPMM-MYMNMAMJSA-N 496.572 0.925 50 20 JCGD Cc1oncc1C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780969548 HVXPSYZFHNLKKW-HSZRJFAPSA-N 470.530 0.773 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc[nH]n3)C2)C1 1782789296 ARVFCIWMXMQOTN-MGPUTAFESA-N 455.943 0.914 50 20 JCGD 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O=C(C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccco1 1837109896 JXBZLVYNFHZOJF-UHFFFAOYSA-N 454.288 0.455 50 20 JCGD CN(C)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837327368 KDVCVHVGWOSJAH-UHFFFAOYSA-N 480.374 0.753 50 20 JCGD C[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cccc1C=O 1837919412 NYLVNEFDIDDAGS-SFHVURJKSA-N 481.358 0.854 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(OC)nn3)CCO2)C1 1838352811 STLFLQNBZGBWMA-ACJLOTCBSA-N 457.325 0.729 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)CO[Si](C)(C)C)CC2)CC1 1838357576 HZEKKCZNLMFZIH-GOSISDBHSA-N 459.616 0.901 50 20 JCGD COCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528216 LVGNYQREAHTRKT-FQEVSTJZSA-N 451.432 0.237 50 20 JCGD COC(=O)C12CC(C(=O)N3CCC(OC4CCN(C(=O)CCC(=O)NN(C)C)CC4)CC3)(C1)C2 1838770203 MWAKISRYVSBBPS-UHFFFAOYSA-N 478.590 0.701 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(C)ccc1O)CCO2 1838892658 TVGDUKBWNBRWRQ-MSIOFZDNSA-N 483.525 0.905 50 20 JCGD CC(C)Cc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1839404609 FOGLMFGTOBLCDQ-SANMLTNESA-N 480.370 0.949 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(C#N)cc1Cl)CCO2 1839424875 GVJJYJHBYKIQFX-QFIPXVFZSA-N 477.949 0.655 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)nc2nccn12 1839550698 ZCCFVMZGQHNAFX-RDTXWAMCSA-N 470.299 0.798 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4n(n3)CCCN(C)C4)CCO2)C1 1839622484 HFZNQKDHMAXMTB-UWJYYQICSA-N 453.971 0.806 50 20 JCGD CC(=O)NCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](Br)Cc1ccccc1)CCO2 1839802325 SNZRYBGEEFQELN-WIYYLYMNSA-N 482.375 0.585 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C[C@](C)(O)CC(=O)O)C2)C1 1839966721 ODOWUJHYZCJYDM-DOPJRALCSA-N 465.341 0.232 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@H]1C(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1840141016 SLOOXXFYQXBJMJ-QINHECLXSA-N 473.364 0.983 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)nc3C(F)(F)F)C2)C1 1840153270 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CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)[C@@H](Cl)COC)C2 1847046108 XGBQANADDRQRKI-UONOGXRCSA-N 461.943 0.900 50 20 JCGD CS(=O)(=O)CC[C@@H](NC(=O)c1ccc(Cl)cc1)C(=O)NNC(=O)[C@@H]1COc2ccccc2O1 21191481 XEKPHOAJABWCHN-QAPCUYQASA-N 495.941 0.861 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCN2C(=O)OCC(F)(F)F)c1 727800334 YFCLWPIAEMMZDW-ZDUSSCGKSA-N 466.438 0.861 50 20 JCGD CC(C)C(=O)N1CCC(C(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cc2)CC1 728213459 CCRGIQFMVMRYHJ-UHFFFAOYSA-N 451.593 0.960 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc2c(c1)C(=O)N(CCc1ccccc1)C2=O 729274946 HXSYAUJJCQGCRT-CYBMUJFWSA-N 458.496 0.224 50 20 JCGD O=C(CCCc1ccc2c(c1)CC(=O)N2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 729295474 KWNGNSIGQNDYRK-UHFFFAOYSA-N 486.550 0.986 50 20 JCGD N#Cc1cccc(S(=O)(=O)NCC(=O)OCC(=O)NNC(=O)c2ccc(Cl)cc2)c1 769760778 QWKUZSZBZLCJNM-UHFFFAOYSA-N 450.860 0.494 50 20 JCGD O=C(COC(=O)CCCn1c(=O)oc2ccccc21)NNC(=O)[C@@H]1COc2ccccc2O1 777229296 JVVMYTGTHADNMU-SFHVURJKSA-N 455.423 0.905 50 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462.315 0.458 50 20 JCGD Cc1cnc(Cl)c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c1 1786984466 JMJOVYNQNVDPJW-SNRMKQJTSA-N 457.723 0.630 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(CS(C)(=O)=O)nc3)[C@H]2C1 1787251057 FTIYRNOCTDOVHG-DKIMLUQUSA-N 473.979 0.473 50 20 JCGD COC(=O)[C@@H](CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1)NC(=O)OC(C)(C)C 1787448731 AJBYDIDTNDKGMX-HAFSJTIUSA-N 479.933 0.957 50 20 JCGD Cn1c(=O)c2c(CC(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]4C3)csc2n(C)c1=O 1787449224 NXPMPMLWXIFLPV-SDPXSBNPSA-N 486.953 0.355 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](C)N3C[C@@H]4C[C@H]4C3)C[C@@H]21 1787508853 WWAXFEUXZDSIDW-JLHWXSJXSA-N 470.574 0.440 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CC(=O)Nc3cc(C)on3)C[C@@H]21 1787509086 RPQGNSDKMBRVDC-HRZAHRDASA-N 499.528 0.425 50 20 JCGD Cc1cc(C(=O)NCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](C)Br)C[C@@H]32)no1 1788672145 SRLXPZJJQRATBT-ABHRYQDASA-N 457.325 0.476 50 20 JCGD CS(=O)(=O)CCC(=O)NC1(c2ccc(NC(=O)c3cnccc3C(=O)NN)cc2)CCC1 1789523714 PDJCLPQAAOUECO-UHFFFAOYSA-N 459.528 0.868 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@]3(NC(=O)OC(C)(C)C)CCOC3)[C@H]2C1 1789912742 RHYZRGCRQGOSQM-YSVRDODPSA-N 489.997 0.904 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](C)Br)[C@H]2C1 1791056028 MBJKQLKJXMZBHC-RLPSOPLKSA-N 463.325 0.244 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccc4sccc4c3=O)C[C@@H]21 1791287938 FKRIBEVZJKWDMZ-SZMVWBNQSA-N 489.598 0.416 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(S(C)(=O)=O)ccc3F)C[C@@H]21 1791293759 IDJGNFJTZGALRC-FNHZYXHNSA-N 498.577 0.196 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](F)(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)C1 1792981574 NEJGNAZNXILSNB-YJVQVXSTSA-N 463.934 0.525 50 20 JCGD Cc1nn(C)c(C)c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1793526849 OHBMMTGFFHWJMH-JHDGKUDLSA-N 497.600 0.586 50 20 JCGD 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NC(=O)c1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)cc1 1807375213 QMLUUBUHXWYIMO-IRLDBZIGSA-N 472.310 0.494 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)[C@@H]2CC[C@@H]3CCC(=O)N3C2)[C@@H]1c1cccnc1 1807744559 XKCMYRCRCJHCEK-FIXDAVPBSA-N 484.601 0.861 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@@H](CNC(=O)c2cc(=O)n3[nH]nnc3n2)[C@H]1c1cccnc1 1807951212 YNQZZVVGXQWQBP-HEHGZKQESA-N 489.334 0.701 50 20 JCGD N[C@@H](Cc1cscn1)C(=O)N1CCC2(CCCN(C(=O)c3ccc(B(O)O)cc3)C2)CC1 1809967132 XRWBRHOCKAXTQF-IBGZPJMESA-N 456.377 0.238 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)N1C[C@H]2C[C@@H]2C1 1810156447 HHCMHFWFLOVZRI-WXYBFKHDSA-N 462.359 0.421 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCn2ccnn2)[C@@H]1c1cccnc1 1810307566 DXABWFLPIMGQPQ-OXJNMPFZSA-N 463.502 0.082 50 20 JCGD Cc1c(C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)cn2[nH]cnc(=O)c12 1811302621 ATSYZQIATZZOTC-YXJHDRRASA-N 458.906 0.645 50 20 JCGD C[C@H](C(=O)N1CC[C@H](CNC(=O)CCC(=O)NN(C)C)[C@H]1c1cccnc1)[C@H]1SC(=N)NC1=O 1813070965 OVDHDCFYKGOZSE-LLBUTXAOSA-N 489.602 0.263 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1 1814403355 QOTRMYYJNITMFD-FMICNJIVSA-N 457.516 0.468 50 20 JCGD Cc1cnn([C@H](C)C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)c1 1815361762 QYVUXNIUYAHUNO-CJNGLKHVSA-N 453.333 0.815 50 20 JCGD COCCn1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)n1 1818260313 ZNNWFBQTMFYLBO-GOSISDBHSA-N 481.517 0.871 50 20 JCGD O=C(c1cccn2c(O)nnc12)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059128 FITMVSVGLKQOFM-HXUWFJFHSA-N 477.330 0.662 50 20 JCGD O=C(Cn1ccnn1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551101 ITOUTBYLLGLNPW-XMSQKQJNSA-N 490.948 0.330 50 20 JCGD O=C(CCc1ccc2c(c1)OCO2)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830723529 PCHGWVSBLJDGIQ-KKSFZXQISA-N 454.907 0.404 50 20 JCGD O=C(C[C@@H]1COc2ccccc2O1)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725562 JZAUCNDLJVVELA-WHSLLNHNSA-N 454.907 0.273 50 20 JCGD O=C(C[C@@H]1COc2ccccc2O1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830725567 JZAUCNDLJVVELA-ZOCZFRKYSA-N 454.907 0.273 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCOC[C@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1)c1ccc(F)cc1 1830733482 NFSJKGTXIYEDKH-OPYAIIAOSA-N 471.913 0.059 50 20 JCGD O=C(c1cccc(OCC(F)(F)F)n1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1833425493 SQFRSWQYAFRPLS-KSSFIOAISA-N 481.855 0.692 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(N3CCOCC3)cn1)CCO2 1833615036 UZYBVTRYMLUDIF-NRFANRHFSA-N 497.390 0.773 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(Cl)nn3)CC2)CC1)c1cccc(B(O)O)c1 1834801330 YGWCYFBJGFSNHQ-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CCc3cccc(O)c3)CC2)CC1)c1cccc(B(O)O)c1 1834801512 RCZXOYUBVTXVDN-UHFFFAOYSA-N 479.386 0.890 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCS(=O)(=O)c3ccccc3)CCO2)C1 1835146268 MKKJLGXPGBHMBZ-WIYYLYMNSA-N 488.990 0.561 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738082 CNNAUCJKPVAILD-MRXNPFEDSA-N 459.595 0.211 50 20 JCGD COc1nccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)c1F 1836237812 IRMZXECYWZRXPV-DYVFJYSZSA-N 464.263 0.990 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)/C=C/c3ccsc3)C2)C1 1837456427 HUFHIYKACIZWEQ-BIWRPXHWSA-N 471.539 0.530 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C2)C1 1837710289 SUXWNAQGEIACEX-OYHNWAKOSA-N 494.621 0.301 50 20 JCGD CC[C@H](Br)C(=O)N1CCC(OC2CCN(C(=O)CC[C@@H](N)C(N)=O)CC2)CC1 1837883208 WGLAPGDTADLKSG-JKSUJKDBSA-N 461.401 0.751 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cc(O)nc(O)c3)CC2)CC1 1837919359 IWSZWBZONAVSAB-UHFFFAOYSA-N 469.303 0.099 50 20 JCGD CCN(C)[C@H](C)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)CCO2)C1 1838528081 DLMYELKQTNHDOC-MWTRTKDXSA-N 492.529 0.930 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)C[C@@](C)(O)CC(=O)O)C2)C1 1839966724 ODOWUJHYZCJYDM-VHSSKADRSA-N 465.341 0.232 50 20 JCGD Cc1cnc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@@H](C)Br)CCO4)cnn2c1 1840033719 NPHNJIMQPJNYJP-AUUYWEPGSA-N 466.336 0.891 50 20 JCGD Cc1cnc2c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)[C@H](C)Br)CCO4)cnn2c1 1840033720 NPHNJIMQPJNYJP-IFXJQAMLSA-N 466.336 0.891 50 20 JCGD COc1ccnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)c1OC 1840034735 VZZBNGIOWSKKKH-BFUOFWGJSA-N 472.336 0.952 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnn(-c4cccnc4)c3)C2)C1 1840150069 GBZDZKYJTIGAGH-NQIIRXRSSA-N 463.922 0.591 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCN(C)C4)C2)C1 1840154800 GZLCRUCNMGZLLD-LAUBAEHRSA-N 469.970 0.042 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(NC(C)=O)c3)C2)C1 1840156953 YQLLUCXEIFFSOH-WIYYLYMNSA-N 453.923 0.969 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(OC(F)F)cc3)C2)C1 1840184760 AFYXRHUQNMJLTK-QFIPXVFZSA-N 484.500 0.731 50 20 JCGD O=C([C@@H]1CCCN1Cc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840313219 YOZBEPUOAUWVCI-JTAQYXEDSA-N 465.978 0.707 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1840427027 RZGRBKVIKMEKBT-JCKWVBRZSA-N 460.300 0.996 50 20 JCGD O=C(c1ccc([N+](=O)[O-])c2c1OCO2)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843014556 YBNCGBYQNMXDLH-UHFFFAOYSA-N 453.216 0.134 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015543 NRYKDJVTAMTOIR-OALUTQOASA-N 471.363 0.877 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1845948191 YBLVXHDVNIRZJG-UHFFFAOYSA-N 477.326 0.452 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)CC2)c(C)c1 15639708 AQQXSLQQQRMCHF-MRXNPFEDSA-N 457.574 0.286 50 20 JCGD COc1ccc(OCC(=O)NNC(=O)NCCC(=O)N2CCN(c3ccccn3)CC2)cc1 748467919 WOPDRASCQZXNHJ-UHFFFAOYSA-N 456.503 0.538 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)n(C)c1 760844296 RXLCNEGYWZTSRB-SFHVURJKSA-N 494.526 0.200 50 20 JCGD COc1ccc(C(=O)NNC(=O)CCN2CCN(c3ccccc3)CC2)cc1-n1cnnn1 857430696 UTHXPONADKHRQL-UHFFFAOYSA-N 450.503 0.644 50 20 JCGD O=C(NCCCN1C(=O)NC2(CCCCC2)C1=O)NNC(=O)c1csc(N2CCOCC2)n1 913638462 RJYYSFYCKIUORM-UHFFFAOYSA-N 479.563 0.569 50 20 JCGD CC(C)(CNC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)N1CCOCC1 915894243 JIKABPMENQMLQU-UHFFFAOYSA-N 497.618 0.081 50 20 JCGD COc1ccc(NC(C)=O)cc1S(=O)(=O)NNC(=O)c1cccc(S(=O)(=O)N(C)C)c1 916110394 KCTCUASDHJQLSK-UHFFFAOYSA-N 470.529 0.527 50 20 JCGD CCN1CCN(CCCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1 916503728 JVCACFFFLCZIFA-UHFFFAOYSA-N 480.635 0.833 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCN2CCN(c3ccccc3)CC2)c1 916515042 YSNQOUMKYQQAEQ-UHFFFAOYSA-N 474.587 0.703 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2[nH]nnc2C)C1 1777742385 GCBZWPANAQSSGZ-LXPZDEJYSA-N 456.507 0.375 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nc3ccccn3n1)C2 1778090851 DDLPVMJMEQUUPW-PDHFBFRESA-N 492.540 0.991 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc(F)cnc3Cl)C2)C1 1779451707 OMFDAROECUASLD-FQEVSTJZSA-N 462.869 0.630 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1779557081 XCCAQNXWKWGJAE-VMUDFCTBSA-N 452.321 0.342 50 20 JCGD COc1cc(C(=O)N2CC[C@@]3(CN(C(=O)CN(C)NC(=O)NCc4ccccc4)CCO3)C2)nn1C 1780435086 QTLNDRBHZQRXCC-XMMPIXPASA-N 499.572 0.218 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)Cc3ccc4ncnn4c3)C2)C1 1780950541 XFVGHMXJTLBXCO-PVPASAESSA-N 478.513 0.236 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cc(O)c(O)c(Cl)c1 1781122735 HZSMMCWMJWQQCV-AUSIDOKSSA-N 488.733 0.872 50 20 JCGD CC(C)(C)OC(=O)NCC[C@@H](O)C(=O)N1CC[C@@]2(CN(C(=O)CCBr)CCO2)C1 1781338166 WBROIQOFFPBRJX-AUUYWEPGSA-N 478.384 0.877 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCBr)C2)[C@@H]1CCCS1(=O)=O 1781650708 WVKLIVMNNHXMCZ-JJRVBVJISA-N 451.383 0.863 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(=O)c1cccnc1)C2 1782172404 URSJUSBKOMGWFG-CBGDNZLLSA-N 452.939 0.579 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2n1 1782574981 RGYBLXCAMJGUET-XMMPIXPASA-N 462.315 0.388 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@]2(CN(C(=O)CN3C(=O)CSC3=S)CCO2)C1 1783354958 ZNGSQNOCUVXZKE-ZBEGNZNMSA-N 464.407 0.850 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)C13CC(NC(=O)OC(C)(C)C)(C1)C3)CCO2 1783936490 ILSSMLDGUQDZRR-KXTRFFEISA-N 493.605 0.637 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1)C1CC1 1784091295 ZEPUMIAENAVXBV-KSWRQPAISA-N 459.971 0.869 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCc4ccccc4[C@H]3O)[C@H]2C1 1784151035 CZBILTOABVTHTA-CMUWLQQYSA-N 493.564 0.574 50 20 JCGD Cc1nccn1CCCC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1784409635 MABPBVLJIUJVGT-JOCHJYFZSA-N 455.519 0.114 50 20 JCGD COc1cccc(C(=O)N2CC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1C 1784922628 BHWXJWDZFJORKO-QHCPKHFHSA-N 453.499 0.759 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cnccc1C(=O)NN)CCO2 1785568856 LXNXCMMNDVRBGF-QHCPKHFHSA-N 490.561 0.434 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3ccc(Cl)c(F)c3)C[C@@H]21)c1cccc(B(O)O)c1 1786982668 CIQVGSNDEBDTRH-XERREHJYSA-N 490.724 0.831 50 20 JCGD Cc1ccc(COCC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1C 1787531475 VDTPLWIFEQXLHA-XWGVYQGASA-N 480.370 0.793 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cn(C)c4ncccc34)[C@H]2C1 1788465030 VBCQSPPZGHRSED-IEZWGBDMSA-N 456.547 0.540 50 20 JCGD C[C@@H](Sc1ccccn1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2C1 1788610894 CVYIALLDYXLRTQ-PDWMJMLSSA-N 484.582 0.854 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](F)Cl)C[C@@H]32)[C@@H](O)C1 1789812865 VQHQLGGFZBRDAM-QNILMXGZSA-N 463.934 0.728 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cccc(B(O)O)c1)C2 1793418185 ROLRMGYDQGXVBI-ACDBMABISA-N 489.378 0.550 50 20 JCGD CC(C)(C)OC(=O)CCCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795737734 OBSCDFXSFIJIMA-UPHUGPLXSA-N 460.336 0.082 50 20 JCGD C[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@](C)(Cl)CCl)C2)[C@@H]1SC(=N)NC1=O 1796427011 LXPDUYLODJJOAZ-CTZDEMLISA-N 451.376 0.615 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1796433001 UGGMVWAOTIVMQM-YVWYUNDQSA-N 467.482 0.187 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C=C/c1ccccc1[N+](=O)[O-])C2 1797756412 IMLIGFGNQYZQJG-CTSHNCOSSA-N 480.481 0.510 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2 1798263737 RAADXXYJRAGQGN-RGHULWKBSA-N 476.958 0.821 50 20 JCGD Cc1ncccc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799094639 AZEZYIMRHOIWEP-JHDGKUDLSA-N 480.569 0.939 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@]1(NC(=O)OC(C)(C)C)CCOC1 1799333467 IGSNEFDIACAAQL-VPEYGQHGSA-N 475.970 0.514 50 20 JCGD CN(C)C(=O)NCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800433416 KAMUNJCQUHRPSB-SFNKJDCFSA-N 481.391 0.853 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCn1c(=O)oc3ccccc31)C2 1800974110 KTBKNPZJEQAWHY-YGTYGHESSA-N 451.907 0.828 50 20 JCGD CN(C)NC(=O)CCC(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)[C@@H]1[C@@H](O)CCN1Cc1ccccc1)C2 1802338056 JLECPJATFYJZLN-KEVRVKNQSA-N 471.602 0.633 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1CCC(=O)N1C(=O)OC(C)(C)C 1802619008 QSWSKDFWJODYRQ-YVSFHVDLSA-N 479.578 0.924 50 20 JCGD C[C@](O)(C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)C(F)(F)F 1803994002 KJHVRUYJNDWSOJ-AUJRIZCKSA-N 480.447 0.713 50 20 JCGD O=C(CCNC(=O)c1ccc[nH]1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1804460828 LOEPXAZSZMRLOJ-XXBNENTESA-N 489.341 0.229 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807361169 PFMDUYZLBDVKSM-GCJKJVERSA-N 460.299 0.094 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375194 PUTDHKUIZHMENF-HYBUGGRVSA-N 475.358 0.674 50 20 JCGD O=C(CSc1ncccn1)N1CCC2(CCCN(C(=O)c3cccc(B(O)O)c3)C2)CC1 1809976527 AMDFHYYFOGNSBU-UHFFFAOYSA-N 454.361 0.794 50 20 JCGD CC(=O)N/C(C)=C/C(=O)N1CC[C@@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810304934 HQBZKZQIFNTUDP-RDAFILGESA-N 465.514 0.440 50 20 JCGD COc1cc(C(=O)NC[C@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1C 1811629441 VKAGIEMMTYYFIA-DYESRHJHSA-N 463.303 0.137 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc(C(N)=O)cc2)[C@H]1c1cccnc1 1813738130 NWPDPAAJZQIJRN-WIYYLYMNSA-N 487.520 0.812 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CNC(=O)N(C)C)n[nH]1 1814563360 XCZAPVHBOHUCQF-WJNWYLSZSA-N 471.522 0.807 50 20 JCGD CC(=O)Nc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)o1 1815356694 LRSBFQUZJCKTHA-CQSZACIVSA-N 468.300 0.914 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1)c1ccc(B(O)O)cc1 1817471803 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C[C@H](CN)C(=O)N[C@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822518361 NKOWETYFASJSSF-ZBFHGGJFSA-N 473.603 0.996 50 20 JCGD C[C@H](O)C(=O)N[C@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822519012 ZVSQRZCNLHLRGJ-ZFWWWQNUSA-N 460.560 0.782 50 20 JCGD CN(C)c1ncc(C(=O)N2CCC([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)o1 1827056112 OXJIXEGKJCUTAE-LJQANCHMSA-N 454.336 0.968 50 20 JCGD O=C(c1nc[nH]n1)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551070 HFESHOWVJPATAA-IIBYNOLFSA-N 476.921 0.470 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnn4c3CCC4)C2)C1 1830543750 BSLBCASERXSSID-KUHUBIRLSA-N 455.353 0.930 50 20 JCGD O=C(c1cnc2cc(Cl)ccn12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830724529 XXMUZYCSNYRNQJ-KXBFYZLASA-N 457.314 0.657 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)CC1 1831286514 XZWMBUXJQQNZGN-QZTJIDSGSA-N 456.609 0.556 50 20 JCGD COc1ccc(CCC(=O)NC2CCN(C3CCN(C(=O)CCC(=O)NN(C)C)CC3)CC2)cn1 1833736654 IHOSAQMKGIDKTO-UHFFFAOYSA-N 488.633 0.967 50 20 JCGD Cc1nn(C)c(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)c1F 1834028953 ORZAFXROUPJENV-UHFFFAOYSA-N 486.552 0.365 50 20 JCGD Cc1ncccc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834145921 WUAKYMKYGVWWHB-UHFFFAOYSA-N 465.558 0.888 50 20 JCGD O=C(CCBr)NC1CCN(C2CCN(C(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1834421111 GFAVOPKVOAALAO-UHFFFAOYSA-N 481.395 0.597 50 20 JCGD COc1cc(C#N)cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834798453 YBJKCCQPDMXCGA-UHFFFAOYSA-N 490.369 0.746 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cncc(F)c3)CC2)CC1)c1cccc(B(O)O)c1 1834801251 VUTYKIFWUIVFGG-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](N)Cc3cccnc3)CC2)CC1 1835097820 UALBDTDCENNIBH-PMACEKPBSA-N 451.999 0.777 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3ncn(-c4ccccc4)n3)CC2)CC1 1835155804 KBPHWIWDWJKJTG-UHFFFAOYSA-N 496.616 0.826 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3CCOCC3)CCO2)C1 1835449739 QYDNOAWUPJCYKQ-QFBILLFUSA-N 462.385 0.339 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](Br)CC)CC2)CC1 1835645370 HMUUROCTVAFFSM-WBVHZDCISA-N 477.400 0.796 50 20 JCGD O=C(CCc1ccsc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928147 FVLVKKNZQLPMMX-JOCHJYFZSA-N 458.345 0.131 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)c3cnn(C)c3Cl)CC2)CC1 1836043421 SJKVHUBDQBCWJH-UHFFFAOYSA-N 468.002 0.632 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cc(F)ccc3[nH]1)CCO2 1836806953 IFHWFNRQHAHUOC-HSZRJFAPSA-N 475.521 0.750 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4nncn4c3)CCO2)C1 1837011427 BMXCEKSLSALTDN-IFXJQAMLSA-N 466.336 0.830 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn(C)c4ncccc34)CCO2)C1 1837191633 SKLAEBAEVYIXJY-UWJYYQICSA-N 450.923 0.897 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3cc([N+](=O)[O-])cn3)C2)C1 1837710021 CNKWNWJCXANAOI-GOSISDBHSA-N 455.544 0.099 50 20 JCGD O=C(/C=N/O[C@H]1CCCCO1)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919118 GJLZJBFMNADMER-OINMWHHXSA-N 487.362 0.508 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920790 FJZMPIUVSGWSAK-XZOQPEGZSA-N 498.385 0.734 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)[C@@H](C)Br)CC2)CC1 1838433815 BJEQJSKWTAFAIG-CXAGYDPISA-N 462.385 0.920 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCOCCOCCOCCOC)C2)C1 1839147486 RYQUJMGDPYJUDT-DENIHFKCSA-N 495.013 0.547 50 20 JCGD C=C(CC(=O)OCC)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1839173549 XXAQYLQFLNKLBL-DNVCBOLYSA-N 461.353 0.983 50 20 JCGD C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839184943 IPEQDDWZDBCFEA-GSHUGGBRSA-N 489.997 0.902 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1)CCO2 1839354132 KRSWOYONMLZUSK-NRFANRHFSA-N 481.481 0.177 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839683335 YRSVCXZTEHPFAX-VEAUEKORSA-N 493.517 0.138 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3NC(C)=O)C2)C1 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COc1ccc(C(=O)NNC(=O)CCN2C[C@H](C)O[C@H](C)C2)cc1S(=O)(=O)N1CCCC1 912921394 PDRSKNBZGVMABP-IYBDPMFKSA-N 468.576 0.740 50 20 JCGD C[C@@H](CO)NS(=O)(=O)c1ccc(C(=O)OCC(=O)NNC(=O)c2cccc(Cl)c2)cc1 915484548 VGUWGJRUNJKTKS-LBPRGKRZSA-N 469.903 0.617 50 20 JCGD Cc1cccc(N2CCN(S(=O)(=O)CC(=O)NNC(=O)c3ccc(Cl)nc3)CC2)c1 919814918 VXOYUCFYPKAZNA-UHFFFAOYSA-N 451.936 0.956 50 20 JCGD N#CCCn1cc(/C=C(/C#N)C(=O)NNC(=O)N[C@H]2CCS(=O)(=O)C2)c(-c2ccccc2)n1 919887332 ZZMRIFMJQDZFLD-QMJOVRGKSA-N 467.511 0.888 50 20 JCGD CN(C)N(C(=O)C1CCN(c2ccc3nnc(C(F)(F)F)n3n2)CC1)[C@@H]1CCS(=O)(=O)C1 1337123784 VHEFLRNBOCCFSU-CYBMUJFWSA-N 475.497 0.852 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cccn2cncc12 1779130707 QVZIFJRRLXRCMW-ZJSXRUAMSA-N 462.315 0.455 50 20 JCGD Cc1ncsc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779371065 MCMSEQTUIZYJNE-IIBYNOLFSA-N 458.544 0.891 50 20 JCGD CCCC(=O)N[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1779517796 LDUBPUQPBSLAGO-OMXJDXKCSA-N 474.562 0.117 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3ncccc3C(F)(F)F)C2)C1 1779708302 WSFYCZSADTTXHE-HXUWFJFHSA-N 463.221 0.538 50 20 JCGD COc1nc(C)ccc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1779846704 GIVYDUKNQUKDJP-HYBUGGRVSA-N 467.331 0.520 50 20 JCGD COCc1c[nH]c(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c1 1780047346 VWXJEKYIRZPNPY-NFBKMPQASA-N 455.320 0.282 50 20 JCGD COc1cc(C(=O)N2CC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)c([N+](=O)[O-])cc1O 1780198125 TZGYWKXMBAOPFY-NRFANRHFSA-N 479.490 0.126 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](F)Br)C1 1780777070 MGMOSQGVOFCMIH-MDNXKNQGSA-N 453.305 0.807 50 20 JCGD CC1=C(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)CCO1 1780968719 DQZNONAJBASTNF-DEOSSOPVSA-N 471.558 0.857 50 20 JCGD CN1CCCn2nc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C4)cc2C1 1781429294 FIXFOZKUOZYOPY-HYBUGGRVSA-N 489.621 0.219 50 20 JCGD C[C@H](C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)[S@](=O)c1ccccc1 1781499197 HOCIUOAGMVGBIF-ZGIUMOBXSA-N 498.410 0.690 50 20 JCGD C[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1781997745 HBGDUZMIUVGDBX-IOHHAYIISA-N 468.352 0.596 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)c3onc4ccccc34)C2)C1 1782346722 OQIYGSOBNYYWDN-JOCHJYFZSA-N 450.455 0.584 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](Br)Cc1ccccc1)CCO2)C(=O)C(=O)O 1782754438 QTPZXBYHRHTMQC-HRAATJIYSA-N 496.358 0.366 50 20 JCGD CS(=O)(=O)CC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1783021907 DULARQCMXCIRBB-LPHOPBHVSA-N 473.389 0.867 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CCBr)[C@H]2C1)[C@H]1SC(=N)NC1=O 1786405867 HKYSCBFGJXJXTB-CUOUOBHDSA-N 461.382 0.554 50 20 JCGD CCOc1cnc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)cn1 1787508646 FHZLCIOVNDKWHB-BRZMCFHBSA-N 483.529 0.603 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1791236082 ZNQGOENPANECJI-QHOFPYNOSA-N 485.541 0.034 50 20 JCGD COc1cccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)c1F 1791292168 BYHQUNOMAQGVTA-ZVZYQTTQSA-N 450.511 0.801 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)CC2=O)c1 1792971418 JAGTZUBVHXARRN-KZWXMACTSA-N 465.934 0.237 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](O)CCl)CC1 1792983375 JHNGJLSTJLNMBT-YVSFHVDLSA-N 459.971 0.823 50 20 JCGD CC(C)(C)OC(=O)N1CC2(C[C@@H](C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](O)CCl)CO2)C1 1792984352 YLWPHMCDAIQHKL-UHDSXZAQSA-N 487.981 0.202 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C1(O)CCN(C(=O)OC(C)(C)C)CC1 1793668989 UMHZCMADBCMSEA-YYIAUSFCSA-N 489.997 0.592 50 20 JCGD COC(=O)CSCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878267 MASRSMSDGBOGRT-LOUJCGABSA-N 494.010 0.614 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCn1c(=O)oc2ccccc21 1793985299 LZQKVGXLDJGULP-YGTYGHESSA-N 451.907 0.828 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)CCBr)ccc21 1795114474 NJDUXJLFMJNDQW-ZSBFGKGUSA-N 465.348 0.865 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc3cccnc3cc1F)C2)c1ccc(B(O)O)cc1 1795735306 XPVWPLAYADLPTF-NHKMSHSESA-N 477.301 0.500 50 20 JCGD CN(CC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)Cc1ccn(C)n1)NC(=O)NCc1ccccc1 1796251359 SDZWCOQKVYQRHH-WKCHPHFGSA-N 467.574 0.947 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCOCC2)cc1 1796491239 KLXKJSNBFHFQBL-BBIADKPPSA-N 473.574 0.099 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccnn1-c1ccccc1)C2 1797750771 PRIBFHGMHUNPCN-VPTLXERWSA-N 475.509 0.388 50 20 JCGD Cn1c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)cc2c[nH]c3nccc-3c21 1798482521 OZBPGXODBFZTNL-UPHUGPLXSA-N 487.325 0.203 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(-n3cncn3)c2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807373013 LYZVRRTXHJRQRS-ZJSXRUAMSA-N 496.336 0.976 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)COC(=O)C(F)(F)F)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374965 LTOHTQWQHCGQIJ-QAPCUYQASA-N 479.220 0.187 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H](CNC(=O)[C@@H](N)CN)[C@@H]1c1cccnc1 1808268602 YUJNDJVEIWFZGL-BPAFIMBUSA-N 470.486 0.521 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccnc1 1810293727 GMMYZYOHEYXVGI-MGPUTAFESA-N 493.484 0.205 50 20 JCGD O=C1CCc2ccc(C(=O)N3CCCC4(CCN(C(=O)c5ccc(B(O)O)cc5)CC4)C3)nc2N1 1810482780 ROUIJXCBEWRZFJ-UHFFFAOYSA-N 476.342 0.805 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815344014 BLBKJLDZPAEYCT-INIZCTEOSA-N 495.370 0.349 50 20 JCGD CC(C)(CCl)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816669209 ZHFNOLGSQSMVHE-MRVPVSSYSA-N 450.912 0.760 50 20 JCGD Cc1nc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3ccc(B(O)O)cc3)n[nH]2)c(=O)[nH]c1C 1817471061 QOJIHIBRXQWYNO-KRWDZBQOSA-N 464.291 0.409 50 20 JCGD COCCn1ccc(C(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)[nH]n2)n1 1818259494 NJEFKABKXZMGSA-LJQANCHMSA-N 466.307 0.552 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)CNC(=O)c1cccnc1)CC2 1819793036 IGWKXDLTNJEZHJ-ZDUSSCGKSA-N 494.537 0.192 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc([N+](=O)[O-])[nH]1)CC2 1819797755 IUQYSQCOHGZGEQ-SECBINFHSA-N 470.471 0.918 50 20 JCGD CN1CCN(C2(C(=O)Nc3cc([C@@H]4CCCCN4C(=O)c4ccc(B(O)O)cc4)[nH]n3)CC2)CC1 1820795539 SGPBQTOGRFCPHQ-FQEVSTJZSA-N 480.378 0.175 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCS(C)(=O)=O)n[nH]1 1822970780 KQYWDUGJBKSHKY-OHHQFBAHSA-N 477.547 0.971 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cccc(B(O)O)c3)CC2)c1 1827056569 YSNAJNHHVNVTJI-QFIPXVFZSA-N 499.398 0.712 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059811 JGJYTKZIKIBYKD-GOSISDBHSA-N 489.428 0.460 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827059814 JGJYTKZIKIBYKD-SFHVURJKSA-N 489.428 0.460 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC([C@H]2CCCCN2C(=O)c2cnc3ncccn23)CC1 1828247926 JOJZTHCQAGUZCD-HXUWFJFHSA-N 461.331 0.956 50 20 JCGD CCN1CCC(C(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cccc(B(O)O)c2)CC3)CC1 1828348150 DRIIFDQHZMHNJN-QGZVFWFLSA-N 456.377 0.781 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)C(=O)Nc2cccnc2)CC1 1829043123 UBZBWICDWRYGDD-FQEVSTJZSA-N 479.541 0.952 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCN(C)CC3)C2)C1 1830537762 NVCRPGJSFUATNR-YLJYHZDGSA-N 475.428 0.111 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1N(C)C 1830733262 GOBAUXNGMOWISB-UTKZUKDTSA-N 455.939 0.431 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H]1CCCCC1(F)F)CCO2 1831718445 FIJLSRNLGWQRAY-DYESRHJHSA-N 481.500 0.581 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(c3ccc(F)cc3)CC1)CCO2 1832388734 HIXSZMDVIQSHBW-XMMPIXPASA-N 497.527 0.626 50 20 JCGD Cc1cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccn1 1832625567 DAGLFFIUHBJNPG-XMMPIXPASA-N 482.541 0.091 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1ccnc1 1833375249 BFLGSISRNXNVBH-QGZVFWFLSA-N 453.352 0.009 50 20 JCGD N[C@@H](Cc1cccnc1)C(=O)N1CCOC[C@]2(CN(C(=O)CCBr)CCO2)C1 1834821742 WNYIAYBIJSGCKP-LPHOPBHVSA-N 455.353 0.193 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CCC(N2CCC(NC(=O)[C@H](F)Cl)CC2)CC1 1835084059 JALQQOGDMBRNNF-GUYCJALGSA-N 454.934 0.701 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCC(N2CCC(NC(=O)/C(C)=N/NC(=O)c3ccc[nH]3)CC2)CC1 1835116243 DACIEMOVPDYXIF-WPWMEQJKSA-N 487.605 0.560 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H]3c3ccc(F)cc3)C2)C1 1835926298 LRGBNBNBPKAYNU-SGIRGMQISA-N 482.317 0.379 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1835932137 PXJAVYRKSFXFCD-DFBJGRDBSA-N 466.343 0.549 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3Cl)C2)C1 1835939710 YHENJCLUZLXGQD-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)[C@@]3(F)CCCC=C3F)C2)C1 1835940860 CCEUOQMAUUFNGB-FGZHOGPDSA-N 464.274 0.182 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(NC(C)=O)cc3)CCO2)C1 1836666267 CRXHDMPKYGVTSR-SIKLNZKXSA-N 467.950 0.898 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(F)ccc3Cl)C2)C1 1837460183 WZNJRALUHQMSML-JOCHJYFZSA-N 491.907 0.861 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839047307 JFGAUYMHCBWYOA-FOIQADDNSA-N 480.363 0.759 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C3=COCC3)C2)C1)NC(=O)NCc1ccccc1 1839054343 VDCZAVUACZMEBE-XMMPIXPASA-N 487.557 0.093 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c(O)c1OC 1839375799 MLJUXEWDRSZMLW-VBKZILBWSA-N 458.895 0.079 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CC(c3ccccc3)=NN1)CCO2 1839636330 MDTRRNLEMDUXMW-KPLVRAHFSA-N 464.950 0.463 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)Cn1cccc([N+](=O)[O-])c1=O)CCO2 1839718519 ZBRGVWJYJZMUGB-HXUWFJFHSA-N 482.566 0.064 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccccc1)CCO2 1840119708 PCEVUBSTABCKJC-RLSLOFABSA-N 479.537 0.559 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(S(C)(=O)=O)c3)C2)C1 1840149459 PKBXLQMPISCUOP-FXAWDEMLSA-N 474.963 0.414 50 20 JCGD CCc1nn(C)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](Cl)COC)CCO3)c1Cl 1840150403 KDCBGSSRLAIIMU-BFUOFWGJSA-N 463.362 0.960 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4cccnc4)[nH]n3)C2)C1 1840153206 HMZGUNVGHXPCGR-IERDGZPVSA-N 463.922 0.796 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cn(C)cc3C(F)(F)F)C2)C1 1840184182 BPUHWSIJTMMSNU-HXUWFJFHSA-N 489.495 0.487 50 20 JCGD O=C(C1CCN(Cc2ccccn2)CC1)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013401 FHVUUNLIKYBMKZ-UHFFFAOYSA-N 462.359 0.491 50 20 JCGD CCc1[nH]nc(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)c1I 1843110727 NLQSSIZCGSLXOR-SNVBAGLBSA-N 466.707 0.993 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cccc(=O)n1C)C2)NC(=O)NCc1ccccc1 1845038597 XDOFVSWFULXXHM-UHFFFAOYSA-N 466.542 0.549 50 20 JCGD Cc1nn2cc(CC(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cnccc3C(=O)NN)nc2s1 1847975650 QVZMWIBDYJOYIR-HOTGVXAUSA-N 454.516 0.156 50 20 JCGD O=C(NNC(=O)c1csc(N2CCOCC2)n1)c1cccc(S(=O)(=O)NC2CC2)c1 12804291 REPNSIJGMFRLQN-UHFFFAOYSA-N 451.530 0.495 50 20 JCGD O=C(NNC(=O)[C@H]1CCS(=O)(=O)C1)/C(=C/c1cccs1)n1nnnc1-c1ccccc1 15639673 VMWWCFUYPRWQHO-HNDQUVLASA-N 458.525 0.982 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(C)c(NC(=S)NNC(=O)[C@@H]2CCS(=O)(=O)C2)c1 18946253 YQWLYKYAXUSNKU-CYBMUJFWSA-N 462.619 0.778 50 20 JCGD CNS(=O)(=O)c1cccc([C@H](C)NC(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)c1 727608363 OXAZFJKCOUZYLK-HNNXBMFYSA-N 497.599 0.615 50 20 JCGD C[C@H]1Oc2ccccc2N(CC(=O)NNC(=O)c2ccc(Cl)c(S(N)(=O)=O)c2)C1=O 811957013 SKBWHSVGGMYNIN-SNVBAGLBSA-N 452.876 0.563 50 20 JCGD O=C(CN1CCCC1=O)NN=Cc1c(Sc2nnnn2-c2ccccc2)nc2ccccn2c1=O 818260489 FOMLXVUCNFIUJZ-UHFFFAOYSA-N 489.521 0.894 50 20 JCGD CS(=O)(=O)NC1(CNC(=O)NNC(=O)c2nn(-c3ccccc3)cc2O)CCCCC1 916254087 XVZOJCGHOVAKRU-UHFFFAOYSA-N 450.521 0.774 50 20 JCGD CCN1CCN(Cc2ccc(CNC(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)cc2)CC1 916418950 VHTNFOMBXORXRC-UHFFFAOYSA-N 463.546 0.944 50 20 JCGD Cn1nnnc1SCCC(=O)NNC(=O)c1ccc(Cn2nnc(-c3ccccc3)n2)cc1 918009027 ZRIHTZJWOSFISG-UHFFFAOYSA-N 464.515 0.855 50 20 JCGD O=C(CNC(=O)c1ccc(F)c(F)c1)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 918278922 IYWDDPORUOFFMN-UHFFFAOYSA-N 482.465 0.177 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2n[nH]c3c2CS(=O)(=O)C3)C1 1777716117 JHSLJMNOQJGEQY-OXQOHEQNSA-N 484.651 0.817 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnc4sc(C)cn4c3=O)C2)C1 1777990927 ZCFXPIGFRRWBJB-IFXJQAMLSA-N 454.936 0.762 50 20 JCGD O=C(Cc1ccc2c(c1)CCCO2)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1778264084 LWXLCJJPIJYYOF-VWLOTQADSA-N 464.327 0.378 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H]3CNc4ccccc4O3)CCO2)C1 1779032721 WVNHTVZWKQFMCP-VOIUYBSRSA-N 480.525 0.392 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CNC(N)=O)C2 1780055126 CPZLNAHRKMQBJI-DYESRHJHSA-N 477.474 0.316 50 20 JCGD CC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CS(=O)(=O)N1CCCC1)C2 1780702643 NTCUJNQBGOQDMW-GPMSIDNRSA-N 450.001 0.943 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)COCCO)C1 1780764911 IYKJTOQDIKQEMI-DENIHFKCSA-N 479.486 0.657 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3CC[C@H]4CCC(=O)N4C3)C2)C1 1781054395 LXOHNGVMYKGMOF-PSNCYSJKSA-N 484.557 0.351 50 20 JCGD N#Cc1ccccc1OCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1783135325 ZSLYFMYTGCLGBY-PXDATVDWSA-N 492.536 0.763 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(-c3ccc(O)nn3)cc1)CCO2 1783935140 PUJANWPMQZLKPD-DEOSSOPVSA-N 482.541 0.666 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(-c3ccccn3)[nH]n1)CCO2 1783935412 RCWGXELSDCABCI-QFIPXVFZSA-N 455.519 0.288 50 20 JCGD COc1ccc(C(=O)N2CC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(Cl)c1 1785122019 XKKACTTXKYAUJA-JOCHJYFZSA-N 458.707 0.786 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)Cc3cc(F)ccc3[N+](=O)[O-])C2)C1 1785532073 LWHHPXTZELYDMD-OAQYLSRUSA-N 465.482 0.479 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cn3ccnc3)[C@H]2C1)NC(=O)NCc1ccccc1 1786161831 ZFLUDDXBQVFDPG-ACRUOGEOSA-N 483.573 0.209 50 20 JCGD CSc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)cc1 1786986509 JMUACLINBZHVQT-NYVOZVTQSA-N 468.384 0.924 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Cl)[C@H]2C1 1787443583 MPXMAZUIBJQFLX-RMEBNNNOSA-N 451.923 0.776 50 20 JCGD CCc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)/C(C)=N/NC(=O)c4ccc[nH]4)[C@H]3C2)nn1C 1787508626 LYJCQPBIEFDSIV-AYOAJRLASA-N 469.546 0.710 50 20 JCGD CC(C)(C)OC(=O)N1CCCO[C@@H](C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@H](O)CCl)C[C@@H]32)C1 1788090771 ACSXORXLTGGXRY-IECFSIQFSA-N 489.997 0.592 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1NC(C)=O 1789277460 ZGRFANXVCRBOOF-LEDOBFOHSA-N 495.341 0.241 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(N4CCOCC4)c3)[C@H]2C1 1790118892 UBIXYBPNYHRNOU-BVSLBCMMSA-N 487.601 0.490 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3CCN(S(C)(=O)=O)CC3)C[C@@H]21 1790961024 FVDFBILMYIMIFF-NXOAAHMSSA-N 494.452 0.811 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)ccc1C 1791293799 JVMCTNDDRLVMKY-ZJOUEHCJSA-N 473.574 0.920 50 20 JCGD CC(C)(CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(N3CCCNC(=O)C3)n1)C2 1792784342 LXYMLFXHMVTMHB-CWPLJXCYSA-N 477.993 0.876 50 20 JCGD C[C@H](CBr)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(S(C)(=O)=O)CC1)C2 1792871320 UZJCTEJCNVZLQM-DMRZNYOFSA-N 480.425 0.279 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(=O)cco1 1794998458 DROGLXZDNIYHEQ-YXPYIKCWSA-N 469.922 0.975 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC#N 1795856341 KFRXMXNPCJNJAV-WOZUAGRISA-N 498.389 0.744 50 20 JCGD C[C@@H](NC(=O)c1ccc(F)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cccc(B(O)O)c1 1796191618 FZRSZUOHNQBXBP-MSPZUWAUSA-N 467.306 0.576 50 20 JCGD Cn1ncc(I)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](F)Cl 1796365658 WRLYYOMGHWDJRL-UJYYTQATSA-N 470.670 0.762 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](C)NC(=O)OC(C)(C)C)C2 1796440386 WFNDIDKXHNNHIP-XTQXAXBPSA-N 490.561 0.623 50 20 JCGD COC(=O)[C@@H]1CCC[C@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1796445587 FGCJWBBVMLCXIO-PUCRAGRTSA-N 487.557 0.689 50 20 JCGD CCS(=O)(=O)N[C@H](C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)/C(C)=N/NC(=O)c1ccc[nH]1 1796890878 NXCAKFJVHNPBPD-OTLZKRIBSA-N 466.564 0.086 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CC1(OC)CN(C(=O)OC(C)(C)C)C1 1797155551 VNBRPHYDCRCLMM-KYHPRHEASA-N 489.997 0.856 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](F)C[C@H]1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2 1797677948 LGANRCREQFGVHY-OBKDMQGPSA-N 489.353 0.966 50 20 JCGD COC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797955915 ORBOOORPYHERSV-KYHPRHEASA-N 473.643 0.967 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ncn(-c3ccccc3)n1)C2 1798440133 CCRBLHCCBWRUAJ-ACHSLPGTSA-N 460.498 0.831 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](C)NC(=O)c1ccc(F)cc1 1799050709 TXPVRKJYTOSUAS-QMQAMEMWSA-N 455.914 0.787 50 20 JCGD NC(=O)CC[C@H](N)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800436594 YYAKGOJEWDMZEK-OYNZLANYSA-N 481.391 0.175 50 20 JCGD COc1cccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1C 1800820445 SODSQTWISGUGFS-FAQVEIGNSA-N 467.526 0.448 50 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1810295103 QFENNLHFZIFOBY-HRAATJIYSA-N 462.514 0.756 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)c2ccco2)[C@@H]1c1cccnc1 1810295718 WIXREIOWAIREEW-BEVDRBHNSA-N 464.482 0.726 50 20 JCGD Cc1nnsc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1810303632 UFKIYDPAFCFQCT-RHSMWYFYSA-N 466.527 0.873 50 20 JCGD CC(=O)OC[C@H](OC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)[C@@H](O)CCl)[C@@H]1c1cccnc1 1810339186 MEDIKRKTNXIPRI-XLAORIBOSA-N 455.895 0.182 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2c(O)cc(O)cc2O)[C@@H]1c1cccnc1 1811432627 BNDXBDNWIVEMIN-QRQCRPRQSA-N 471.514 0.891 50 20 JCGD Cc1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)c(O)n1 1811481218 DSLXUQRTFDLWOK-RXVVDRJESA-N 460.299 0.804 50 20 JCGD CN(CC(=O)N1CC[C@@H](CNC(=O)CCC(N)=O)[C@@H]1c1cccnc1)NC(=O)NCc1ccccc1 1812633142 MPAUUAFPSQLKBZ-RDPSFJRHSA-N 495.584 0.699 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc(=O)ccn2C)[C@@H]1c1cccnc1 1813072411 CWYRJTGTTSJFDR-VGOFRKELSA-N 454.531 0.473 50 20 JCGD N[C@@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1ccc(B(O)O)cc1)CC2)c1ccccn1 1815011997 PJAISEGOEJUGEO-RDTXWAMCSA-N 451.317 0.144 50 20 JCGD COc1ccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)cn1 1815336952 IALVJIVPRSXOPN-OAHLLOKOSA-N 452.301 0.766 50 20 JCGD C[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361934 UXQXTLSHSPOEHF-SKDRFNHKSA-N 452.139 0.832 50 20 JCGD O=C(Cc1ccc(F)cn1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1815502359 SVDDANNEPFERKW-MRXNPFEDSA-N 454.292 0.826 50 20 JCGD O=C1Cc2cc(C(=O)Nc3nc4c(s3)C[C@H](NC(=O)c3ccc(B(O)O)cc3)CC4)ccc2N1 1818923832 LZGWTYVQSFNEOC-MRXNPFEDSA-N 476.323 0.857 50 20 JCGD CC(=O)Nc1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)o1 1819784467 AKBOTWXZWJYXEE-AWEZNQCLSA-N 468.300 0.914 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1821661541 OAQLNSPWWPEWIO-YJBOKZPZSA-N 484.561 0.988 50 20 JCGD COCCOCCOCCOCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1 1822263752 BYEDJPMHXMQMBA-IAGOWNOFSA-N 476.958 0.698 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H]2CCCS2(=O)=O)[nH]n1 1822416570 IICWHBDIUMDLJE-HUUCEWRRSA-N 454.553 0.352 50 20 JCGD CNC(=O)CC(=O)N[C@@H]1CCc2nc(NC(=O)CN(C)NC(=O)NCc3ccccc3)sc2C1 1822518771 SXOOIIKHIAJZKY-OAHLLOKOSA-N 487.586 0.537 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cn3ncccc3n1)CC2 1826085890 FDGKLIYQOBXDIA-GFCCVEGCSA-N 456.532 0.785 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1nc(O)n3c1CCCC3)CC2 1826088017 NNVBXFPEWAWSFG-GFCCVEGCSA-N 475.575 0.980 50 20 JCGD O=C(Cn1ccccc1=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052954 QDBBPWBEECPOBG-NRFANRHFSA-N 451.332 0.462 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1827680928 YMDRFXJHSCPZHN-YGYFLSRZSA-N 493.373 0.734 50 20 JCGD NC[C@H](N)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(Cl)Cl)C2)C1 1829050510 QZWDSLZTUIPUGI-MGPUTAFESA-N 472.373 0.528 50 20 JCGD O=C(c1c[nH]c2nccc-2c1Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830727906 KMBNDYQOAPRGIC-AUUYWEPGSA-N 457.314 0.838 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CCOC[C@@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830737899 JVFHKSZFVNWWFK-RZTYQLBFSA-N 487.981 0.442 50 20 JCGD COC(=O)c1ccccc1CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1830888324 QIVDJQMLAPDPIU-GCJKJVERSA-N 468.934 0.462 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@H]1F)CCO2 1832126774 MGHSGAIXKDLMOV-LDBYXDLTSA-N 465.434 0.948 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)Cc3cnccn3)CC2)CC1 1833370861 MPMWBBNWBVCIJV-STBIYBPSSA-N 480.573 0.725 50 20 JCGD Cc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1 1835083143 QPMNTOSTHCSUBV-DEOSSOPVSA-N 467.526 0.306 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)c1F 1835490669 LLQMRQPVQWDKBH-YUNKPMOVSA-N 478.876 0.652 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)[C@H]3C[C@@H]3C3CC3)CC2)CC1 1835734630 NPRCARZXOYTTMR-UXHICEINSA-N 454.575 0.916 50 20 JCGD O=C(c1ccc2ncccc2c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835928403 OAEOCJYIAPIFIL-RUZDIDTESA-N 475.310 0.298 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(Cl)cc4)CC3)C2)C1 1835931948 IRWBOYQNNAJBEQ-DEOSSOPVSA-N 498.772 0.822 50 20 JCGD COc1c(C)cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1C 1835939750 ZVEPPHWZKIXSBG-VWLOTQADSA-N 482.342 0.376 50 20 JCGD COc1nc(C)ccc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1835999568 YRXGQEHWXYCGBE-UHFFFAOYSA-N 480.374 0.577 50 20 JCGD Cc1nc(N)sc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837892777 ICZRAENZDCOLTB-UHFFFAOYSA-N 472.376 0.640 50 20 JCGD O=C([C@@H](F)Br)N1CCO[C@]2(COCCN(C(=O)[C@H]3Cc4ccccc4CN3)C2)C1 1839199852 XBROGSNPYATYMZ-HLIPFELVSA-N 470.339 0.848 50 20 JCGD Cc1c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)cn2[nH]cnc(=O)c12 1839200639 NQJMUMNOHDKGEO-KDOFPFPSSA-N 486.298 0.092 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(n3)OCCO4)C2)C1 1840152760 SFBNNUNBVWUKAM-XOBRGWDASA-N 455.895 0.177 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(Cl)c4nncn4c3)C2)C1 1840153050 BJIYMKWIBBBKGY-DNVCBOLYSA-N 472.329 0.707 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(C#N)cc3Cl)C2)C1 1840185893 ZRHLWFMXZWAQFD-QFIPXVFZSA-N 477.949 0.655 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cnccn3)CCO2)C1 1840455795 UFQBGEMJLSRCRJ-DNVCBOLYSA-N 455.353 0.897 50 20 JCGD CC(C)N(CC(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)C(=O)OC(C)(C)C 1841119360 JEJGHMUKNCZKKR-UHFFFAOYSA-N 459.352 0.829 50 20 JCGD COc1ccc(Cn2cc(CC(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)cn2)cc1 1843013238 XFOXITHANPBKHC-UHFFFAOYSA-N 488.353 0.680 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)cc1 1844265145 YKSNDUZKCVVOLJ-UHFFFAOYSA-N 494.552 0.607 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)c2ccc(N3CCCOC3=O)cc2)C1 1845532474 CCHQIAMZTIZPMU-UHFFFAOYSA-N 463.299 0.844 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CO[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]31)C2 1846385929 MWIPMTURJNELIH-FGTMMUONSA-N 493.605 0.445 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@H](O)CCl 1847564441 WIQRFRPZBBFQJG-YHUYYLMFSA-N 455.943 0.647 50 20 JCGD Cc1noc(C)c1S(=O)(=O)N1CCC(C(=O)NNC(=O)CCN2C[C@@H](C)O[C@H](C)C2)CC1 10889193 LJZNCJOCUIMICO-ZIAGYGMSSA-N 471.580 0.339 50 20 JCGD Cc1nc(S(=O)(=O)NCCC(=O)NNC(=O)c2ccc(Br)s2)cn1C 725879106 BRNYSECBYIBDDG-UHFFFAOYSA-N 450.340 0.682 50 20 JCGD COc1ccc(CCN2C[C@@H](C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)CC2=O)cc1OC 728179390 KHLCGCYIJABXTG-DLBZAZTESA-N 453.561 0.587 50 20 JCGD O=C(COC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21)NNC(=O)[C@H]1COc2ccccc2O1 728326108 CNEIAVUXPFGXTL-QGZVFWFLSA-N 455.383 0.475 50 20 JCGD Cc1ncsc1C(=O)NNC(=O)N1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)CC1 729510731 JWECKPGWYOEFNT-UHFFFAOYSA-N 454.490 0.721 50 20 JCGD O=C(CSc1nnc(N2CCOCC2)n1C[C@H]1CCCO1)NNC(=O)c1cccc([N+](=O)[O-])c1 827873253 PTAZAGXQWMOCTM-MRXNPFEDSA-N 491.530 0.755 50 20 JCGD C[C@H]1CCCCN1C(=O)CN1CCN(C(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 913462873 FQBSHZPATKADSR-INIZCTEOSA-N 479.607 0.353 50 20 JCGD O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1 914830854 CHPGUOTVZNYJLT-LSDHHAIUSA-N 462.553 0.536 50 20 JCGD C[C@@H](NC(=O)C1CCCCC1)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 918446172 LRTHKWLMCNQPJC-QGZVFWFLSA-N 494.614 0.873 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(c2ccccc2Br)C1)N[C@@H]1CCS(=O)(=O)C1 919885983 OPIUVNDSKHJCGC-WDEREUQCSA-N 459.322 0.320 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](C)N1C[C@H]3C[C@H]3C1)C2 1778090875 FNUFYUKEOCLVNU-MWZFPKGBSA-N 484.601 0.975 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)Cc1ccc(O)cn1)C2 1778094740 MJHNUANWEKAHGR-UQPPNZDLSA-N 482.541 0.978 50 20 JCGD Cc1cc(C)n2ncc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C4)c2n1 1778560792 NSCHOYQFWRGGMM-NTKDMRAZSA-N 485.589 0.847 50 20 JCGD Cn1ccc2cccc(C(=O)N3CCO[C@@]4(CCN(C(=O)c5cnccc5C(=O)NN)C4)C3)c21 1779032077 LJSCAGIPFGGURI-XMMPIXPASA-N 462.510 0.934 50 20 JCGD CCNC(=O)N[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H](F)Br)C2 1779321700 HZPIMUYEESJVKW-SFDCBXKLSA-N 451.337 0.898 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](C)n1ccnn1)CCO2 1780098272 HHGUEVHNXBZOPT-QKKBWIMNSA-N 472.458 0.816 50 20 JCGD CCNC(=S)NCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](F)Br)C2 1781473551 AABVDKZZSLBARN-PVXIVEMSSA-N 453.378 0.675 50 20 JCGD Cc1cc(C(=O)N2CCO[C@@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)n(-c2ccccc2)n1 1783934168 BCGVRTGUEGQUQX-XMMPIXPASA-N 468.558 0.997 50 20 JCGD CC1=NN(c2ccc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]4C3)cc2)C(=O)C1 1784092291 GKHKTXLEHCMBAQ-WNHJNPCNSA-N 462.934 0.992 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CO[Si](C)(C)C)C[C@@H]21 1787393648 VMOLJNCCYHPQMW-QAETUUGQSA-N 473.643 0.703 50 20 JCGD CC(C)(C)c1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)[nH]n1 1788914109 ARMAOZCJMLFZIJ-OWQGQXMQSA-N 469.546 0.613 50 20 JCGD C[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1ccc(O)cc1 1789884887 ODXLMYUDKIVSCU-UYIIBVGGSA-N 452.316 0.469 50 20 JCGD COC(=O)Nc1cccc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1 1789981895 SGLANNCEFXRGCD-YYWHXJBOSA-N 481.314 0.452 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](C)NC(=O)c3ccccn3)[C@H]2C1 1790587814 OLOHLPHXLVWVRS-DNCCFGNJSA-N 452.939 0.433 50 20 JCGD Cc1cn(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)[C@@H](C)Br)C[C@@H]32)c(=O)nc1O 1792132322 GHAKAYAKSGKKPB-RFGFWPKPSA-N 457.325 0.020 50 20 JCGD COC[C@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CCN(C(=O)OC(C)(C)C)C[C@@H]1O 1792451320 IAAVIOFWXCOSDI-COZGXFGHSA-N 489.997 0.448 50 20 JCGD O=C1CC[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](Br)Cc2ccccc2)C3)N1 1795391751 XSPOFKXZQIHBNY-KMOPNRPKSA-N 464.360 0.861 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccc(B(O)O)cc1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C(F)F 1795558796 NNGTUQPRWAFKSS-MHORFTMASA-N 495.332 0.706 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c[nH]c3nccc-3c1Cl)C2)c1ccc(B(O)O)cc1 1795734417 HDYUUUQFBYDNCS-HBCWATKFSA-N 468.706 0.365 50 20 JCGD CC(C)(C)OC(=O)N[C@@]1(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)CCOC1 1796188597 YLKNGRGNHLRQRX-YDLHNXBPSA-N 487.362 0.302 50 20 JCGD C[C@H](CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2)NC(=O)OC(C)(C)C 1796388574 LSHKMVSAWPQGLH-BKEDOTJMSA-N 490.561 0.192 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(=O)NCC(C)C)C2 1798522307 OITNRFCKSRCRRO-CCWDJLKJSA-N 476.486 0.496 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(O)c(O)c(Cl)c1)C2 1801012476 IHCVJFFNIRTKNA-IVWMJMPLSA-N 454.911 0.327 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1 1801352314 QGJFYUUJNBRQFW-KOUNCHBCSA-N 493.369 0.723 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2 1802134157 LIMYQJQRYQAVIX-RMCNWUJSSA-N 457.955 0.574 50 20 JCGD CC(C)(C)OC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)CCl)[C@H]1c1cccnc1 1803142063 XAQLUSWSKFYCBS-JYYAWHABSA-N 456.927 0.530 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807366899 VRQBXUNAIGCEKS-SCWSEQNSSA-N 496.373 0.994 50 20 JCGD O=C1Cc2cccc(C(=O)N3CC[C@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)c2N1 1807367747 VHZFLOJWYOKMQK-NTKDMRAZSA-N 484.321 0.889 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n(C)n1 1807369411 IZPJWASSFOMJSA-LAUBAEHRSA-N 463.303 0.137 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc3n(n2)CCCNC3=O)[C@H]1c1cccnc1 1813071445 SDCZZJAZRAPIEG-JTSKRJEESA-N 496.572 0.104 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1813412994 LPDBRXAJFFIJCI-PLMTUMEDSA-N 476.541 0.933 50 20 JCGD COc1cccc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)n1 1815337293 QYSUNBAFAMPYFY-CQSZACIVSA-N 452.301 0.766 50 20 JCGD COc1nn(C)cc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1816310953 ZKBSLWTYRIDTQH-QGZVFWFLSA-N 452.280 0.451 50 20 JCGD COC(=O)C12CC(C(=O)N3CCCC[C@H]3c3cc(NC(=O)c4cccc(B(O)O)c4)n[nH]3)(C1)C2 1817479495 NYIZDGXFLKAOLV-YTZBPGPESA-N 466.303 0.739 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CNC(=O)c2ccco2)n[nH]1 1817602510 WQXKEBRSYOQIOV-MRXNPFEDSA-N 480.485 0.737 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1)c1cc2cn[nH]c2cn1 1819232965 PZSJJWMGMGDAFK-LJQANCHMSA-N 459.275 0.981 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819797726 IJAXJUOIJWIYBJ-BDJLRTHQSA-N 458.544 0.941 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cccc(B(O)O)c1)CC2)n1ccccc1=O 1820125065 NQIRTLPYURRKJJ-CJNGLKHVSA-N 466.328 0.472 50 20 JCGD C[C@H](CS(C)(=O)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822410405 IYDWZNPFJQHRSB-HIFRSBDPSA-N 456.569 0.456 50 20 JCGD COC[C@@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cn1cc(C)c(O)nc1=O)CC2 1826008446 BIUCPNGFIIQXHH-GHMZBOCLSA-N 455.924 0.580 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827058236 UJHWGVKKBLRZPD-OXQOHEQNSA-N 458.368 0.307 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cnc(O)nc2O)CC1 1827590434 LGCNXZIATXWLIY-QGZVFWFLSA-N 469.502 0.433 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CS(=O)(=O)N2CCCC2)CC1 1827678768 RVVLHPMQSMOLJA-IBGZPJMESA-N 485.651 0.405 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CC[C@]2(CN(C(=O)C(O)O)CCN2C(=O)OCc2ccccc2)C1 1828524969 IZCCSMOCDPRJHZ-RTWAWAEBSA-N 488.368 0.986 50 20 JCGD CCOC(=O)c1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)c1F 1830730740 DGDSKFBSPKJVFV-IERDGZPVSA-N 472.897 0.672 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C1 1830733410 LIVKGPCJHKNUFT-GSHUGGBRSA-N 489.997 0.690 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3cccc(F)c3)CC1)CCO2 1832367196 OOWYWNLXPFDRNZ-QHCPKHFHSA-N 476.549 0.687 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1 1833574171 ZEMBPBGUUWXLRJ-SJKOYZFVSA-N 461.288 0.636 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)CCN(C)C)CC2)CC1 1834615877 WENQNSKADKRTIZ-YZSQISJMSA-N 459.595 0.644 50 20 JCGD NC[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccccc1 1834759084 BMJPEBAIVPOJOF-DEOSSOPVSA-N 478.402 0.294 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc([N+](=O)[O-])cc3F)CC2)CC1)c1ccc(B(O)O)cc1 1834798414 SIKYDPNYFVIDNI-UHFFFAOYSA-N 498.320 0.913 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)C#Cc3ccccc3)CC2)CC1)c1cccc(B(O)O)c1 1834801216 ULPQUUORMZKCDX-UHFFFAOYSA-N 459.355 0.603 50 20 JCGD COc1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)cc1 1834801252 UBTWEENQMICTBJ-UHFFFAOYSA-N 465.359 0.874 50 20 JCGD O=C(c1ccnc(C(F)F)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835935655 XURRQEGKMHKNGF-JOCHJYFZSA-N 475.257 0.083 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c1 1835939987 ROCLKIMRSGIBQO-REJWQLKLSA-N 480.326 0.158 50 20 JCGD CCC(=O)C(=O)N1CCC(N2CCC(NC(=O)CN(C)NC(=O)NCc3ccccc3)CC2)CC1 1836343927 RDSCLZUMEPJWNK-UHFFFAOYSA-N 486.617 0.883 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc(O)nc3O)CC2)CC1)[C@H](F)Br 1836412789 UXQHDNMXOKTHQU-ZDUSSCGKSA-N 460.304 0.764 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnn4cccnc34)CCO2)C1 1836850284 KNEIKMWHAPYVSA-BEFAXECRSA-N 466.336 0.973 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3cnccc3[nH]1)CCO2 1837102209 ZWWVBGGIVSAHGN-SWOYFSSUSA-N 493.524 0.767 50 20 JCGD Cc1c(F)ccc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)c1N 1837457977 ZITNYVOTZIUGJZ-QHCPKHFHSA-N 486.504 0.099 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC(OC2CCN(C(=O)c3cncc(F)c3)CC2)CC1 1837522604 RUQQVEDXQORFIY-UHFFFAOYSA-N 455.295 0.827 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3n[nH]cc3[N+](=O)[O-])CCO2)C1 1837799025 MMEKBGFYRUVNKE-ZBEGNZNMSA-N 460.285 0.561 50 20 JCGD Cc1nccn1CCCC(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837920791 FLWPYUXPQSAJHT-UHFFFAOYSA-N 482.390 0.964 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837921399 HEQLBCQXIXFZBT-UHFFFAOYSA-N 489.378 0.503 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(OC2CCN(C(=O)CN(CCO)CCO)CC2)CC1 1838432128 WIFLCJJEAPWBDX-UHFFFAOYSA-N 459.660 0.123 50 20 JCGD COc1ccnc(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)c1OC 1838841691 IVQOEUTYACQULY-BFUOFWGJSA-N 472.336 0.952 50 20 JCGD Cc1cccc(C)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1839368000 AHMAUWSAMWAKFS-XMMPIXPASA-N 452.316 0.367 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1839964770 BXDNZQVJDHQXPP-VBKZILBWSA-N 498.378 0.260 50 20 JCGD CCOC(=O)C1(C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](Br)CC)CCO3)C2)CC1 1839966630 LGGSXBYORPWJFC-KDOFPFPSSA-N 461.353 0.960 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C2)C1 1840033571 JTPMEBIUSJXWQD-RBZFPXEDSA-N 482.331 0.871 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C/c3ccc([N+](=O)[O-])o3)C2)C1 1840150367 KEEUIIOEPRDOOL-CILJEUCVSA-N 457.867 0.911 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CN(Cc4ccccc4)CCO3)C2)C1 1840153110 DPCQUFSRQKYGBN-HFMPRLQTSA-N 496.004 0.598 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3cccc(C#N)c3)C2)C1 1840182665 PMGMVFIQYFYJLM-DEOSSOPVSA-N 471.558 0.320 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1840184919 CHQXSJNPMCPATL-DEOSSOPVSA-N 484.557 0.520 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CC1 1840796927 VFJXSGUXBAAOKA-VGOFRKELSA-N 487.981 0.610 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)c2nnc3cc(C)nn3c2C)C1 1843697434 DETFTQJEMTZRFV-ZVHZXABRSA-N 463.502 0.692 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1843868132 AZIWCGFZFVTVOD-QHCPKHFHSA-N 471.363 0.831 50 20 JCGD CC(C)(C)OC(=O)N[C@]1(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)CCOC1 1844264925 YTJDDOTURKTANF-HSZRJFAPSA-N 488.545 0.186 50 20 JCGD COC(=O)c1ccc(C(=O)N2CC3(CCCN3C(=O)c3cnccc3C(=O)NN)C2)c([N+](=O)[O-])c1 1844264999 JGKBOLMEMLJALS-UHFFFAOYSA-N 482.453 0.511 50 20 JCGD COC[C@H](Cl)C(=O)N1CCCC12CN(C(=O)[C@@H](CCS(C)(=O)=O)NC(=O)OC(C)(C)C)C2 1846364716 GHCKVLDVTCXYKW-LSDHHAIUSA-N 496.026 0.772 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@@H]1C[C@](C)(O)CN1C(=O)OC(C)(C)C)C2 1846386071 ZUDKXYCBIFEFOJ-AOMKIAJQSA-N 481.594 0.323 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CC[C@H]4[C@@H]3CCN4C(=O)c3cnccc3C(=O)NN)CC2=O)c1 1847214074 PHZJYTYAEPPKPB-NQERJWCQSA-N 492.536 0.562 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCc2ccc(S(N)(=O)=O)cc2)cc1 17406643 OUXYXKNVEFUHHL-UHFFFAOYSA-N 468.557 0.043 50 20 JCGD Cn1cc(S(=O)(=O)N2CCOCC2)cc1C(=O)NNC(=O)c1cc(-c2ccccc2)n[nH]1 17519500 QGJIKZQGZXQGAN-UHFFFAOYSA-N 458.500 0.511 50 20 JCGD Cn1cccc1C(=O)NNC(=O)c1ccc(C(=O)NNC(=O)c2cccn2C)c([N+](=O)[O-])c1 728203511 KKIMFGDCTVEJAB-UHFFFAOYSA-N 453.415 0.421 50 20 JCGD Cc1ccc(S(=O)(=O)NCCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1C 728889339 CUAFDPMREJBEQS-UHFFFAOYSA-N 460.560 0.826 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)N1CCC[C@@H](NS(=O)(=O)c2cccc(F)c2)C1 729499368 QLXQTYJHIMTAEO-CQSZACIVSA-N 483.547 0.801 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H](C)CSC)c(=O)n2Cc1ccccc1 731340824 MIRKDBRJHOKENM-CQSZACIVSA-N 458.544 0.574 50 20 JCGD O=C(COC(=O)Cn1nc(-c2ccccc2)oc1=O)NNC(=O)[C@@H]1COc2ccccc2O1 746189628 ZMURJABBHBCPSH-INIZCTEOSA-N 454.395 0.034 50 20 JCGD Cc1cc(CN2C(=O)c3ccccc3C2=O)cc(C(=O)NNC(=O)C(=O)N2CCCC2)c1O 748342984 IKLLOVOIXLXWDO-UHFFFAOYSA-N 450.451 0.880 50 20 JCGD O=C(CCNc1ccccc1[N+](=O)[O-])NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 842241051 XQFSAXMQHUPJJG-UHFFFAOYSA-N 477.499 0.879 50 20 JCGD CN1C(=C(C#N)C(=O)CCc2nc(-c3cn(CCO)c(=O)nc3O)no2)N(C)c2ccccc21 904862066 YAZUBGSWILXOEI-UHFFFAOYSA-N 463.454 0.814 50 20 JCGD Cc1c(C(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cnn1-c1ccccn1 914710679 AZYNNRHEHFLJHH-UHFFFAOYSA-N 498.565 0.990 50 20 JCGD O=C(Cc1nc(-c2ccccc2)cs1)NNC(=O)[C@H]1CC(=O)N([C@H]2CCS(=O)(=O)C2)C1 914830852 CHPGUOTVZNYJLT-GJZGRUSLSA-N 462.553 0.536 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NN=C1C(=O)Nc3cc(O)ccc31)c(=O)n2Cc1ccccc1 915948611 XDTPDOVSYYLOHR-UHFFFAOYSA-N 487.476 0.606 50 20 JCGD O=C(NCc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)c1ccc([N+](=O)[O-])cc1 916233353 UWTMMOXNCPKXGU-UHFFFAOYSA-N 469.501 0.821 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2cccc(NS(C)(=O)=O)c2)nc1 916246811 SEOGWPLXPQIYOY-UHFFFAOYSA-N 456.550 0.966 50 20 JCGD Cc1ccc([C@@H](CNC(=O)NNC(=O)c2ccc(-n3cnnn3)cc2)N2CCOCC2)cc1 918099124 KWFNWJNJNMXOIN-HXUWFJFHSA-N 450.503 0.988 50 20 JCGD O=C(COC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Cc1ccccc1F)NNC(=O)c1cccc(Cl)c1 919184019 VIAWHVBJRVOBOI-AEFFLSMTSA-N 477.876 0.988 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)CN3C(=O)CCC3=O)cc2)cc1 1317699873 ALBPMKNICBBIFG-UHFFFAOYSA-N 472.523 0.726 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(CCN(C(=O)c3nc4c(=O)[nH]c5ccccc5n4n3)C2)C1 1778057513 ZAPAVAQSTJCJDE-YEJXKQKISA-N 474.905 0.268 50 20 JCGD Cn1cc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)c2cccnc21 1779186591 RUFDAJXCDBMTJZ-PXDATVDWSA-N 476.342 0.694 50 20 JCGD C=C[C@@H](O)C(C)(C)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1 1779372394 GWIWOSGMJRWLIY-PMAPCBKXSA-N 459.547 0.386 50 20 JCGD CCSc1cccnc1C(=O)N1CC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1780463936 FUMCVTIBQHPGKP-QFIPXVFZSA-N 470.555 0.949 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CC[C@H]4OCCC[C@@]4(CNC(=O)[C@@H](F)Br)C3)cc21 1780774643 FXWYCKRGFMEEQF-SPYBWZPUSA-N 486.342 0.835 50 20 JCGD O=C(CCCn1c(O)nc2ccccc21)N1CC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1780919607 CJMAJGDELKHMMK-RUZDIDTESA-N 492.341 0.346 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccc(=O)oc1)CCO2)NC(=O)NCc1ccccc1 1780970270 SQYYIPOVQFEOLY-XMMPIXPASA-N 483.525 0.430 50 20 JCGD CN(C)[C@H](C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1)c1ccccc1Cl 1782830010 ADGZBOGLWIYVAZ-XUZZJYLKSA-N 485.777 0.766 50 20 JCGD CC[C@@H](CC(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1)NC(=O)OC(C)(C)C 1783934957 OHYYYDKGTDXTGS-GAJHUEQPSA-N 483.610 0.883 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783940109 QLXJKXNSOQHRRF-HYBUGGRVSA-N 491.564 0.076 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]2C1 1784094778 RMORPLJPIUFDAR-UNPPPGBBSA-N 471.982 0.965 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@](C)(O)C(F)(F)F)[C@H]2C1 1784874119 SPUNFEIOHAEPIR-OARUALHXSA-N 473.452 0.413 50 20 JCGD CN1C(=O)CC[C@H]1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785078912 DVOFUTMUFYXISK-WOYTXXSLSA-N 486.997 0.719 50 20 JCGD O=C(CCCc1ccncc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1785352987 KVKPLDISQUDTPJ-BVSLBCMMSA-N 451.332 0.378 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)[C@H]3C[C@H](NC(=O)OC(C)(C)C)C3)C2)C1 1785516003 XQMYGLKUZGFWFV-SEPYTNNBSA-N 481.594 0.493 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H](F)C[C@H]1C(=O)N1CC[C@@]2(CN(C(=O)[C@H](O)CCl)CCO2)C1 1785691026 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JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)C3=Cc4ccccc4NC(=O)C3)C2)C1 1840185322 KWKDKBYJBGNPPU-VWLOTQADSA-N 499.568 0.242 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CSCC(=O)O)CCO2)C1 1840193982 SBRSPDMPTDYZBI-LRDDRELGSA-N 453.355 0.434 50 20 JCGD Cc1cc(C)cc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1840306248 NKSVBIBBJPXIKV-AREMUKBSSA-N 480.370 0.686 50 20 JCGD CCNC(=S)NCC(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1 1841925290 IGMZZGOTEBPYPU-ZDUSSCGKSA-N 462.016 0.806 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)[C@@H](F)C1 1847724147 NZKDIKPUWVZBPU-FYQPLNBISA-N 489.353 0.777 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCCC[C@@H]2C)cc1C(=O)NNC(=O)[C@@H]1CCS(=O)(=O)C1 9930758 AUFNFDRSBHRTRI-LSDHHAIUSA-N 457.574 0.754 50 20 JCGD N#Cc1ccc(OCC(=O)NNC(=O)CCc2ccc(S(=O)(=O)N3CCOCC3)cc2)cc1 15889044 VTEKBNYYBWEODX-UHFFFAOYSA-N 472.523 0.738 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CN2C(=O)NC3(CCC(C)CC3)C2=O)cc1 17406214 ONZDRKAGVAHVQY-UHFFFAOYSA-N 479.559 0.264 50 20 JCGD COc1ccc(S(N)(=O)=O)cc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 17517312 JPTSSGDBEJLJSK-UHFFFAOYSA-N 482.540 0.202 50 20 JCGD CCn1nc(C(=O)NNC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2c1=O 23723140 JCEMCRMYSOMUOD-UHFFFAOYSA-N 452.427 0.906 50 20 JCGD CC1CCC(NS(=O)(=O)CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCC3)c2)CC1 116773512 SYZTXCHYTYXNTE-UHFFFAOYSA-N 486.616 0.730 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)OCC(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 728332970 VHCCZJLYEAQCGL-MRXNPFEDSA-N 452.416 0.373 50 20 JCGD COc1ccc(C(=O)NCC(=O)NNC(=O)C2CCN(c3ncccn3)CC2)cc1[N+](=O)[O-] 728981300 SGLNCEOVYFVCKL-UHFFFAOYSA-N 457.447 0.187 50 20 JCGD CS(=O)(=O)N1CCc2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc21 742637424 YVMBIODMCWAXLC-UHFFFAOYSA-N 462.440 0.535 50 20 JCGD CS(=O)(=O)CC[C@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)c1ccc(C#N)cc1 747175238 FKZILQHRJCJTNC-KRWDZBQOSA-N 464.525 0.101 50 20 JCGD O=C(Cc1ccc(S(=O)(=O)N2CCOCC2)s1)NNC(=O)c1cc(Br)c[nH]1 750844233 ZDBKFQDURSBWRU-UHFFFAOYSA-N 477.362 0.863 50 20 JCGD COc1cc(N2C[C@@H](C(=O)NNC(=O)CNC(=O)c3cccs3)CC2=O)cc(OC)c1OC 751208516 FRTRNKRRDYPZRQ-LBPRGKRZSA-N 476.511 0.704 50 20 JCGD Cc1cc(C)n(CC(=O)NNC(=O)CCn2c(=O)oc3cc(S(=O)(=O)N4CCCC4)ccc32)n1 769192439 BHXUQWKDLGQSJZ-UHFFFAOYSA-N 490.542 0.430 50 20 JCGD Cn1nc(C(=O)NNC(=O)NCCCN2C(=O)NC3(CCCCC3)C2=O)c2ccccc2c1=O 916268659 AMLZSICEEGWMCH-UHFFFAOYSA-N 469.502 0.522 50 20 JCGD CCCNC(=O)CN1CCC(NC(=O)NNc2ccc(S(=O)(=O)N(CC)CC)cn2)CC1 916518990 VMIFGHWQTIFNSR-UHFFFAOYSA-N 469.612 0.729 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)[C@@H]2CCN(c3ccc(F)cc3)C2=O)cc1 919689821 FBRYEIJBXCULKW-SFHVURJKSA-N 462.503 0.955 50 20 JCGD CCN(CC)C(=O)CNC(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 920814153 XWVYTSHESSVHTN-UHFFFAOYSA-N 461.544 0.978 50 20 JCGD Cc1ccccc1NCC(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779031770 XHXXHAUPURIVGY-QHCPKHFHSA-N 452.515 0.549 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2ccncc2O)C1 1779616911 RNBVLYOCJRPIJR-XMSQKQJNSA-N 454.487 0.227 50 20 JCGD Cc1c(C(=O)N2CC[C@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn2[nH]cnc(=O)c12 1780021732 NDEWHPGMJYPHKZ-XIKOKIGWSA-N 452.309 0.558 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(CCN(C(=O)c3cccc(-c4cnccn4)c3)C2)C1 1780184647 BHANGYUYAVFRCP-RUZDIDTESA-N 472.310 0.581 50 20 JCGD CN(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cc(F)cn1C)CCO2)NC(=O)NCc1ccccc1 1780968585 NZMCQRGAFBCFNR-DEOSSOPVSA-N 486.548 0.954 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@H](C(=O)N3CC[C@]4(CN(C(=O)[C@H](O)CCl)CCO4)C3)O[C@H]2C1 1783494774 NGMUJYFJBWQTDA-GQTOQBHESA-N 487.981 0.440 50 20 JCGD CCOc1ccc(CC(=O)N2CC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1OC 1783698645 IPIIDMPMWATOQC-VWLOTQADSA-N 482.342 0.460 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CO)NC(=O)OC(C)(C)C)C[C@@H]21 1783965319 HWBQJZGEOIKTGT-YXMSTPNBSA-N 492.411 0.883 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)CCN3C(=O)c4ccccc4C3=O)C[C@@H]21)[C@@H](O)CCl 1784085002 AOZSUVNZFZMBQT-MGHWNKPDSA-N 463.918 0.252 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCO)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](F)Br)C[C@@H]21 1784197044 CHYRVSLIOSVZMY-YYFQZIEXSA-N 496.374 0.932 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)Cc3cnn(C)c3)C2)C1)NC(=O)NCc1ccccc1 1784576811 DKTPDXMQDWZJNK-DEOSSOPVSA-N 483.573 0.139 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CC1 1785317318 RNNGVPHKYRUUTO-HRAATJIYSA-N 457.955 0.983 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1 1785488008 PMBDMLMWVJFMOE-DEOSSOPVSA-N 477.525 0.638 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3nc4ncccn4n3)CCC2)cc1)c1cccc(B(O)O)c1 1788145614 IFAXKXAOVZCSMJ-UHFFFAOYSA-N 456.271 0.866 50 20 JCGD CC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21 1789858826 REEVQSUWVWMCBZ-PYTMVJMLSA-N 452.939 0.990 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1792229294 KMGJKQXHHGLQFM-ZRCAFCQKSA-N 485.277 0.250 50 20 JCGD COc1nccnc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](CCl)NC(=O)OC(C)(C)C 1793878202 DIISPBNZFNSYSB-XGUBFFRZSA-N 483.953 0.821 50 20 JCGD CS(=O)(=O)Cc1ncccc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1794405424 OMSOSASOKWKMJS-GNXNZQSNSA-N 450.344 0.633 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3sccc3c1O)C2)c1cccc(B(O)O)c1 1795740559 HOXDGHWIZLKIMS-YVWYUNDQSA-N 466.324 0.804 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nc3ccccn3n1)C2 1796440215 IZTHMDOTTZVSAO-OBAMXFLESA-N 464.486 0.067 50 20 JCGD CC(=O)N1CCC(N2CCC(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](F)Cl)C4)CC2)CC1 1797280559 IQZQPNXDOQZLNE-HNJRGHQBSA-N 472.989 0.833 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@](C)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)[C@H](O)C1 1797309075 ZGSSPGLKWKZMTJ-HAOOACFXSA-N 489.997 0.184 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnn2cc(C)cnc12 1797417842 OWIRWUNTZIQTFJ-JRADWPLCSA-N 478.513 0.375 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccn2nccc2c1 1797555101 FFFVHHGZFIIFMH-KEMUROEHSA-N 463.498 0.672 50 20 JCGD Cc1cccc(CCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)c1 1797748529 GLTSOEHGTBAFBJ-OPMZPASUSA-N 451.527 0.830 50 20 JCGD COC(=O)c1ccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cn1 1798440476 VWANLMKTQNSELK-QDMKHBRRSA-N 452.471 0.432 50 20 JCGD CC(=O)N[C@@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2)c1cccc(Cl)c1 1799067868 DHVLIPZCUCKVNU-QJESEZNXSA-N 458.342 0.707 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)C1=C2c3ccccc3C(=O)N2CC1)c1cccc(B(O)O)c1 1799139207 MUFONLPBULRTKG-REPLKXPHSA-N 471.322 0.889 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)[C@@H](F)Br)cnc2c1 1799347303 LCYVLKVEGZHIDW-NOXHYTERSA-N 467.295 0.897 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(NC(=O)C2CC2)cc1 1799440544 KTBYKWOKBQUJHT-HATOLVCRSA-N 477.326 0.232 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(Br)cc1O 1799476988 QYLSUYUWXUZLGE-DBWKPXFBSA-N 483.363 0.731 50 20 JCGD COc1ccc(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c1OC 1799660574 PKINGCOJTRWDOP-YVWYUNDQSA-N 472.278 0.040 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F)C(=O)C(=O)O 1800334848 ZPJULTAVGPZVRJ-BJUDCHGJSA-N 476.436 0.004 50 20 JCGD C[C@@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1CN(C(=O)OC(C)(C)C)CCO1)C2 1800754968 YZMZGIBQUPAFAJ-RBGFHDKUSA-N 490.395 0.995 50 20 JCGD CN1CCCC[C@@H]1C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803164785 SUJCMZNEZXMJGT-UIFIKXQLSA-N 465.558 0.884 50 20 JCGD CCCNC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1803442314 RQSJWCKBUNICLJ-VGOFRKELSA-N 481.557 0.706 50 20 JCGD Cc1nn2cc(CC(=O)N3CCCC4(CCN(C(=O)c5cccc(B(O)O)c5)CC4)C3)nc2s1 1806448991 ZFGFCGUMFDMMLC-UHFFFAOYSA-N 481.387 0.867 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)/C=N/N2CCCCC2)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807360910 MCTHJVNZFNVEOJ-NVQJOJJJSA-N 463.347 0.553 50 20 JCGD CCN1CCC(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)CC1 1807363817 FSBJDPBZVJAFTF-FYYLOGMGSA-N 464.375 0.813 50 20 JCGD CC(=O)N[C@H](C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(C)(C)C 1807364054 HKHDFMILXMUATK-ILWGZMRPSA-N 480.374 0.632 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)C2CCC(O)CC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374089 IFOJEFMNTBWDBB-LWOJGPERSA-N 451.332 0.632 50 20 JCGD O=C(CSc1ncccn1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807571287 NFRGZDJFJFPFRP-NQIIRXRSSA-N 477.355 0.663 50 20 JCGD Cn1c(=O)c2c(ncn2CC(=O)N2CC[C@H](CNC(=O)[C@H](F)Cl)[C@H]2c2cccnc2)n(C)c1=O 1808309934 UEZOQSATNJLHTE-UNEWFSDZSA-N 491.911 0.069 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H](CNC(=O)c2cn3cccnc3n2)[C@@H]1c1cccnc1 1809781807 SKBRZCCTROZUBY-UTKZUKDTSA-N 464.530 0.817 50 20 JCGD Cc1ncncc1C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810302239 GYJMIIJNSCRKHH-UZLBHIALSA-N 460.498 0.812 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)[C@@H](O)N2CCOCC2)[C@H]1c1cccnc1 1810360631 UBNBVYLPOVHNNL-AXVVYFOYSA-N 469.380 0.912 50 20 JCGD COc1ccnc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1810807767 CIFNUIJYKIUTDX-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD O=C(CN1CCCCC1=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1812973147 ASHZOXAPUGIQPH-WMZHIEFXSA-N 464.331 0.094 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1 1813070592 KBJGFORAXFPGDU-HRAATJIYSA-N 456.503 0.173 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cn3ncccc3n2)[C@@H]1c1cccnc1 1813070644 LBIOKZHMTBJCAL-VGOFRKELSA-N 464.530 0.817 50 20 JCGD Cc1cc(C)n(CCC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1813304857 GKKSABBROUGIGQ-URXFXBBRSA-N 475.358 0.985 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(-n3ccnc3)ccn1)CC2)c1ccc(B(O)O)cc1 1815343846 RVPHPTMSDPKXDF-INIZCTEOSA-N 488.338 0.943 50 20 JCGD Cc1cnn([C@@H](C)C(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)c1 1815347864 UFHZHCNCBYETNU-BBRMVZONSA-N 453.333 0.815 50 20 JCGD O=C(Nc1cc([C@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1ccc(B(O)O)cc1 1817472833 ZXXLKDBHMFMEET-MRXNPFEDSA-N 452.236 0.946 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)C(=O)Nc3cccnc3)sc2C1 1820047851 KYAWMXYTTKMGSG-NSHDSACASA-N 480.510 0.401 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cccn3c(O)nnc23)[nH]n1 1822414544 WDANQKDPGJGBDT-OAHLLOKOSA-N 469.506 0.837 50 20 JCGD NC(=O)c1ccccc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1ccc(B(O)O)cc1)CC2 1823443686 OXFAWWQGOWISSW-AWEZNQCLSA-N 464.312 0.461 50 20 JCGD NC(=O)c1ncccc1C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827055769 FAOGOADDZUCAOI-HXUWFJFHSA-N 464.331 0.407 50 20 JCGD C[C@H](CN)C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828550795 AZAUGISFNLZLSW-TVTNDZMWSA-N 466.966 0.633 50 20 JCGD COCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1830481148 IERPSUGSDPERTJ-DEOSSOPVSA-N 491.589 0.216 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)c(C)c1 1830737704 GPTRVNRFQLXFGI-LAUBAEHRSA-N 454.907 0.451 50 20 JCGD CN(CCCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2)C(=O)OC(C)(C)C 1830738325 NDVBOSIBGRUWAB-IERDGZPVSA-N 477.986 0.690 50 20 JCGD CN1CC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)C1 1832551352 KOKWJYORYAXNGC-HRAATJIYSA-N 474.986 0.137 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@]2(CN(C(=O)Cn3cc([N+](=O)[O-])cn3)CCO2)C1 1832800617 VOZVVEWCINJACN-SJORKVTESA-N 464.306 0.484 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cn3ccc4sccc4c3=O)CCO2)C1 1832895723 AMISATJUUZRWKE-IIBYNOLFSA-N 483.974 0.773 50 20 JCGD CC(C)(C)OC(=O)NC[C@H](O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](F)Cl)CC2)CC1 1833272121 GUPKQUCCIOTKJQ-HOTGVXAUSA-N 464.966 0.978 50 20 JCGD CCc1nn(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](Cl)COC)C3)C2)c1Cl 1833595788 CVEOQNHTKIAOJA-DJJJIMSYSA-N 463.362 0.960 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccnc(C(F)(F)F)c1)CCO2 1833794366 FKJSAZCKMXFHFL-NRFANRHFSA-N 493.247 0.164 50 20 JCGD COc1ccccc1OCC(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797764 CRWZACDUJHUIKN-UHFFFAOYSA-N 495.385 0.639 50 20 JCGD C[C@@H](C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cccc1C=O 1834797985 SPERZOFQPUPYGK-SFHVURJKSA-N 480.374 0.427 50 20 JCGD CN(C)c1cccc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)c1 1834798399 PPFHGXASTQZVMS-UHFFFAOYSA-N 478.402 0.931 50 20 JCGD Cc1nccn1[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801414 HIZQRGQTIYCJQZ-QGZVFWFLSA-N 467.379 0.318 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3ccccc3N)CCO2)C1 1835781146 LZKFDNRYCAHFMQ-ISGGHPHESA-N 459.547 0.111 50 20 JCGD CC(C)(C)c1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)c[nH]1 1835935619 VXYWIWIXZNYNOG-DEOSSOPVSA-N 469.347 0.376 50 20 JCGD Cc1occ(C(F)(F)F)c1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1836557135 GWSRTZYMHYOUFC-OAQYLSRUSA-N 496.247 0.670 50 20 JCGD CC[C@H](C)[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839138011 BGAMYBTUEZSZDD-QNFHRHJVSA-N 492.013 0.982 50 20 JCGD COc1cccc2[nH]cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)c12 1839557228 PAIHPWPPQQOTQV-RUZDIDTESA-N 493.325 0.240 50 20 JCGD CN[C@@H](CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)/C(C#N)=C/c1ccc(F)cc1F)CCO2)C(=O)O 1839743475 SUGNIFHBXPVODO-RKGDEQIESA-N 492.479 0.391 50 20 JCGD O=C1CC[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)[C@H](Br)Cc4ccccc4)CCO3)C2)N1 1839801935 IOLUXFMWDDVFPX-HMFYCAOWSA-N 494.386 0.728 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cn3c(=O)n(C)c4ccccc43)C2)C1 1840153058 BMNFOXFIPZYOKB-KSFYIVLOSA-N 480.949 0.050 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)COc3cc(Cl)ccn3)C2)C1 1840153686 XRYUULNHNXGNTE-DNVCBOLYSA-N 462.330 0.824 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CCc3c[nH]c4ncccc34)C2)C1 1840187084 JYKOEHOQKYNNRM-DEOSSOPVSA-N 486.573 0.325 50 20 JCGD CO[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1840206862 KPQYOMRDRIDFQX-QEEYODRMSA-N 463.959 0.610 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(F)cc(Cl)c3)CCO2)C1 1840710252 IQUQWQCMLKWIGO-QFIPXVFZSA-N 491.907 0.861 50 20 JCGD COc1ccc(C(=O)CCC(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)cc1 1843010817 HCJUFXGKLJZKBF-UHFFFAOYSA-N 450.300 0.855 50 20 JCGD CC(=O)Nc1ccc(S(=O)(=O)NCC(=O)NNC(=S)NCCc2cccs2)cc1 11512611 XUSBEKNLZOHQMZ-UHFFFAOYSA-N 455.587 0.723 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)c2ccc(S(N)(=O)=O)cc2)c1 25376713 YOZTWLYWJKSSQO-UHFFFAOYSA-N 454.530 0.439 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)C[C@](O)(c2nccn2C)C(F)(F)F)cc1 105566578 SGYSNHTXFVQNAU-KRWDZBQOSA-N 477.465 0.337 50 20 JCGD C[C@@]1(c2ccc(CNC(=O)NNC(=O)c3cccc(S(C)(=O)=O)c3)cc2)NC(=O)NC1=O 726282676 PPYITUSDRZBUPF-FQEVSTJZSA-N 459.484 0.289 50 20 JCGD CCOc1ccc(O[C@H](C)C(=O)NNC(=O)Cn2cnc3c(c(Br)nn3C)c2=O)cc1 727064407 UJBKRDMDYFHDET-LLVKDONJSA-N 493.318 0.906 50 20 JCGD Cn1cc(S(=O)(=O)NCC(=O)NNc2ccc(S(=O)(=O)Nc3ccccc3)cc2)cn1 728217886 USWGPCPKJVADBI-UHFFFAOYSA-N 464.529 0.643 50 20 JCGD COc1cccc2c1OC[C@@H](NC(=O)NNc1ccc(S(=O)(=O)N3CCN(C)CC3)cn1)C2 728398208 BWXLTTWFSVPUAJ-INIZCTEOSA-N 476.559 0.656 50 20 JCGD CNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)s1 916232013 CDPZLEBIFYCXSE-UHFFFAOYSA-N 458.518 0.826 50 20 JCGD CN1CCN(C(C)(C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1 916259040 RIHMYJOFIKRXKZ-UHFFFAOYSA-N 480.635 0.831 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNS(=O)(=O)c2ccc3nc(O)[nH]c3c2)c1 916643758 DEQKBPDVIKHNTE-UHFFFAOYSA-N 467.529 0.922 50 20 JCGD Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N1CCC(C(=O)NNC(=O)CN2CCCC2=O)CC1 920827741 XDHPVZIODROYQD-UHFFFAOYSA-N 467.504 0.074 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C(=O)c1cccn1C)C2 1778095001 PVJQNJQOPJKSFM-CAAOGRNVSA-N 482.541 0.856 50 20 JCGD C[C@@H](C(=O)N1CC[C@@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1)N1CSCSC1 1779149765 SYHYEVLCXHAKCX-HNAYVOBHSA-N 459.638 0.232 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968629 OQBLVWVTXFXDMG-NBGIEHNGSA-N 487.601 0.736 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1nccs1)CCO2)NC(=O)NCc1ccccc1 1780968671 DFYBHCAXTRELIE-JOCHJYFZSA-N 472.571 0.933 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnn3c2OCCC3)C1 1781259339 CBZYSHACPBICMF-WZONZLPQSA-N 483.529 0.105 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](Br)CC)C1 1781900799 FKMMQYIZWYKIIO-YRWGSWDYSA-N 464.357 0.738 50 20 JCGD Cc1nc(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CCC(=O)NN(C)C)C2)cs1 1782209469 RWMUMBZRAKTIJA-DYESRHJHSA-N 451.593 0.881 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3cnc4c(c3)NC(=O)CS4)C2)C1 1782424265 OSXXIHBRAWBVDH-DJJJIMSYSA-N 454.936 0.823 50 20 JCGD COC(=O)N(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)Cc1ccccc1 1783691594 PSBAJFBJLAAIDC-RUZDIDTESA-N 495.341 0.079 50 20 JCGD COC(=O)N(CC(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2)Cc1ccccc1 1783691603 PSBAJFBJLAAIDC-VWLOTQADSA-N 495.341 0.079 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@]1(F)CCN(C(=O)OC(C)(C)C)C1)CCO2 1783935085 NQISZRXEMSBMLU-PKTZIBPZSA-N 499.584 0.538 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)n(-c2cccc(=O)n2C)n1 1784089475 DEICCQRUTXDHGP-ONIAQPFYSA-N 477.949 0.072 50 20 JCGD COc1ccc(CC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@H](O)CCl)[C@H]3C2)c([N+](=O)[O-])c1 1784092004 CDUUXKSMBVCXMG-PLYYQAHHSA-N 455.895 0.725 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@H](C)n3cc(C)cn3)C2)C1 1784447999 JUJXFENFPNUZOF-LQDRLVSNSA-N 455.519 0.716 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C#CC3(O)CCCCC3)C[C@@H]21 1787508708 PMSAQSZYZODORY-INOWORCRSA-N 483.569 0.799 50 20 JCGD C[C@@H]1CCc2c(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cnccc5C(=O)NN)C[C@@H]43)n[nH]c21 1787953714 ZVGQRHGJYVEBBJ-QISBLDNZSA-N 467.530 0.365 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc4ncnn4c3)[C@H]2C1 1788449739 XXCABRRWKREVQI-MIRJYFFBSA-N 478.513 0.457 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CS[C@H]3CCCCO3)[C@H]2C1 1788647488 ZQEIOUFLRNSOHD-IAGYGMIVSA-N 456.609 0.599 50 20 JCGD C[Si](C)(C)OCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3CCc4nc(O)nc(O)c4C3)C[C@@H]21 1788765142 IGLDVECXEIGCSG-OAOQPFQOSA-N 478.622 0.824 50 20 JCGD CC(=O)N[C@@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21)c1ccc(F)cc1 1789700024 RZZKRECHJWBWPT-XFUTXVRSSA-N 455.914 0.582 50 20 JCGD O=C1NCCCn2nc(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]4C3)cc21 1789926172 PRIWNZXDBRUBKK-GVARAGBVSA-N 472.315 0.300 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)N3CCN(C)CC3)C[C@@H]21 1790962879 FIOCQGCWSDMKII-ICUGJSFKSA-N 459.429 0.776 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(C(F)(F)F)nn3C)C[C@@H]21 1791290827 AASVJINUVVZANI-YDHLFZDLSA-N 474.484 0.405 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3CCC(O)CC3)[C@H]2C1 1791410920 SPKLCHVTYJACHL-ZRJJKMADSA-N 459.547 0.651 50 20 JCGD COc1ccc(Cn2cc(CC(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@H](O)CCl)C4)cn2)cc1 1793995808 TZRBYMXIABKGHH-BAYUQKDNSA-N 476.961 0.672 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1 1795732907 SAVYKFBESNECBI-HCBXPFHNSA-N 452.316 0.382 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc3ncsc3[nH]1)C2 1796441759 ZJQQDGBBQZDBCL-IZJYNLIKSA-N 469.527 0.962 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3c(Cl)cccn13)C2 1797750775 SOQHWZQXVDVNSQ-IVWMJMPLSA-N 483.916 0.503 50 20 JCGD CC(=O)Nc1cccc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)n1 1798440656 GQCJECBWWUQYRO-QDMKHBRRSA-N 451.487 0.604 50 20 JCGD CCS(=O)(=O)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C(C#N)=C/c1ccc(F)cc1F 1800332257 KCASPLSNZQGJPY-AHHPBITISA-N 467.494 0.896 50 20 JCGD C[C@H](CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C)NC(=O)OC(C)(C)C 1801011152 IXWIKFBGLBKGOE-IHSNIMORSA-N 469.583 0.252 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@@H](CNC(=O)c2cc3n(n2)CCNC3=O)[C@@H]1c1cccnc1 1806084901 SSYDKRYGXCXEBL-MPGHIAIKSA-N 460.922 0.595 50 20 JCGD Cc1cc(C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)nc2nccn12 1807363212 BESZXZZRELKBAV-KNQAVFIVSA-N 484.325 0.746 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807372980 LIIWIZBKLKRMHU-ZTNFWEORSA-N 469.303 0.643 50 20 JCGD Cc1cnn([C@H](C)C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)c1 1807374539 LAYSWQNEXPRPIU-PIPMEXSNSA-N 461.331 0.847 50 20 JCGD C[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)N1CCN(C)CC1 1807864928 FZWNBLJDDXTAPA-SFGWALBWSA-N 494.600 0.036 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1808439160 IFHTXJWOFZSZBM-DENIHFKCSA-N 465.315 0.590 50 20 JCGD C=C(CC(=O)OCC)C(=O)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1808439234 JVNOBFMEPJTWHJ-SIKLNZKXSA-N 465.315 0.590 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1ccc2nonc2c1 1809125011 CKQRXJMYQWIIAL-XMSQKQJNSA-N 471.282 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2ccc3nncn3c2)[C@@H]1c1cccnc1 1809906196 HDQRFFITQYJXLA-IERDGZPVSA-N 485.508 0.756 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)[C@@H]2CC[C@H]3CCC(=O)N3C2)[C@@H]1c1cccnc1 1813074496 YETSHMFBBXWWKN-CMCWBKRRSA-N 484.601 0.861 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813074739 WLXOHBUIVPFMRI-ZJBJCVSYSA-N 496.572 0.069 50 20 JCGD C[C@H](Br)C(=O)N[C@@H]1CCc2nc(NC(=O)CNCP(=O)(O)O)sc2C1 1814770457 VMOFYMZBAUYMKR-JGVFFNPUSA-N 455.271 0.563 50 20 JCGD C[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1)N1C[C@H]2C[C@H]2C1 1815356358 FJBAGUCVDLEORA-JJAZEVLHSA-N 454.361 0.389 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)[nH]n1)c1ccc(B(O)O)cc1 1817470538 CUADFGUPCZNKIP-INIZCTEOSA-N 451.248 0.108 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1)N1C[C@H]2C[C@H]2C1 1817472564 XDUGYFANWNHQBS-DFYYWFRZSA-N 451.336 0.736 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ncccn3n1)CC2 1819796980 KNCRQQBZKIFDCH-JTQLQIEISA-N 478.498 0.119 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)CCn2cncn2)n[nH]1 1822681075 CHZQHZUUZCWXEZ-MRXNPFEDSA-N 452.479 0.396 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cnccc1C(=O)NN)CC2)n1cncn1 1826790136 OJRHXHHTRFKJKN-MNOVXSKESA-N 455.504 0.220 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@]2(C1)CN(C(=O)c1c(Cl)cncc1Cl)CCO2 1829599451 URPHZDANIOCISG-NRFANRHFSA-N 494.140 0.452 50 20 JCGD CCc1c(Br)c(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)nn1C 1830722575 DLCKQCUILZHVGN-FZKQIMNGSA-N 493.786 0.415 50 20 JCGD O=C1C[C@@H](C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CN1Cc1ccccc1 1831109893 ZZBBLITVBUBKLN-PWHSHALESA-N 479.961 0.091 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CC(=O)N(Cc3ccccc3)C1)CCO2 1831110658 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1836803763 WSVFBVMKLGSLEM-DEOSSOPVSA-N 481.289 0.371 50 20 JCGD CCc1[nH]nc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c1F 1837344366 VVMSWAYRJWEEOM-UHFFFAOYSA-N 472.326 0.717 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)C3(c4ccc(F)cc4)CC3)C2)C1 1837456989 UYOAPJZSNQEIJE-DEOSSOPVSA-N 497.527 0.626 50 20 JCGD Cc1cccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c1 1837459379 DXUJDIUPSDMMGL-QHCPKHFHSA-N 453.499 0.377 50 20 JCGD Cc1ncncc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919334 ZFEQULOOQWXCOD-UHFFFAOYSA-N 452.320 0.391 50 20 JCGD COCCn1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1837920137 CTPRNWPQTLOJNA-UHFFFAOYSA-N 484.362 0.135 50 20 JCGD O=C(Cn1cc(Cl)cn1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920779 DZMVUEVQYVWSBA-UHFFFAOYSA-N 474.754 0.529 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)Br)CC2)CC1 1838357724 JWWOXZRFJJTMRI-SWLSCSKDSA-N 464.357 0.833 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)/C=C\C(=O)NC3CC3)CC2)CC1 1838365226 VCQLAQVWJDVKKP-ALCCZGGFSA-N 463.579 0.193 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)OC(=O)NC(C)C)CCO2 1839074706 ZNPAZRLFEXHPBP-FOIQADDNSA-N 463.959 0.610 50 20 JCGD CCc1[nH]nc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)c1F 1839198003 PEZBFXAKSPDNTM-XJKSGUPXSA-N 451.268 0.872 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H]3CCCO3)CCO2)C1 1840012520 MPENIPGFEKXJLQ-CKJXQJPGSA-N 475.970 0.754 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2)C(C)(C)C 1840030585 PPQGTRONFVYMMS-MUKKUYKPSA-N 462.385 0.777 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3cccs3)C2)C1 1840031204 ISEHXCTXOBCCBH-UGSOOPFHSA-N 474.377 0.718 50 20 JCGD C[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ccc(F)cn4n3)C2)C1 1840034960 BTDMCIXKXTWHFR-KZULUSFZSA-N 470.299 0.722 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CCc4nc[nH]c4C3)C2)C1 1840036364 JDGYWIBWAVONSF-KSMMKXTCSA-N 455.353 0.754 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)C2)C1 1840151524 FMSIBBKIOZLAPQ-WIYYLYMNSA-N 488.990 0.343 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C)c4ncccc34)C2)C1 1840153786 ZJNPCSRJSWNFLR-LAUBAEHRSA-N 450.923 0.897 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4nc[nH]c4c3)C2)C1 1840184366 IJQUVIODGJMJBQ-QFIPXVFZSA-N 458.519 0.006 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)C1 1840276685 XAGLPMWHQPFUKU-HYFFOGBASA-N 489.997 0.690 50 20 JCGD CC(C)N(C)CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C2)C1 1840565215 WADPTYWNWWUQNE-HTAPYJJXSA-N 491.029 0.915 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1CCCN1C(C)C)CCO2 1840582920 KUWALHPDMDIQIK-KERCYCQASA-N 488.589 0.450 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2)C1CC1 1843360195 JPOWQPMSIZTVDU-SFHVURJKSA-N 457.336 0.487 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)C[C@H](O)CNC(=O)OC(C)(C)C)C2 1843416779 ZQTQTESBIPQEEN-WBILBPDKSA-N 490.561 0.600 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2C[C@H]2C[C@@H]1C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265556 OIRZSKSSFQOWMP-JCGIZDLHSA-N 484.557 0.900 50 20 JCGD CNC(=S)NCCC(=O)N1CCCC12CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1844267103 NSKKYVYBZRNRJJ-UHFFFAOYSA-N 463.516 0.821 50 20 JCGD COc1ccc(/C=C/C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)c(OC)c1OC 1847646720 CJJDIUOBAZWKOM-DVFNVHRYSA-N 480.326 0.921 50 20 JCGD C[C@H]1C[C@@H](C)CN(C(=O)CN2CCN(CC(=O)NNC(=O)c3cccc([N+](=O)[O-])c3)CC2)C1 15055853 BANHWBSVEGKDDG-CALCHBBNSA-N 460.535 0.478 50 20 JCGD O=C(NNC(=O)C1CCN(S(=O)(=O)c2cc(F)ccc2F)CC1)c1ccc(-n2cnnn2)cc1 23787601 VQIGJTRLMFHMOT-UHFFFAOYSA-N 491.480 0.802 50 20 JCGD O=C(CNC(=O)c1cccs1)NNC(=O)CNC(=O)c1ccccc1I 725902314 KCRPGJPPQIABRS-UHFFFAOYSA-N 486.291 0.660 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCCNC(=O)CC2CCCCC2)c1 726261603 QJFNIRUQZQJOPQ-UHFFFAOYSA-N 453.565 0.968 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)c3ccc4c(c3)CCN4S(C)(=O)=O)cc2)CC1 728214050 WEPQMCDEZHTQOY-UHFFFAOYSA-N 493.611 0.702 50 20 JCGD Cn1cc(-c2cncc(C(=O)NNC(=O)CCc3ccc(S(=O)(=O)N4CCOCC4)cc3)c2)cn1 731165495 XZORVNLMOKQDKJ-UHFFFAOYSA-N 498.565 0.897 50 20 JCGD COc1ccc(-c2nn(CCC(N)=O)cc2/C=C(/C#N)C(=O)N2CCO[C@@H](C(N)=O)C2)cc1 747775600 FNEGLWQUEHUYSX-QWSHFYNQSA-N 452.471 0.054 50 20 JCGD O=C(O)CCCOc1ccc(S(=O)(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1Cl 751267127 DQAZOEUFNHGJMR-SNVBAGLBSA-N 454.910 0.328 50 20 JCGD COc1ccc(C(=O)CNC(=O)CCC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)cc1 751295071 UZGJDXWJPZTETF-UHFFFAOYSA-N 465.466 0.482 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)CNS(=O)(=O)/C=C/c2ccccc2)n1 759781953 RDUROXRSTSLHFI-BQYQJAHWSA-N 452.514 0.275 50 20 JCGD CCOc1ccc(S(=O)(=O)NCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)cc1OCC 798217565 SIHXAOYSBQZOCW-IBGZPJMESA-N 479.511 0.750 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccccc2)CC1)c1ccc(-n2cnnn2)cc1 807135854 NRFFBBGSLOVNRS-UHFFFAOYSA-N 456.488 0.023 50 20 JCGD CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)c1ccc(-n2cnnn2)cc1 913155954 KCIVEGCLDAHGMV-SFHVURJKSA-N 489.583 0.832 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N(Cc2ccccn2)C1)c1cccc(S(=O)(=O)N2CCCC2)c1 914882005 ZBVKJMGXTPFNOQ-QGZVFWFLSA-N 471.539 0.676 50 20 JCGD CCN(CC)CCNC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 915879473 ZPABWIJTYZWRMA-KRWDZBQOSA-N 485.607 0.625 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)NCc2ccc(S(N)(=O)=O)cc2)c2ccccc2c1=O 915884589 JJERELLMFKPPOD-UHFFFAOYSA-N 458.500 0.769 50 20 JCGD COCCOc1ncccc1CNC(=O)NNC(=O)c1sc(N2CCOCC2)nc1C 916510501 NUZIKGFDJMIRRF-UHFFFAOYSA-N 450.521 0.853 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N[C@H]1CCCN(S(C)(=O)=O)C1 920239968 KCDKCNLIXUOUKD-AAEUAGOBSA-N 463.354 0.971 50 20 JCGD COC[C@H](C)n1c(C)cc(/C=C(/C#N)C(=O)N(C)CC(=O)N[C@H]2CCS(=O)(=O)C2)c1C 920290678 NITNQHZYCJXGME-JYGLJHOQSA-N 450.561 0.981 50 20 JCGD CCn1c(CCC(=O)NNC(=O)NCCCOC)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 920862804 MNAJXFBOAASFRV-UHFFFAOYSA-N 496.590 0.377 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@@H]1CCOC1)c(=O)n2Cc1ccccc1 921202753 DCHCTMSZAVZWMK-QGZVFWFLSA-N 468.514 0.248 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](O)[C@H](C(=O)N2CC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)C1 1778082203 UTMJTIVJMSASTP-FAPUVCABSA-N 475.970 0.034 50 20 JCGD COc1nccnc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778091171 JVZIJJMXADMQAP-AQECUGPMSA-N 483.529 0.747 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)[C@@H]3CC3(F)F)C2)C1)NC(=O)NCc1ccccc1 1778151256 QTYZRMCRVCTVFY-LAUBAEHRSA-N 465.501 0.818 50 20 JCGD C[C@H](C(=O)N1CC[C@@]2(CN(C(=O)CN(C)NC(=O)NCc3ccccc3)CCO2)C1)N1C[C@H]2C[C@H]2C1 1778863292 ZBLQCZJODNKZPR-VABHDBBGSA-N 498.628 0.503 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1cccc3c1OCC3)CCO2 1779030676 TULHNFLXFMDIMB-HSZRJFAPSA-N 451.483 0.377 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779034962 YOIJYXWRKACTIW-RDTXWAMCSA-N 454.325 0.302 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1[N+](=O)[O-] 1779036005 SWYBINLAAAIWQI-QFIPXVFZSA-N 484.469 0.359 50 20 JCGD O=C(/C=C/C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)NCc1ccco1 1779208059 DUGMZPDJYPRVPK-YPZLONQISA-N 458.284 0.972 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3ncccc3Br)C2)C1 1779649314 GLIHCGWIOUAVCO-FQEVSTJZSA-N 474.120 0.281 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCO[C@@]2(CCN(C(=O)c3c(F)cncc3F)C2)C1 1779731225 GDPWTDZUYACCLQ-QMPKWXHSSA-N 460.441 0.937 50 20 JCGD COc1ccc(F)c(C(=O)N2CC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c1OC 1781819988 KQHJPMZRWQLTDK-HSZRJFAPSA-N 472.278 0.280 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1783873024 ILGFESSBWFYDQM-SIFORAMQSA-N 454.911 0.076 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)C#Cc3ccc(Cl)cc3)C[C@@H]21)c1ccc(B(O)O)cc1 1786978798 XFMOEVUTCFGPBF-NYVOZVTQSA-N 466.730 0.665 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3nn(C)c4c3CCC4)[C@H]2C1 1788020551 DYSYRAKYTJEJDX-MDUUWBQSSA-N 481.557 0.636 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3scnc3C3CC3)C[C@@H]21 1788611490 FIIDUYVUKCSKGW-JQFCIGGWSA-N 470.555 0.926 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)C(C)(C)C)C[C@@H]21)NC(=O)NCc1ccccc1 1789724972 UFPAAOVENFMNRB-XWUOBKMESA-N 489.617 0.719 50 20 JCGD CN1CCN(C2(C(=O)N3CC[C@H]4CO[C@@H](CNC(=O)[C@@](C)(Cl)CCl)[C@H]4C3)CC2)CC1 1789871899 HKZFPUDXFGYHTG-BOSXTWCSSA-N 461.434 0.982 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](F)Cl)C[C@@H]21 1791142533 MWMJSJYZYPUAKD-OVWQWFNUSA-N 454.923 0.197 50 20 JCGD CN(CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COC(C)(C)C)NC(=O)NCc1ccccc1 1793758473 VLJRPHLSPGALDZ-HATOLVCRSA-N 475.590 0.737 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C1CCN(c3ccc(F)cn3)CC1)C2)c1ccc(B(O)O)cc1 1795736812 LIADJURVDLXJLZ-BBIADKPPSA-N 496.348 0.020 50 20 JCGD COc1ccc(-c2cc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)n[nH]2)cc1 1795739060 SPZJIKXACMALGC-FEJSZKPUSA-N 490.325 0.282 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CNC(=O)c1ccco1 1795845925 OUXRCTLRPKFOTH-KRXQYRFLSA-N 498.964 0.731 50 20 JCGD N#C/C(=C\c1ccc(Br)cc1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@@H](N)CN 1796342501 HOJRFEVIYOORKE-PQUOWXTFSA-N 462.348 0.232 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@]1(F)CCCCC1(F)F)C2 1797750456 ACCWXRCMKQGLGT-XBMZAUBUSA-N 469.464 0.806 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)SCC(=O)N3)C2 1797750691 OSMNGYCXNGKKGK-VTEUUUEMSA-N 496.549 0.246 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CO[Si](C)(C)C 1797953856 JYVXDQLANPWJPO-KYHPRHEASA-N 473.643 0.703 50 20 JCGD CSCC[C@@H](O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799097602 QCOPRVDVKASKBT-RCLSDMTESA-N 493.630 0.036 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCN1C(=O)Cc3ccccc3C1=O)C2)[C@H](F)Br 1799342028 DENYQJMIUWSZNP-FTUNRGFVSA-N 496.333 0.882 50 20 JCGD COc1cc(C)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(C)c1 1799720147 ATUJPSPQJOIMGR-OPMZPASUSA-N 452.316 0.509 50 20 JCGD Cc1nc2ccc(F)cn2c1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2 1799955569 RTWYVUAPQJQIGG-YVWYUNDQSA-N 460.510 0.358 50 20 JCGD COC(=O)N(CC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CCC(=O)NN(C)C)C2)Cc1ccccc1 1800852211 PMQJEZNYVWRWHN-BBIADKPPSA-N 489.573 0.218 50 20 JCGD COc1cccc(CC(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n1 1804396235 BYSSYNNZWLQASJ-CYFREDJKSA-N 474.326 0.727 50 20 JCGD C[C@H](Oc1ccccn1)C(=O)N1CC[C@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807368672 WKSQRMQEUHGZMW-WGGBDISSSA-N 474.326 0.944 50 20 JCGD COc1cc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)ccn1 1807375245 NOJNHLBIAAKEOC-SIKLNZKXSA-N 460.299 0.798 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)C#CC(=O)O)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807453060 MWQJMVGXFKZWJT-RDPSFJRHSA-N 492.536 0.522 50 20 JCGD CC(C)(NCCC#N)C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815339801 PUSDTSLHEVYVJH-HNNXBMFYSA-N 455.349 0.331 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)Cn2cccc([N+](=O)[O-])c2=O)[nH]n1)c1ccc(B(O)O)cc1 1817474945 JPBSYRPARZKYQW-KRWDZBQOSA-N 494.273 0.166 50 20 JCGD COCc1oncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817475170 LELHJSDBPOARKV-KRWDZBQOSA-N 453.264 0.844 50 20 JCGD Cc1cc(C(=O)NCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)no1 1819929076 OWUXEQFXXBDORP-LLVKDONJSA-N 498.525 0.094 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@@H](N)Cc2cscn2)[nH]n1 1822413911 GVGGCKFALCWQHN-HOCLYGCPSA-N 462.580 0.801 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)[C@H](O)NC(=O)OC(C)(C)C)[nH]n1 1822415076 AEILNSGUQLWJFZ-KSSFIOAISA-N 481.554 0.618 50 20 JCGD O=C(Cn1cnnn1)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCN2C(=O)OCc1ccccc1 1829056777 PXEXALYXMLGQSQ-XLIONFOSSA-N 479.900 0.660 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(Cl)ccc1F)CCO2 1830188572 IVRQYECTBUPQNZ-JOCHJYFZSA-N 476.697 0.543 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ncccc1C)CCO2 1831829425 IQQQEQRJDAXGPN-OINMWHHXSA-N 468.514 0.594 50 20 JCGD Cn1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)cn1 1832272600 NGQMLZUJOYQGDG-HXUWFJFHSA-N 453.547 0.895 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)s3)CCO2)C1 1833216341 WWSNXOFLCRZMLO-FQEVSTJZSA-N 463.491 0.270 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccns1)CCO2 1833774060 UNFWHMZIAOFIPE-RXULLKCLSA-N 460.516 0.347 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccn1)CCO2 1833984063 OCUXKFIYOSZJDD-NJRDNMGOSA-N 454.487 0.286 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1cc2n(n1)CCC2 1835608825 XYUIBPMASTVUCW-UHFFFAOYSA-N 465.363 0.008 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1nccc3occc13)CCO2 1836291631 BOGKSFXOHJVESF-QHCPKHFHSA-N 480.481 0.210 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3nccc4nc[nH]c34)CCO2)C1 1836457775 XNUUYFGLQZANMP-KZULUSFZSA-N 452.309 0.811 50 20 JCGD O=C(c1cc2n(n1)CCCC2)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1836979692 VWJQWUCYAXOTGJ-MAUKXSAKSA-N 459.316 0.980 50 20 JCGD C=C[C@H](O)C(C)(C)C(=O)N1CCO[C@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1837396972 PNNQTXGURCJLAP-HVHZHASVSA-N 475.546 0.150 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc(Cl)s3)C2)C1 1837459798 XKMPJQSEZNWTJB-LJQANCHMSA-N 480.934 0.179 50 20 JCGD Cc1ccc(NCCC(=O)N2CCO[C@@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c(C)c1 1837543815 JQICJYFCUBQBFD-RUZDIDTESA-N 489.617 0.935 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)CN3C(=O)CSC3=S)C2)C1 1837717637 KXMZGPJKXBEHAM-GOSISDBHSA-N 475.665 0.155 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccc4nn[nH]c4c3)CC2)CC1 1837921358 CUJMCRGWLMNHGT-UHFFFAOYSA-N 477.330 0.564 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3nc4ccccn4n3)CC2)CC1 1838021025 HKAOXPNXZDPOBV-UHFFFAOYSA-N 471.562 0.715 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)C3=C4c5ccccc5C(=O)N4CC3)CCO2)C1 1838458840 FSJGKVBWWJJDGT-DVECYGJZSA-N 489.956 0.967 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(Cl)cc3)CCO2)C1 1838959480 XMKWTWXCRHLYNS-JOCHJYFZSA-N 473.917 0.722 50 20 JCGD CN1CCN(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@](C)(Cl)CCl)CCO3)CC1 1839152053 MAOYGICYBBDXTK-UXHICEINSA-N 465.422 0.317 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(CC#N)cc1)CCO2 1839364309 YAWXOQDCEAMLHF-HSZRJFAPSA-N 457.531 0.196 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN3CCCC3=O)C2)C1 1839743463 SDALBYLXTBHJSC-XMZCUOJSSA-N 488.491 0.951 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)COCCO)C2)C1 1839744048 LRESBBQQSKIRBD-CQTHNFAISA-N 465.453 0.337 50 20 JCGD C[C@H](Cc1ccc(F)cc1)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1839765179 UUFAVLUYXCQBGU-CRICUBBOSA-N 499.543 0.773 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cnncc3C(=O)O)C2)C1 1839965168 PFBMRCMRDWAFBP-RDTXWAMCSA-N 471.308 0.418 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(OC)n(C)n3)C2)C1 1839966131 VNHIRTJPNPWZNH-SCLBCKFNSA-N 459.341 0.672 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1840032573 CMGVXYXKPFVYJG-SCLBCKFNSA-N 452.309 0.583 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)C(F)(F)F)CCO2)C1 1840201714 ZHKAROINKBPHRK-IAQYHMDHSA-N 474.274 0.152 50 20 JCGD CC(=O)NCCCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)[C@H](O)CCl)C1 1841353520 AUBRNUOUGYYPRR-DLBZAZTESA-N 489.013 0.989 50 20 JCGD CC(=O)N[C@@H](C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2)c1ccc(F)cc1 1845009338 WSSDFEGTHOZMLT-HXUWFJFHSA-N 453.279 0.200 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1cccc(O)n1)C2)NC(=O)NCc1ccccc1 1845038494 IYAGLVBGVOKIGY-UHFFFAOYSA-N 452.515 0.950 50 20 JCGD C#CCCC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1cccc(B(O)O)c1)C2 1845131988 PKCQIGIJCZDELM-HXUWFJFHSA-N 483.374 0.880 50 20 JCGD COC[C@H](Cl)C(=O)N1CC2(CCCN2C(=O)CN2CCN(C(=O)OC(C)(C)C)CC2)C1 1846968124 GSXNCEPQXOTZKQ-INIZCTEOSA-N 458.987 0.996 50 20 JCGD CN1CCN(CC(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CC1 1848100226 ZWXUKFRCDHQPPF-ULQDDVLXSA-N 458.003 0.568 50 20 JCGD Cc1cc(=O)c(C(=O)NNC(=O)c2cccc(S(=O)(=O)N(C)C)c2)nn1-c1ccccc1 15429621 FYBZEQXBEIACKF-UHFFFAOYSA-N 455.496 0.866 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)OCC(=O)NNC(=O)c2ccc([N+](=O)[O-])cc2)n(C)c1 18396390 ACHKETMQESIRON-UHFFFAOYSA-N 481.487 0.582 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCN(CC(=O)NNC(=O)c3n[nH]c4c3CCCC4)CC2)cc1 117392024 OKNHRDMMIGWFJF-UHFFFAOYSA-N 460.560 0.364 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)[C@@H](CCS(C)(=O)=O)NC(=O)c2ccccc2Cl)cc1 726276574 WLYFJZAFPUKOMF-QGZVFWFLSA-N 494.957 0.968 50 20 JCGD CCn1c(O)nc2cc(C(=O)NNc3ccc(S(=O)(=O)N4CCN(C)CC4)cc3)ccc2c1=O 728216408 ZVALIUWPQQTYCG-UHFFFAOYSA-N 486.554 0.815 50 20 JCGD Cn1c(=O)nc(O)c2c(C(=O)OCC(=O)NNC(=O)[C@H]3COc4ccccc4O3)cc(C3CC3)nc21 728324262 ZSLOBVDNTWKPLK-MRXNPFEDSA-N 495.448 0.056 50 20 JCGD COc1ccc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1Br 730571940 ZBHLZOMHVRZPDK-UHFFFAOYSA-N 456.322 0.883 50 20 JCGD O=C(CCc1ccccc1)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 749927840 JFQAUIIJGADNDZ-UHFFFAOYSA-N 460.560 0.497 50 20 JCGD O=C(COC(=O)c1cc(I)ccc1-n1cnnn1)NNC(=O)c1cccs1 781968747 LTXWLRSKKGWBON-UHFFFAOYSA-N 498.262 0.946 50 20 JCGD O=C(NNC(=O)[C@@H]1CS[C@H](Cc2ccccc2F)C(=O)N1)c1ccc(-n2cnnn2)cc1 894395700 AXUMGZQVLWEEDA-DLBZAZTESA-N 455.475 0.405 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)CCNS(C)(=O)=O)cc2)cc1 916145107 TVCZQDBNAASTTG-UHFFFAOYSA-N 482.584 0.516 50 20 JCGD O=C(NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1)NC1CCN(C(=O)C2CC2)CC1 916260788 FVTWHXYHWGJBDP-UHFFFAOYSA-N 463.560 0.816 50 20 JCGD CC(C)(C)OC(=O)N1CCN(C(=O)CNC(=O)NNC(=O)[C@H]2COc3ccccc3O2)CC1 918138358 PACHHYQKWRMHTI-MRXNPFEDSA-N 463.491 0.236 50 20 JCGD O=C(NNC(=O)[C@H]1COc2ccccc2O1)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O 918552039 JVMHFPBFBFDXNM-RDTXWAMCSA-N 487.490 0.611 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)c1cccn1C)N(S(C)(=O)=O)CC2 920597907 BTMHYYFPYIBFRI-MRXNPFEDSA-N 450.517 0.752 50 20 JCGD CCN(CC)C[C@@H](C)NC(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 921119520 CPMAPPVXPODTBA-QGZVFWFLSA-N 469.608 0.701 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)c1n[nH]c3cc(Cl)ccc13)CCO2 1779031990 ISUQOZLWAYTPCJ-JOCHJYFZSA-N 483.916 0.972 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](O)c1ccccc1Cl)CCO2 1779033790 DZKWJUKDRJYISZ-XMSQKQJNSA-N 473.917 0.516 50 20 JCGD CCn1nc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2ccc(B(O)O)cc2)C3)cc1C 1779833431 GKEFDUWKYAAJIT-NFBKMPQASA-N 454.336 0.333 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])cc4c3OCC4)C2)C1 1780092931 ZLFINVMHXGXRLC-QHCPKHFHSA-N 496.480 0.286 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@H](F)Br)C1 1780774824 NJWPDHSEVTZMFW-VWPFQQQWSA-N 452.321 0.342 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)C1CCC(O)CC1)CCO2)NC(=O)NCc1ccccc1 1780968277 AFDSPRHSDWRNLA-UXIGSVSMSA-N 487.601 0.714 50 20 JCGD Cc1cccc(C)c1NC(=O)C(=O)N1CC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1781236991 IKEUZCAECLHMAQ-DEOSSOPVSA-N 465.315 0.065 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H]2[C@H]3C=CS[C@@H]32)C1 1781529556 DWAKPBHEKWHIII-VEYJHQLJSA-N 457.556 0.688 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CC[C@@]2(C1)CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CCO2 1781865283 UZIUBWRUHFPRPK-XVYSXSONSA-N 496.524 0.721 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1781985145 YAPQWBNPHKVIRC-JOCHJYFZSA-N 471.250 0.479 50 20 JCGD COc1ccc([C@H](O)C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc1 1783768159 DFRPIERWODSFIS-FUOQNJDISA-N 462.547 0.081 50 20 JCGD CC(C)OC(=O)c1ncccc1C(=O)N1CCO[C@@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783935711 CMYPZFWZBWVBHM-HSZRJFAPSA-N 475.546 0.463 50 20 JCGD COC(=O)NCC(=O)N1CC[C@@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1784255116 XLEUFUSRPFLUNT-ORAYPTAESA-N 462.931 0.304 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cn3ccnc3)C[C@@H]21 1785075371 IQANWGAPBWUDKH-QAETUUGQSA-N 469.970 0.995 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)C(Cl)Cl)C[C@@H]32)c1 1785589547 UXURHUWYHFUIMI-BPNCWPANSA-N 450.344 0.882 50 20 JCGD CC(C)(C)n1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)n1 1786984658 VZUBMVUJMBIUOU-QRFRQXIXSA-N 454.336 0.225 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3ccc4ncnn4c3)C[C@@H]21 1787507741 NZAHYDVDFRNKTI-WEMFUYDZSA-N 492.540 0.386 50 20 JCGD COC(=O)c1ccc(CC(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)s1 1789688963 RFFDWNJEAIDGAW-SNRMKQJTSA-N 486.355 0.051 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC[C@H]2CO[C@@H](CNC(=O)C3(c4ccccc4F)CC3)[C@H]2C1 1792192504 GIHAOQLBHJTTHY-JLMWRMLUSA-N 466.318 0.831 50 20 JCGD CN(C)C(=O)CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](F)Cl 1796370177 IERZTRMUQSMUJM-QZCUMHFISA-N 492.976 0.872 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1c(F)cccc1F)C2 1797752853 JMDIOFVGMQQXSA-NXCRSVRDSA-N 459.453 0.409 50 20 JCGD C=CC(=O)N[C@@H](C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)C2 1797946171 ARHIAJVKGIXAPA-DTNKQSLVSA-N 474.470 0.414 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)CN(C)C(=O)C(=O)O)C2 1799221157 KBUCLTKXISGWIO-BTTYYORXSA-N 476.442 0.315 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)COCCO)C2)[C@H](Br)Cc1ccccc1 1800436942 QQCMPHMXRDAAKX-SFNKJDCFSA-N 455.349 0.591 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)c1 1800845929 TULAPJNXRMHBQT-BJWYYQGGSA-N 474.319 0.475 50 20 JCGD COC[C@@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccnc1CS(C)(=O)=O)C2 1800973572 FYTONFJIEPSTBX-IARIHHJXSA-N 459.952 0.083 50 20 JCGD COC[C@H](Cl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(N3CCOCC3)cn1)C2 1800974613 ZPTGNOMHFQEKHC-HIRMHNASSA-N 452.939 0.375 50 20 JCGD COc1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)CCC(=O)NN(C)C)cc(C(F)(F)F)n1 1801011843 KHCVLBSYMORZFP-HBCWATKFSA-N 487.479 0.685 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Br)cc1O)C2 1801012504 LLKIMDYLNCSUTA-DBWKPXFBSA-N 483.363 0.731 50 20 JCGD C[C@@H]1[C@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)CCN1C(=O)OC(C)(C)C 1802248968 SQLVXQJHWDOQHQ-RGGMIXCSSA-N 459.971 0.821 50 20 JCGD Cc1cc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)nn1C 1803288300 DGELXZNEBQCKPU-VGSWGCGISA-N 476.541 0.684 50 20 JCGD CC1CCN(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)CC1 1807367082 XEUJGQUYZTXSSH-URXFXBBRSA-N 464.375 0.813 50 20 JCGD COc1cccc(C(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807369185 CAPUDAXFZZBEIV-PGRDOPGGSA-N 460.299 0.798 50 20 JCGD CCOc1ccc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)nn1 1807377040 ZIBNNUPHDXKWFF-GCJKJVERSA-N 475.314 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2nc3ccccn3n2)[C@@H]1c1cccnc1 1807933834 ASRYRGISVTVAHY-UZLBHIALSA-N 485.508 0.756 50 20 JCGD Cc1cc2nnc(C(=O)NC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)[C@H]3c3cccnc3)c(C)n2n1 1809188366 WNIPPJHWJFPWNA-CVDCTZTESA-N 499.340 0.449 50 20 JCGD C[C@H](C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1)n1ccccc1=O 1810517605 DLIXPNGYEPXNKS-TVTNDZMWSA-N 489.536 0.823 50 20 JCGD C[C@H](Br)C(=O)NC[C@H]1CCN(C(=O)CN(CCO)CCO)[C@@H]1c1cccnc1 1812868215 USSONZRTZYFPIH-YXJHDRRASA-N 457.369 0.157 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)CN(CCO)CCO)[C@H]1c1cccnc1 1812868216 USSONZRTZYFPIH-ZVZYQTTQSA-N 457.369 0.157 50 20 JCGD CN1CCCn2nc(C(=O)N[C@H]3CCc4nc(NC(=O)c5ccc(B(O)O)cc5)sc4C3)cc2C1 1815348190 INKMCTRHVLMSJM-INIZCTEOSA-N 494.386 0.395 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1nc3ccccn3n1)CC2)c1cccc(B(O)O)c1 1815354720 QVZAJHUPKBKCKM-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD Cc1nn(C)c(C)c1CC(=O)N[C@@H]1CCc2nc(NC(=O)c3cccc(B(O)O)c3)sc2C1 1815361839 SJVJMOUHKMUVKS-MRXNPFEDSA-N 467.360 0.642 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnncc2C(=O)O)n[nH]1 1819760008 GAAZFCWBMMFWGU-MRXNPFEDSA-N 479.457 0.516 50 20 JCGD C=C(CC(=O)OCC)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1822922668 YMYVYALREMOJGC-OAHLLOKOSA-N 457.317 0.558 50 20 JCGD CC(=O)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN(C)NC(=O)NCc1ccccc1)CC2 1825167529 ASWPXAJYMDTGIT-MRXNPFEDSA-N 487.586 0.537 50 20 JCGD O=C(C(O)O)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1 1828525309 OSWOXNFNKMIBHY-KUHUBIRLSA-N 488.310 0.440 50 20 JCGD O=C([C@H](O)CCl)N1CCN(C(=O)OCc2ccccc2)[C@]2(CCN(C(=O)[C@@H]3C=CCN3)C2)C1 1828551147 KLUPYIJOLGJKDH-YYDVJCTNSA-N 476.961 0.566 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@@H]2CCCCN2C(=O)c2cc3n(n2)CCCO3)CC1 1828611195 MYTCJTMUTADVCB-NRFANRHFSA-N 466.347 0.893 50 20 JCGD CC(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1828888915 UBMYKVRDXUUSTN-DEOSSOPVSA-N 465.315 0.452 50 20 JCGD COCc1oncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)CBr)CCO2 1830538803 QSIZTXVGKUHDFL-ACJLOTCBSA-N 460.325 0.922 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCO[C@]2(COCCN(C(=O)C(Cl)Cl)C2)C1 1830574074 XCZGGURAVCFEDU-KZULUSFZSA-N 470.350 0.132 50 20 JCGD C=CC[C@@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830738774 VKVIYEACSZWXSK-HOIFWPIMSA-N 489.997 0.902 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CCC(F)(F)CC1)CCO2 1831009334 HIEMWDSMDQKFLV-FQEVSTJZSA-N 460.522 0.641 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CNC(=O)OC(C)(C)C)C2)C1 1831638104 ASXLDXLRHNOKNK-QYWGDWMGSA-N 477.986 0.736 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(O)no3)C2)C1 1832549319 MFGQOJWJVBRDJD-RNODOKPDSA-N 488.925 0.582 50 20 JCGD CC(C)(C)OC(=O)NC[C@@H](O)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](O)CCl)CC2)CC1 1833306487 UCODFJQQCYKAJD-DLBZAZTESA-N 477.002 0.043 50 20 JCGD Cn1ncc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)c1C(F)(F)F 1833324304 HSICTGQIGMEDHY-MLGOLLRUSA-N 454.833 0.109 50 20 JCGD Cc1nc(C(=O)N2CCO[C@@]3(COCCN(C(=O)CCBr)C3)C2)c(=O)[nH]c1C 1833385495 LYFVSAQXCZYAFJ-GOSISDBHSA-N 457.325 0.242 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(=O)n3O)CCO2)C1 1833478729 YHOYQQBMIDBYJO-SCLBCKFNSA-N 458.309 0.329 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccno3)CCO2)C1 1834144500 IETDCDWFVMSBHP-XOBRGWDASA-N 472.926 0.877 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(N2CCC(NC(=O)c3cncn3C)CC2)CC1 1834243431 LSAXEFIPNZRCFY-JVWAILMASA-N 468.562 0.739 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)[C@@H]1CNc2ccccc21 1834727994 CYWXSDDVPKODDC-HSZRJFAPSA-N 476.386 0.761 50 20 JCGD C[C@H]1CCc2c(C(=O)NC3CCN(C4CCN(C(=O)c5ccc(B(O)O)cc5)CC4)CC3)n[nH]c21 1835360770 SGWZAKJSBSWTNK-INIZCTEOSA-N 479.390 0.638 50 20 JCGD CC[C@H](C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1)c1ccccc1 1835929211 HSRDBZAIXXKSGV-DHLKQENFSA-N 466.343 0.630 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)nc2ccccc12 1835937367 SGENAQNTODWQNF-SANMLTNESA-N 489.337 0.607 50 20 JCGD C[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1 1836896004 LTNFWEOCCFFUDM-ACJLOTCBSA-N 452.309 0.583 50 20 JCGD Cn1cccc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837390245 YMGGMTAVELYDFZ-UHFFFAOYSA-N 454.531 0.950 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)C[C@H](N)c3cccnc3)CC2)CC1 1837899898 AZFBCUMXHMSTDQ-NRFANRHFSA-N 474.606 0.843 50 20 JCGD N#Cc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1Cl 1838595794 BYKZANNQXILMBP-QHCPKHFHSA-N 483.717 0.275 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(C)c1 1839024176 YHYHBWSTNAHROB-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD CC[C@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1839044717 UEGXZRFDOHISHB-YWZLYKJASA-N 470.979 0.365 50 20 JCGD CC[C@@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc4ncnn4c3)CCO2)C1 1839049185 BWBPSOXCMBSQFE-OXQOHEQNSA-N 480.363 0.902 50 20 JCGD CN(CC(=O)N1CCO[C@]2(COCCN(C(=O)C3(C)CC3)C2)C1)NC(=O)NCc1ccccc1 1839054293 RPRJVMCVBVVBBW-XMMPIXPASA-N 473.574 0.589 50 20 JCGD CCC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(N3CCN(C)CC3)CC1)CCO2 1839106348 BWIBTFHNFBFJEW-RXVVDRJESA-N 457.015 0.630 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccc(O)nn3)CCO2)C1 1839668453 SDPFNRGBIFRNEQ-ACJLOTCBSA-N 473.324 0.048 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C2)C1 1840154145 MTYBFIJIAWHXIM-JLTOFOAXSA-N 485.877 0.647 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)C[C@@](C)(O)CC(=O)O)CCO2)C1 1840180977 LPGQJHZEVPVGFF-KZNAEPCWSA-N 455.335 0.295 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)Cc3cccnc3Cl)C2)C1 1840182408 IQIUHEYMCQYCPC-OAQYLSRUSA-N 467.954 0.107 50 20 JCGD CCOC(=O)C(C)(C)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1840885557 OIHKDSQVYBEUEP-YVEFUNNKSA-N 453.305 0.723 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H]2C[C@]21C(=O)N1CC2(CCCN2C(=O)c2cnccc2C(=O)NN)C1 1844265377 WYMHULBPPHHZJI-IZHWHUGBSA-N 484.557 0.902 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC2(CCCN2C(=O)Cn2cnc3c(O)nc(NC(=O)C(C)C)nc32)C1 1845884800 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0.147 50 20 JCGD O=C(Cn1cc(Cl)cn1)N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839199103 JDGSGUNEEHTAPR-ZFWWWQNUSA-N 453.696 0.683 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1839465840 QDRWQVWQBTUMGX-LPHOPBHVSA-N 457.867 0.279 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc3occc3c1O)CCO2 1839564293 CUYKUHRFVUVWMD-XMMPIXPASA-N 480.282 0.202 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1839692488 ZTUQTMHVPQMUKB-ZHRRBRCNSA-N 495.418 0.871 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc4c(n3)NC(=O)CC4)C2)C1 1840032042 MFCWLFRSLDVCQR-RNODOKPDSA-N 481.347 0.820 50 20 JCGD O=C([C@H](F)Cl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1C[C@@]13C(=O)Nc1ccccc13)CCO2 1840037440 AGGVGDOYUAVUDI-ACRWPFGISA-N 451.882 0.887 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3c(F)cccc3Cl)C2)C1 1840182974 MUHIGWICSZEJPT-QFIPXVFZSA-N 484.956 0.851 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)Cc3ccccc3F)C2)C1 1840183661 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CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@@H](O)CCl)C2 1792984112 YMIAIMZPKGQMMY-SCAKLKGDSA-N 471.982 0.964 50 20 JCGD COc1cc(N2CCC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3ccc(B(O)O)cc3)C4)CC2)ncn1 1793304874 KOJJRLAGBBUUOM-WKCHPHFGSA-N 493.373 0.333 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)C1 1793875826 XZKSQGXFXGLFCM-UEUMHJPSSA-N 499.373 0.039 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCc1c(C)noc1C 1794136460 OTQHBJYZTKUUIF-QCIWSRGXSA-N 470.530 0.948 50 20 JCGD O=C(COc1ccc(Cl)c(Cl)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1795192797 CXMTWJZAVRNCOX-USGNIVHTSA-N 493.152 0.955 50 20 JCGD Cc1nc(Br)sc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795734608 UPSQLTFFYQDSFT-AGGWBTHJSA-N 494.176 0.411 50 20 JCGD Cc1ccc(COCC(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cccc(B(O)O)c2)cc1C 1795738860 JITQDVZOGIEJLP-RUMRUAAYSA-N 466.343 0.403 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](O)CCl)C2)c1ccc(CCN2CCCC2)nc1 1796502386 IDELIQUYFCNFRQ-PIKOESSRSA-N 450.967 0.523 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]cc1I 1798792389 JLZGLJBKNVAFGB-ZSBIGDGJSA-N 488.330 0.639 50 20 JCGD COc1cc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CCC(=O)NN(C)C)C3)c([N+](=O)[O-])cc1O 1799308626 LXLOFJGIBWFZLS-BTTYYORXSA-N 463.491 0.934 50 20 JCGD CC(C)(C)OC(=O)N1C[C@]2(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)C[C@H]1CO2 1799936735 LUZPPNPIQHCGTE-MDFABALLSA-N 499.373 0.397 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2C[C@@]2(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)C1 1801891632 MSUIYRJIJRSDQU-HULAXLKRSA-N 483.374 0.875 50 20 JCGD O=C(/C=C/c1ccccc1[N+](=O)[O-])N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1802109324 JNHNUMRMHNABJQ-PCLDGEOKSA-N 465.271 0.191 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)CCC(=O)NN(C)C 1802344270 UTCSRXACNAEGIB-PLACYPQZSA-N 475.565 0.884 50 20 JCGD COCCOCC(=O)NC[C@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1806757853 QUBKKQYSJATIMY-ZNPGGGMWSA-N 470.530 0.884 50 20 JCGD CCOC(CC(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)OCC 1807363700 BDPQNOAKRFVDBJ-CVDCTZTESA-N 469.347 0.870 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cnc3ncccn23)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807375920 QWHDVTCFLVLDST-NQIIRXRSSA-N 470.298 0.438 50 20 JCGD CC(C)(C)OC(=O)NCCC(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807375956 WQOVGLCEHFJWTB-DENIHFKCSA-N 496.373 0.996 50 20 JCGD COc1nccc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1F 1807711079 IGVLJEZBZNSAJF-DYESRHJHSA-N 478.289 0.938 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CN2C(=O)CNC2=O)[C@H]1c1cccnc1)[C@@H](F)Br 1808650848 GIZJBMSUMBVVAT-TUKIKUTGSA-N 456.272 0.330 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)CNCP(=O)(O)O)[C@@H]1c1cccnc1)[C@H](F)Br 1808660974 FNXMVONWRPCPGL-YUTCNCBUSA-N 467.232 0.503 50 20 JCGD CC(C)=NO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1 1808846461 YCVFZQJFQHGCDE-BSIFCXSSSA-N 452.320 0.882 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)C2CCC(O)CC2)[C@@H]1c1cccnc1 1810306371 XREOWUGGFWMKFN-IFXFZGMBSA-N 466.542 0.951 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cccn(C(F)F)c1=O 1810603969 UXCKGAQQEYFIOS-FXAWDEMLSA-N 496.279 0.952 50 20 JCGD COc1ccnc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)c1 1810807769 CIFNUIJYKIUTDX-XMSQKQJNSA-N 460.299 0.798 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cnc(OCF)cn2)[C@H]1c1cccnc1 1813071485 UCZVVGAFFLJUAQ-KKSFZXQISA-N 473.509 0.870 50 20 JCGD C[C@H](Nc1cccnc1)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1814992331 LYKWOPLVMGMVMD-XJKSGUPXSA-N 465.344 0.944 50 20 JCGD CC1CCN(CC(=O)N[C@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)CC1 1815335705 LYAZDSGBSCMGEC-KRWDZBQOSA-N 456.377 0.781 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@H]1CCc2nc(NC(=O)c3[nH]nnc3C)sc2C1 1815936377 UFRQLNBSPYGVQS-QPDIMOPTSA-N 455.504 0.929 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)Nc2cc([C@@H]3CCCCN3C(=O)c3ccc(B(O)O)cc3)[nH]n2)c1 1816119709 KKINKCZOPHXXQH-IBGZPJMESA-N 497.342 0.508 50 20 JCGD Cc1nnc(CC(=O)N2CCCC[C@@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)s1 1817475613 VNVAZOHOCJEXLW-MRXNPFEDSA-N 454.321 0.798 50 20 JCGD C[C@H](C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1)N1CCN(C)CC1 1817476897 GMFRJAZMWVHFKX-OXQOHEQNSA-N 468.367 0.031 50 20 JCGD CN(CC(=O)Nc1cc([C@@H]2CCCCN2C(=O)C2=NNC(=O)C2)[nH]n1)NC(=O)NCc1ccccc1 1820711353 NQGNMJUESVUYNF-SFHVURJKSA-N 495.544 0.624 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc(-n4ccnc4)ccn3)sc2C1)c1cccc(B(O)O)c1 1821687284 PKVIJQRMQUEYPM-INIZCTEOSA-N 488.338 0.943 50 20 JCGD Cc1cc(CC(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)nn1C 1824297058 DJZLEEXYVRDVJZ-JOCHJYFZSA-N 452.364 0.884 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCC([C@H]2CCCCN2C(=O)CCN2CCOCC2)CC1 1826745302 KTKHMJYOASXUFK-JOCHJYFZSA-N 457.380 0.322 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1 1827060534 OCASKAGWNYSJGJ-MBSDFSHPSA-N 492.385 0.813 50 20 JCGD O=C(Cn1ccc2c(F)cccc21)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830720020 QSSWBCMLNZUCDS-GHTZIAJQSA-N 453.898 0.837 50 20 JCGD Cc1ccc(COCC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc1C 1830727905 JUJSXYDTBHKXGF-UGKGYDQZSA-N 454.951 0.876 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ncc(F)cc1F)CCO2 1831964227 BFAGYXKQZIGKLG-QESWDSMOSA-N 490.467 0.564 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC([C@@H]2CCCCN2C(=O)CN2C(=O)C=CC2=O)CC1 1831982758 PQFDBFOXCAFSBB-JHKMYFMNSA-N 482.541 0.665 50 20 JCGD CC(C)(C)OC(=O)N1CCC(O)(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)CC1 1832111629 MJHTWOYFBXBKSO-FOIQADDNSA-N 493.960 0.739 50 20 JCGD COc1cccc(CCC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834797309 CDBFDJBRSXYXMA-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD O=C(CCc1ccccc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1834837625 ZZHQTJCBBTYMGT-DEOSSOPVSA-N 452.316 0.069 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(N2CCC(NC(=O)c3n[nH]c4c3CS(=O)(=O)C4)CC2)CC1 1834913445 PHKQHXTUPMNFJJ-INIZCTEOSA-N 488.010 0.277 50 20 JCGD Cn1ncc2cc(C(=O)NC3CCN(C4CCN(C(=O)c5cccc(B(O)O)c5)CC4)CC3)ccc21 1835415795 BDUYDAZKQQNRRE-UHFFFAOYSA-N 489.385 0.752 50 20 JCGD CC(C)O[C@H](C)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835738174 WLUIQMLDBOBZDX-MRXNPFEDSA-N 460.579 0.684 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cccc4nccn34)CC2)CC1 1835738228 NKKQCYCOYUKRQH-UHFFFAOYSA-N 490.568 0.832 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3scnc3C(F)(F)F)C2)C1 1835929395 NUIQJBNVCGOQBC-IBGZPJMESA-N 499.276 0.226 50 20 JCGD Cc1nc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c(C(F)(F)F)o1 1835936923 JYLLGFFSQXRNIV-HXUWFJFHSA-N 497.235 0.065 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)CCO2 1836687544 LOOJIXSFRJRREX-IMSXRSKXSA-N 496.004 0.598 50 20 JCGD O=C(CN1C(=O)CSC1=S)N1CCC(OC2CCN(C(=O)[C@@H](O)CCl)CC2)CC1 1836720072 IBHGOFBUTOMBMT-AWEZNQCLSA-N 464.009 0.445 50 20 JCGD C[C@H](C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1ccnc1 1836777999 XMZDZDHHPNZBOG-QGZVFWFLSA-N 454.336 0.436 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837222500 KWDRAYYASZRFPN-KRWDZBQOSA-N 483.573 0.830 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H]3CCc4ccccc4C3)C2)C1 1837460965 MHENPVISDKBBHF-FNZWTVRRSA-N 493.564 0.560 50 20 JCGD C[C@@H](Nc1ccccn1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919088 CSAXWDFXDFLHAD-GOSISDBHSA-N 480.374 0.874 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)Cn3ccnc3)C2)C1 1838528265 NBUUUTWRAQAFQT-QFIPXVFZSA-N 487.469 0.487 50 20 JCGD C[C@@H]1Oc2ccc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@H](O)CCl)C4)C3)cc2NC1=O 1838585574 LQLSMQPDVIAEAM-CQURBHOASA-N 467.906 0.076 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(C)nn3C(F)F)CCO2)C1 1838716021 PSTKZEXUQYSLOM-ACJLOTCBSA-N 450.870 0.910 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc(F)c(F)c3)CCO2)C1 1839009785 QVXLPJPEJNYIJC-JOCHJYFZSA-N 475.452 0.347 50 20 JCGD CC(=O)N[C@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Cl)C2)C1)c1ccc(F)cc1 1839037928 FOOVWAOOORVKJR-ABSDTBQOSA-N 459.877 0.994 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)C2)C1 1839141819 UPGOAMHCGNMOIH-ZQDYSYBYSA-N 481.977 0.640 50 20 JCGD Cc1cccc2c(C(=O)N3CCO[C@]4(COCCN(C(=O)CCC(=O)NN(C)C)C4)C3)n[nH]c12 1839597375 XLURAELZWFFQGE-QHCPKHFHSA-N 472.546 0.314 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@]2(COCCN(C(=O)CN3CCOCC3)C2)C1 1839743496 UNTWWWWBIVWJPK-VKNPPUGMSA-N 490.507 0.660 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)c1 1839996319 CRVUTEPOSWPPFO-UMESLIDUSA-N 474.558 0.538 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](C)Br)CCO3)cn1 1840032766 JRQQNMWCNSCUCV-YJYMSZOUSA-N 470.320 0.722 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3c[nH]c4ccc(OC)nc34)C2)C1 1840153793 AVQUEFQLZVGCNU-QVKFZJNVSA-N 466.922 0.895 50 20 JCGD CCOC(=O)c1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](Cl)COC)CCO3)ccn1 1840154085 LFWKPIBLVHQDGH-HRAATJIYSA-N 469.922 0.582 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1CC1)CCO2)NC(=O)NCc1ccccc1 1840636797 WWUOTLLMAKCELK-QHCPKHFHSA-N 459.547 0.199 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1C1CC1)CCO2 1840656539 UUPYTOLGGPDIKK-RUZDIDTESA-N 464.327 0.628 50 20 JCGD CC1(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)CN(C(=O)OC(C)(C)C)C1 1840954984 RDURVCIDKZFNEO-OPAMFIHVSA-N 489.997 0.690 50 20 JCGD O=C1C[C@@H](C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)CN1Cc1ccccc1 1843010410 MQPLUWULYSRZQZ-HXUWFJFHSA-N 461.327 0.232 50 20 JCGD CC(C)[C@H](CNC(=O)OC(C)(C)C)C(=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843015151 NPOYYMYCVMIHHM-IBGZPJMESA-N 473.379 0.980 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)c1ccc(=O)oc1)C2)NC(=O)NCc1ccccc1 1845038523 NFZYSVKLWJCQHK-UHFFFAOYSA-N 453.499 0.803 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)[C@@H]2CCNC(=O)C2)C1)NC(=O)NCc1ccccc1 1846423617 NROGVHSQEMDXEV-GOSISDBHSA-N 456.547 0.062 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1848099792 WXIOLEFUHUQSIQ-ULQDDVLXSA-N 465.743 0.314 50 20 JCGD CCN(CC)S(=O)(=O)c1cc(C(=O)NNC(=O)c2nn(CC)c(=O)c3ccccc23)n(C)c1 17190721 UAZDUCXZXHQNFA-UHFFFAOYSA-N 474.543 0.860 50 20 JCGD CCN(CC)S(=O)(=O)c1cccc(C(=O)NNC(=O)Cc2c(C)nc3nc(N)nn3c2C)c1 28196020 YBVIXHXTVXZDFO-UHFFFAOYSA-N 474.547 0.358 50 20 JCGD COc1ccccc1C(=O)N[C@@H](CCS(C)(=O)=O)C(=O)NNC(=O)NC1CCCCC1 725987402 KQJIMEKKKIBLMG-INIZCTEOSA-N 454.549 0.891 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC(=O)N2CCc3ccccc3C2)c1 726715884 VFFZZQMFQDHQRU-UHFFFAOYSA-N 459.528 0.466 50 20 JCGD C[C@@H](C(=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1)N1C(=O)CCC1=O 727723371 XMUWBSVFDZFKLF-AWEZNQCLSA-N 458.496 0.464 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N(CCN2CCOCC2)C1)c1cc(F)ccc1Br 728611084 UKQWLPHVALXIIL-GFCCVEGCSA-N 457.300 0.530 50 20 JCGD Cn1cc(CC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCN(Cc4ccccc4)CC3)cc2)cn1 751294209 FQJRALZQNYZPRR-UHFFFAOYSA-N 496.593 0.930 50 20 JCGD O=C(COC(=O)CN1c2cccc3cccc(c23)S1(=O)=O)NNC(=O)[C@H]1COc2ccccc2O1 842766872 HDTFKNXBXJCDPK-GOSISDBHSA-N 497.485 0.879 50 20 JCGD O=C(COC(=O)c1cccc(NC(=O)[C@@H]2CCCO2)c1)NNC(=O)[C@H]1COc2ccccc2O1 907762016 VHPHGHBKPNYLPZ-RBUKOAKNSA-N 469.450 0.948 50 20 JCGD CN(C)S(=O)(=O)N1CCN(C(=O)NNC(=O)c2ccc(COc3ccccc3)o2)CC1 914531034 DQKVIPYTKXQXLD-UHFFFAOYSA-N 451.505 0.637 50 20 JCGD C[C@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCN(S(=O)(=O)N(C)C)CC1 914531168 XECXFTNKCAPJNR-LBPRGKRZSA-N 478.369 0.381 50 20 JCGD CN1CCN(C(C)(C)CNC(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1 916258738 FSVIHUOMSLLMRH-UHFFFAOYSA-N 466.608 0.441 50 20 JCGD CC(=NNC(=O)CN1CCCC1=O)c1ccc(S(=O)(=O)N2CCC(C(=O)O)CC2)cc1 916357905 QZEGALVCBNKRAK-UHFFFAOYSA-N 450.517 0.635 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)c1 916378574 OXKOXONSBZNEMW-KRWDZBQOSA-N 492.480 0.455 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCC[C@](O)(c2nccn2C)C(F)(F)F)nc1 916379025 XZCUMUQOYNOSBV-INIZCTEOSA-N 479.485 0.968 50 20 JCGD O=C(NCc1cccc(S(=O)(=O)NCc2cccc(F)c2)c1)NNC(=O)C(=O)NC1CC1 918099160 UIFZEASTHVGFMO-UHFFFAOYSA-N 463.491 0.413 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)Cn3cnc([N+](=O)[O-])n3)cc2)cc1 918551282 AUFWHNXTTXFEJN-UHFFFAOYSA-N 487.498 0.777 50 20 JCGD C[C@H](OC[C@H]1CCCCO1)C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 921146173 MAEIKRCGZLNSLU-PKOBYXMFSA-N 483.587 0.762 50 20 JCGD Cn1nc(C(=O)NNC(=O)CC2(CC(=O)N3CCOCC3)CCCC2)c2ccccc2c1=O 1321516078 YDCMMDDNHGLQOE-UHFFFAOYSA-N 455.515 0.894 50 20 JCGD CN1CCc2cc(C(=O)N3CC[C@@]4(C3)CN(C(=O)c3cnccc3C(=O)NN)CCO4)ccc21 1777918620 CNMQSGVSRUZULW-XMMPIXPASA-N 464.526 0.435 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(F)(F)F)c[nH]3)CCO2)C1 1779030673 SZVGFTPKSHURLZ-LJQANCHMSA-N 466.420 0.789 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@]2(CCN(C(=O)c3cnn(Cc4ccccc4)c3)C2)C1 1779595098 GLSGZJYAVVYQQD-VWLOTQADSA-N 474.326 0.369 50 20 JCGD O=C(c1ncn2c1CNS(=O)(=O)c1ccccc1-2)N1CC[C@]2(C1)CN(C(=O)[C@@H](F)Cl)CCO2 1779947091 GJCGTNJVOSYTGH-XLIONFOSSA-N 497.936 0.642 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)c3ccc(O)nn3)CCO2)C1 1780095190 IUDWAZTYPSCEEN-OAQYLSRUSA-N 471.426 0.773 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@]2(CN(C(=O)Cn3ccnc3)CCO2)C1 1780097155 RMTQBMVNMPJCBD-NRFANRHFSA-N 457.443 0.860 50 20 JCGD CC(C)(C)OC(=O)N1CCC(C#N)(C(=O)N2CC[C@]3(CN(C(=O)[C@@H](O)CCl)CCO3)C2)CC1 1781168160 WLBGQIVEMFOFHK-AOMKIAJQSA-N 484.981 0.957 50 20 JCGD COC(=O)[C@H]1CC=CC[C@@H]1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cnccc1C(=O)NN)C2 1782159091 IQMXSUNJNOELPV-CGSFFBPTSA-N 499.568 0.568 50 20 JCGD O=C(CCCn1cccc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1782579487 QYLTZWSTYVVSQI-ZJSXRUAMSA-N 453.348 0.776 50 20 JCGD Cc1nccn1[C@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782625812 IYIYOXDYPWTWKN-AYPBNUJASA-N 454.336 0.260 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H]2C[C@@]21C(=O)N1CC[C@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1783555189 LKUVDDSYNTTXRS-YWWLGCSWSA-N 499.373 0.209 50 20 JCGD CCn1nc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c2ccccc21 1783933988 QKZMVSOKYUCCJS-QHCPKHFHSA-N 456.547 0.873 50 20 JCGD CC(=O)N[C@@H](Cc1cccc(F)c1)C(=O)N1CCO[C@]2(CCN(C(=O)CCC(=O)NN(C)C)C2)C1 1783940112 QLXJKXNSOQHRRF-RDPSFJRHSA-N 491.564 0.076 50 20 JCGD CC(C)(C)n1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)c1Cl 1785713896 VZDYYJTVFJKFRI-SNRMKQJTSA-N 488.781 0.878 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c(O)cccc34)C[C@@H]21)c1cccc(B(O)O)c1 1786984979 FURBCZRZFRFJSJ-BUKVSMQUSA-N 475.310 0.527 50 20 JCGD CCOC(=O)[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1 1787451350 KCXPMOZVNMREDP-BTFPBAQTSA-N 479.933 0.957 50 20 JCGD COc1cc(C)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1789996256 GRXFXLWLFBYRCC-HSQYWUDLSA-N 452.316 0.591 50 20 JCGD Cc1cc(O)c([N+](=O)[O-])cc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1790292737 KYNGVOIRLBTFAE-XERREHJYSA-N 483.286 0.196 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)COc3ccc(O)nn3)[C@H]2C1 1790590080 UBTQLRNJFKKBKA-FQUUOJAGSA-N 457.325 0.714 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](CCO)NC(=O)OC(C)(C)C)C[C@@H]21 1791249101 FENZQHBGCUOVRS-WOYTXXSLSA-N 477.986 0.496 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1c(F)cccc1Cl 1792753236 ILZWYOPRTWDJRQ-GFENJXEQSA-N 454.930 0.984 50 20 JCGD COc1ccc2c(/C=C/C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)c[nH]c2c1 1795738817 HCYUBDZEGNVCFJ-SQKWKTBVSA-N 489.337 0.773 50 20 JCGD Cc1ccc(S(=O)(=O)CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2cccc(B(O)O)c2)C3)cc1 1795747378 HBGBSRNUXBBGRZ-ACDBMABISA-N 470.356 0.401 50 20 JCGD Cc1cnn(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)c1 1795884685 PVISALNQTGIAHD-DFGXFYAUSA-N 469.970 0.913 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(C(=O)N(C)C)c1)C2 1796445466 AXMCJCBZLATSFS-ZLPXHQDTSA-N 494.552 0.726 50 20 JCGD COC(=O)C12CCC(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cnccc3C(=O)NN)(CC1)CC2 1797750715 OBBYFMFILOEDME-BIPWODODSA-N 499.568 0.402 50 20 JCGD COc1cc(C)c(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2cnccc2C(=O)NN)cc1OC 1797754157 XHRKEENJUBWHKO-USGNIVHTSA-N 483.525 0.528 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Br)Cc1ccccc1 1800436809 OFOFIAUPRKQLQH-USYVTKNRSA-N 496.402 0.733 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Br)C2)C(C)(C)O 1802150884 PDFQTKWANNCQJG-XVIXHAIJSA-N 496.374 0.931 50 20 JCGD C=CCO[C@H](C)C(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@H]1c1cccnc1 1803566963 PTXIBDGIYKXTLB-MDYRTPRTSA-N 452.515 0.991 50 20 JCGD O=C(CN1CCCCC1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1806883111 IMNMGIGRPYFSJE-NZQKXSOJSA-N 450.348 0.567 50 20 JCGD Cn1cc(CCC(=O)N2CC[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cn1 1807362186 FKLMVXCWZWVFQJ-REWPJTCUSA-N 461.331 0.447 50 20 JCGD CC(C)=NO[C@H](C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807373931 VHWFBCHQKLMGRY-LKUPVBHCSA-N 452.320 0.882 50 20 JCGD CN(CC(=O)NC[C@H]1CCN(C(=O)CNC(N)=O)[C@H]1c1cccnc1)NC(=O)NCc1ccccc1 1807460412 BTBASXMUNXYJPV-KNQAVFIVSA-N 496.572 0.102 50 20 JCGD CCOC(=O)N[C@H](O)C(=O)N1CC[C@H](CNC(=O)[C@H](F)Br)[C@@H]1c1cccnc1 1808668320 ODQXAKBXFGBLOD-UKTARXLSSA-N 461.288 0.842 50 20 JCGD Cc1c(C(=O)N2CCC3(CCCN(C(=O)c4ccc(B(O)O)cc4)C3)CC2)cn2[nH]cnc(=O)c12 1809971371 UGULYVFOUKSDNU-UHFFFAOYSA-N 477.330 0.169 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@H]1CCN(C(=O)c2cc3n(n2)CCCNC3=O)[C@@H]1c1cccnc1 1813071446 SDCZZJAZRAPIEG-VGOFRKELSA-N 496.572 0.104 50 20 JCGD COc1nn(C)cc1C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813071575 UVOWTFBSXYTLNV-JXFKEZNVSA-N 457.535 0.516 50 20 JCGD CC(=O)N[C@H](C(=O)N[C@@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(C)(C)C 1815335813 SIHICPICEMEILA-CRAIPNDOSA-N 472.376 0.600 50 20 JCGD COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)nc1 1815356763 QRHIWUIVMPPNPQ-AWEZNQCLSA-N 452.301 0.766 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1cc(O)n(C)n1)CC2 1817277601 ZGLMVDANBRBUBW-DLDHGHKKSA-N 470.515 0.942 50 20 JCGD CC(=O)O[C@@H](C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1)C(C)C 1819247884 RMVLPFSJZFUKGJ-AZUAARDMSA-N 456.308 0.983 50 20 JCGD CC(=O)c1cc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)n[nH]1 1819796032 YDOAXLKSNDSURU-SNVBAGLBSA-N 468.499 0.607 50 20 JCGD CC[C@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)[C@@H](O)N3CCOCC3)sc2C1 1819891296 OLCYQZAYAQVLMD-XMZIXOGTSA-N 461.382 0.879 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)CN1CCS(=O)(=O)CC1)CC2 1825441438 VZWSMLFFJXFCKW-NEPJUHHUSA-N 493.449 0.959 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@H](C)NC(=O)c1cnccn1)CC2 1825999888 GCZCZDMWIMBPLQ-TUAOUCFPSA-N 466.951 0.917 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N[C@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826088540 YHYPQFXSMKSOMN-NEPJUHHUSA-N 453.569 0.136 50 20 JCGD O=C(N[C@@H]1CCc2nc(NC(=O)[C@@H]3CCc4nc[nH]c4C3)sc2C1)c1cccc(B(O)O)c1 1826616431 FZBHDGJNNQLOIR-UKRRQHHQSA-N 465.344 0.577 50 20 JCGD O=C(CC(F)(F)C(=O)O)N1CCC([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827052981 RHJCXMCSUVTNSX-QGZVFWFLSA-N 452.263 0.710 50 20 JCGD O=C([C@@H](O)CCl)N1CC[C@@]2(C1)CN(C(=O)[C@H]1C[C@@H](O)C1)CCN2C(=O)OCc1ccccc1 1829096109 NGMKWMHTGFIMNO-QPXQOZNCSA-N 479.961 0.809 50 20 JCGD Cn1ccc(=O)cc1C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1 1829640840 QYAHNZRUDUBOQV-OAQYLSRUSA-N 451.332 0.612 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](C)CNC(=O)OC(C)(C)C)CCO2 1830747160 ALSSOTHTLHEGNL-VWKPWSFCSA-N 477.986 0.857 50 20 JCGD CC(C)[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1)c1ccccc1 1830842531 XIYFXAVCIXRSPE-BVAGGSTKSA-N 480.370 0.876 50 20 JCGD COC(=O)CSCC(=O)N1CCO[C@]2(COCCN(C(=O)CCBr)C2)C1 1831443340 XGHANDDGFITOCW-INIZCTEOSA-N 453.355 0.134 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)c1ccccc1)CCO2 1832218446 JCEFRVQSOYBYDY-NZQKXSOJSA-N 456.279 0.147 50 20 JCGD Cc1cnc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO3)cn1 1832549244 IYRUMTCEPKIIGE-AOMKIAJQSA-N 497.980 0.987 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc(Cl)nc1 1833010571 KWAPBJCZFZUFJM-UHFFFAOYSA-N 470.766 0.914 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)C1(O)CCC1 1833067265 DXBQPLMKBVDOJG-QGZVFWFLSA-N 457.380 0.103 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CCC(N3CCC(NC(=O)[C@@H](O)CCl)CC3)CC2)cc1 1833306727 ZZLNQWGJXVOHCE-PMACEKPBSA-N 453.967 0.900 50 20 JCGD Cc1ncccc1CCC(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1833747901 FBABLFPNXKHEET-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)s1 1833947789 NUSFODMKZMTFRC-UHFFFAOYSA-N 471.388 0.936 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)CC1)c1ccc(B(O)O)cc1 1834797756 CAEDQCZAMQJFQO-UHFFFAOYSA-N 470.291 0.367 50 20 JCGD COc1ccc(OCC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1834798009 MISRTBFIKPGFEQ-UHFFFAOYSA-N 495.385 0.639 50 20 JCGD COc1cccc(OC)c1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834798356 LFZBYVOYIJQYDS-UHFFFAOYSA-N 495.385 0.883 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)COc3ccccc3C)CCO2)C1 1835151392 NAPWGPGSZDXAAZ-WINMZROPSA-N 497.552 0.964 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc2c(c1)OCCO2 1835283023 VVVMUQOVPAUOKD-UHFFFAOYSA-N 493.369 0.637 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1(C(F)(F)F)CCC1)CCO2 1835471731 MLAMAESZSWWIKY-LJQANCHMSA-N 485.463 0.488 50 20 JCGD C[C@H](C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1)C1(O)CCC1 1835734652 OMBIQYXEDFBBFM-MRXNPFEDSA-N 472.590 0.421 50 20 JCGD O=C(c1cc(F)cc(Cl)c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835933963 KFIHGNQIOSCQKS-QFIPXVFZSA-N 476.697 0.543 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3cnn(C)c3)CCO2)C1 1835990722 AIYQEUKSVKDVQG-LPHOPBHVSA-N 457.369 0.983 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3c(s1)CCCC3)CCO2 1836877975 FCIVEHFKMRKRGY-XMMPIXPASA-N 484.383 0.691 50 20 JCGD C[C@H](C(=O)N1CCOC[C@@]2(CN(C(=O)CO[Si](C)(C)C)CCO2)C1)n1ccccc1=O 1837715215 COGJVYXJVIMXBT-DYESRHJHSA-N 451.596 0.717 50 20 JCGD Cc1ccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c(C)n1 1838359997 NJMDWOXEVUMNBI-HSZRJFAPSA-N 468.514 0.081 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncnc3)C2)C1 1838527632 YWIUBXHLWPBOJD-QFIPXVFZSA-N 485.453 0.694 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cc(C)nn3C(F)F)CCO2)C1 1838716023 PSTKZEXUQYSLOM-FZKQIMNGSA-N 450.870 0.910 50 20 JCGD O=C(CC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)Nc1ccc(F)cc1 1839028648 NZOYNQHAVHBQNA-OXQOHEQNSA-N 457.886 0.210 50 20 JCGD CCC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3cn4c(nc3=O)SCC4)CCO2)C1 1839044320 YWVNXCSSYJWEQL-IIBYNOLFSA-N 485.006 0.755 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H]3C[C@H](O)CN3C(=O)OC(C)(C)C)C2)C1 1839143708 GFLROBRBMXNGPY-DVSDUFGPSA-N 489.997 0.831 50 20 JCGD C[C@@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4n(n3)CCCNC4=O)C2)C1 1839153480 ZLAKPIOWJGDBDK-UXHICEINSA-N 488.372 0.323 50 20 JCGD CS(=O)(=O)c1ccc(F)c(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](F)Cl)C3)C2)c1 1839477136 YPVLJRIJPINULM-YJBOKZPZSA-N 466.890 0.834 50 20 JCGD O=C(c1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1839482485 ZDFGWXZAZKFBRU-BEFAXECRSA-N 467.866 0.141 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc4c(c3)CCNCC4)CCO2)C1 1839694581 QLAGOJBIECMTJC-GCJKJVERSA-N 466.966 0.094 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(C)n3nc(C)ccc3=O)C2)C1 1839965210 QQLVYGQKAPNDMK-IERDGZPVSA-N 499.406 0.917 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cc4cn[nH]c4cn3)C2)C1 1840033475 GQEOFRJPBAEONA-KPZWWZAWSA-N 452.309 0.811 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)C3=NN(c4ccccc4)C(=O)C3)C2)C1 1840152447 ILFQMBNQWXXPAM-HTAPYJJXSA-N 478.933 0.490 50 20 JCGD COc1ccc(COCC(=O)N2CCOC[C@]3(CN(C(=O)CCC(=O)NN(C)C)CCO3)C2)cc1 1840185550 RYHYDDCXUVLHAB-DEOSSOPVSA-N 492.573 0.041 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)CCSC(=N)N)C2)NC(=O)NCc1ccccc1 1845038646 CJUICFXCAAILGW-UHFFFAOYSA-N 461.592 0.553 50 20 JCGD COc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1OC 16128191 NICRUTVZPGRALM-UHFFFAOYSA-N 485.540 0.348 50 20 JCGD O=C(NNC(=O)[C@H]1CCCCN1S(=O)(=O)c1ccccc1)c1ccc(-n2cnnn2)cc1 22193218 GQHYUDUYCAWBHV-GOSISDBHSA-N 455.500 0.667 50 20 JCGD Nc1nccnc1C(=O)NNC(=O)c1ccc(S(=O)(=O)N2CCN(Cc3ccccc3)CC2)cc1 22278901 WEEJPARSFJFYIT-UHFFFAOYSA-N 495.565 0.640 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)[C@@H]2CCCCN2S(=O)(=O)c2ccccc2)c1 25416634 VJZRDLUSDQDAHZ-IBGZPJMESA-N 494.595 0.941 50 20 JCGD Cc1ccc(NC(=O)C(=O)NNC(=O)c2cc(S(=O)(=O)N(C)C)ccc2N2CCOCC2)cc1 726276168 LJGCFJWAKDRFKD-UHFFFAOYSA-N 489.554 0.482 50 20 JCGD COc1ccccc1C(=O)N[C@H](CCS(C)(=O)=O)C(=O)NNC(=O)C(=O)Nc1ccc(C)cc1 726276778 ZMUZJMRUTQCABC-QGZVFWFLSA-N 490.538 0.323 50 20 JCGD CN(C)N(C(=O)c1cc(S(=O)(=O)N2CCOCC2)ccc1Cl)[C@@H]1CCS(=O)(=O)C1 728175894 JGJDVBLMEDRNKT-CYBMUJFWSA-N 465.981 0.467 50 20 JCGD O=C(COC(=O)[C@@H]1CCCN1C(=O)Cc1ccccc1)NNC(=O)[C@H]1COc2ccccc2O1 728333600 KCQKUGHIWYLYLE-FXAWDEMLSA-N 467.478 0.751 50 20 JCGD O=C(COC(=O)[C@H]1CCN(c2ccc(F)cc2)C1=O)NNC(=O)[C@H]1COc2ccccc2O1 728335857 RUUWPTUJAMVYDR-MAUKXSAKSA-N 457.414 0.709 50 20 JCGD COc1ccc(C(=O)NNC(=O)[C@@H]2CCS(=O)(=O)C2)cc1S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1 728370750 BLYWGUUWPKCVRT-OFQRWUPVSA-N 487.600 0.558 50 20 JCGD O=C(NNC(=O)[C@@H]1CC(=O)N(c2ccc(F)c([N+](=O)[O-])c2)C1)C1CCN(c2ncccn2)CC1 728848134 WSKBNHFQIXLENL-CQSZACIVSA-N 471.449 0.941 50 20 JCGD Cc1ccc(S(=O)(=O)NNC(=O)C2CCN(c3ncccn3)CC2)c(C)c1OCC(=O)O 728853801 BOYFKYJJDBPBTB-UHFFFAOYSA-N 463.516 0.783 50 20 JCGD CC(C)OCCCn1c(NNC(=O)Cn2c(=O)c3c(ncn3C)n(C)c2=O)nc2ccccc2c1=O 729279461 GCAPUEYVZQCFQP-UHFFFAOYSA-N 496.528 0.102 50 20 JCGD Cc1cc(NC(=O)CSCC(=O)OCC(=O)NNC(=O)[C@@H]2COc3ccccc3O2)no1 782701425 FDGMHRVAZLNZDL-AWEZNQCLSA-N 464.456 0.185 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N([C@@H]2CCS(=O)(=O)C2)C1)c1ccc(COc2ccccc2)o1 912952917 HHHVQUPKTYZHKH-LSDHHAIUSA-N 461.496 0.655 50 20 JCGD CS(=O)(=O)CC[C@@H](NS(=O)(=O)/C=C\c1ccccc1)C(=O)NNC(=O)C1CCCC1 914849360 YCJWCACJYMUURW-VWILAXROSA-N 457.574 0.718 50 20 JCGD CS(=O)(=O)N1CCC(NC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1 916237838 NHXJXYOSJQSOAT-UHFFFAOYSA-N 498.569 0.756 50 20 JCGD O=C(NNC(=O)/C(=C/c1ccco1)n1nnnc1-c1ccccc1)N[C@H]1CCS(=O)(=O)C1 919889460 MMKNZHQTUPGODP-HNDQUVLASA-N 457.472 0.449 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)CCCC[C@@H]1SC[C@@H]2NC(=O)N[C@@H]12 921302326 SCLVINCLXKOYDM-KCQAQPDRSA-N 468.605 0.775 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(CCN(C(=O)c3ccc4c(c3)n(C)c(=O)n4C)C2)C1 1777867514 GEQCJSFOXASPNO-VFNWGFHPSA-N 450.923 0.574 50 20 JCGD C[Si](C)(C)OCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CS(=O)(=O)N2CCCC2)C1 1778089746 CAGOWMNMCARWQY-YLJYHZDGSA-N 475.684 0.777 50 20 JCGD CN1CCN(CC(=O)N2CC[C@@]3(C2)CN(C(=O)/C(C#N)=C/c2ccc(F)cc2F)CCO3)CC1 1778263915 NJAOTNJJSPILSZ-HNFCMGRUSA-N 473.524 0.949 50 20 JCGD Cn1c(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)ccc1C(F)(F)F 1779030012 DLCRHFPAHXNRAC-FQEVSTJZSA-N 480.447 0.800 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3cc(C(F)(F)F)ccn3)CCO2)C1 1779032675 QQKGGIWLIWFKOE-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD CCOC(=O)N[C@@H](O)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@](C)(Cl)CCl)C2 1779203732 ONDPJZMCEGAOMG-WZPWBUNQSA-N 454.351 0.801 50 20 JCGD O=C([C@H](O)CCl)N1CCO[C@]2(CCN(C(=O)[C@@H]3CCCN(c4cc(NC5CC5)ncn4)C3)C2)C1 1780909270 FDAGBXRKGOEXJY-UQNRQAKVSA-N 493.008 0.697 50 20 JCGD COC[C@@H](C)C(=O)N1CCO[C@]2(CCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780968956 LDHJINNNXLHYPS-JPYJTQIMSA-N 461.563 0.445 50 20 JCGD CC[C@H](Br)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@H](O)N1CCOCC1)C2 1781901270 KAQFNPBUTBLUKW-JHDROBOHSA-N 462.385 0.324 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H]3CC34CN(C(=O)OC(C)(C)C)C4)C2)C1 1783451516 ABAJQOXCXYFGJS-XDHUDOTRSA-N 493.605 0.446 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@@]2(CN(C(=O)c3cnc4sc(C)cn4c3=O)CCO2)C1 1783876463 YAUDPMGOGDBGSW-KUHUBIRLSA-N 454.936 0.762 50 20 JCGD C[C@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)C[C@@H]21 1783967838 XWCXRCWEPFAHAJ-KNPMLCFXSA-N 468.352 0.309 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H]3CCC(=O)N3)[C@H]2C1 1786676941 PTGLOZWRWBQEHO-KUZCPNRJSA-N 474.470 0.392 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc2c1OCC2 1787814128 SUUWJLBBASXSJR-YYWHXJBOSA-N 450.300 0.208 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)/C=C/C(=O)NCc3ccco3)[C@H]2C1 1788720797 MWBLVMMVWGCRDZ-XBTWKOANSA-N 453.923 0.686 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](C)[C@H]3SC(=N)NC3=O)C[C@@H]21 1791057265 JVSFRSZMEIEHFU-RHIYVLOFSA-N 461.382 0.552 50 20 JCGD N#Cc1ccc(CCC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)cc1 1792424301 LYKZLWMWAOPFAX-OPMZPASUSA-N 462.510 0.393 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H]1CC(=O)N(Cc2cccs2)C1 1793976345 MFYWVJPHEMXODQ-LSIDRNEPSA-N 469.991 0.940 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](Cc1ccccn1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](O)CCl)C2 1794154619 VVFBVTBTDBLDDO-PTIUUAQKSA-N 496.992 0.707 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(B(O)O)c1 1795741270 QQUONRLQQAJFBH-FAQVEIGNSA-N 472.734 0.474 50 20 JCGD C[C@@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796187804 FXAVIUQIHGWRCS-FZDIXFNVSA-N 459.352 0.779 50 20 JCGD Cc1nn2cc(CC(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)c3cccc(B(O)O)c3)nc2s1 1796189791 AXYFPDGTLOQNOY-VBUUOAMHSA-N 453.333 0.274 50 20 JCGD COc1cc(C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)c([N+](=O)[O-])cc1O 1796191923 PWUPNYVTDPCTOK-MUJYYYPQSA-N 469.259 0.554 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc2c1OC(C)(C)C2 1796262561 LNTCBYPDGUEZRZ-UPHUGPLXSA-N 458.559 0.976 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Br)Cc1ccccc1)C2)[C@@H](O)N1CCOCC1 1797808427 NWGFKTBFYMJBAR-KKXBDNRESA-N 496.402 0.233 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1cnccc1C(=O)NN 1798442577 CIUZSNNUVMFIJA-YYAJDYIMSA-N 484.557 0.854 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)[C@@H](O)CCl)C4)C[C@@H]2C1 1800696097 HOKKKDFDJBGFCN-KWCBCURJSA-N 471.982 0.823 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1Cc3ccccc3CN1C)C2 1801010608 LHWMSQBCUIDCMR-VLVHOKLOSA-N 457.575 0.006 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@](O)(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)C1 1801052520 RGHMFXZMHXEAHW-UUUMGPIQSA-N 494.358 0.638 50 20 JCGD CN(C)CC(=O)NC[C@H]1CCN(C(=O)CN(C)NC(=O)NCc2ccccc2)[C@H]1c1cccnc1 1806458206 AMYZRVYWVDILEU-QPPBQGQZSA-N 481.601 0.995 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)CCC(=O)N2CCCC2)[C@H]1c1cccnc1)c1cccc(B(O)O)c1 1807369337 HAKKDVULAOPRAL-YKSBVNFPSA-N 478.358 0.484 50 20 JCGD CC(C)(C)n1cc(C(=O)N2CC[C@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)nn1 1807373384 AKZISDNKVOGFQV-WIYYLYMNSA-N 476.346 0.741 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CSC(=N)N)[C@@H]1c1cccnc1 1808414658 KYZWZHVQVIACHR-PRBGLLFOSA-N 470.559 0.848 50 20 JCGD O=C(COC(=O)C(F)(F)F)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1810181286 CWYVIVMIWXYANU-CRAIPNDOSA-N 479.220 0.187 50 20 JCGD Cc1[nH]nc(C(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1F 1810297805 DUPFPYDXTWTEKN-IFXJQAMLSA-N 466.477 0.884 50 20 JCGD Nc1c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4ccc(B(O)O)cc4)sc3C2)sc2nccnc12 1815339605 JVVMWZUOPHVOHE-GFCCVEGCSA-N 494.367 0.949 50 20 JCGD COc1ccc(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn1 1815350573 YFXSKIIVSLNCDB-HNNXBMFYSA-N 452.301 0.766 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCCC[C@H]1c1cc(NC(=O)CCN2C(=O)C=CC2=O)n[nH]1 1815472084 PVXMBTQUUKDKHW-INIZCTEOSA-N 480.485 0.029 50 20 JCGD CC[S@@](=O)CCC(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cnccc2C(=O)NN)n[nH]1 1819403633 XQMKKXYYSNSKTF-HEJPQYQCSA-N 461.548 0.873 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)Nc1cc([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1819516209 NEBTXEHWUKRIAI-WMLDXEAASA-N 485.549 0.383 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cn1cc(Cl)cn1)CC2 1819794838 FMVLDOCJFQSDLD-NSHDSACASA-N 474.934 0.918 50 20 JCGD Cn1cccc(C(=O)N2CCCC[C@@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)c1=O 1824716872 VEYLZWZCRBLYJM-HXUWFJFHSA-N 466.542 0.931 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cccc(=O)n2O)CC1 1825493920 NPMMJXRZNQBKRV-SFHVURJKSA-N 468.514 0.631 50 20 JCGD N[C@H](C(=O)N1CCCC[C@H]1C1CCN(C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1 1826907613 LUFWAYYOLYKSGU-VXKWHMMOSA-N 450.348 0.695 50 20 JCGD CCNC(=O)N[C@H](C)C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2cnccc2C(=O)NN)CC1 1828924439 STELTUSPRSTDSZ-BEFAXECRSA-N 473.578 0.626 50 20 JCGD CN(CC(=O)N1CCC([C@H]2CCCCN2C(=O)COCCO)CC1)NC(=O)NCc1ccccc1 1830371884 HDMAPNRBLKSRPZ-JOCHJYFZSA-N 489.617 0.961 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C=C\C(=O)NC3CC3)C2)C1 1830539106 BDZIMXWMCAUSAU-ZWXCXDBRSA-N 458.353 0.309 50 20 JCGD C[C@@H](CBr)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4c3NC(=O)C4=O)C2)C1 1830539258 FVQRJAXSDYGIKP-YEJXKQKISA-N 494.342 0.922 50 20 JCGD O=C(CCc1ccc2c(c1)OCO2)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](O)CCl)CCO2 1830723528 PCHGWVSBLJDGIQ-IIBYNOLFSA-N 454.907 0.404 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CCOC[C@]2(CN(C(=O)[C@@H](O)CCl)CCO2)C1 1830737911 KKOKBEHHBZADHG-VWKPWSFCSA-N 475.970 0.442 50 20 JCGD CN(C)c1ccc(CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1830738485 PEDMWRXBJIHYGZ-DENIHFKCSA-N 453.967 0.741 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC([C@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831872028 ZSWQVIVAMVKOFP-FUHWJXTLSA-N 473.640 0.307 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)CC1 1831874514 JVFBNTJJVVDNLG-SFHVURJKSA-N 452.600 0.352 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cncnc3)C2)C1 1832549415 NGNCYFUYWZHUID-KKSFZXQISA-N 483.953 0.679 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ccno3)C2)C1 1832549416 NLGAWLYZHYWQPP-VBKZILBWSA-N 472.926 0.877 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CCO[C@]4(COCCN(C(=O)c5ccc(B(O)O)cc5)C4)C3)c2c1 1832742920 QRFXTNXSLWWLKI-AREMUKBSSA-N 491.353 0.469 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc4nccn4c3)CC2)CC1)c1ccc(B(O)O)cc1 1834798588 NKPZNVNCGMZNPX-UHFFFAOYSA-N 475.358 0.513 50 20 JCGD Cn1cccc1C(=O)C(=O)N1CCC(N2CCC(NC(=O)c3cnccc3C(=O)NN)CC2)CC1 1835737396 PIPNSOLDAXZLPZ-UHFFFAOYSA-N 481.557 0.092 50 20 JCGD CC(C)n1nccc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1835947646 ZWDIEPMNULQMSX-UHFFFAOYSA-N 482.589 0.962 50 20 JCGD C[C@H](CBr)C(=O)N1CCC(OC2CCN(C(=O)C[C@@H]3NC(=O)NC3=O)CC2)CC1 1836670622 SBOGRKXOSUJNCG-DOMZBBRYSA-N 473.368 0.614 50 20 JCGD CCc1ncccc1C(=O)N1CCOC[C@@]2(CN(C(=O)c3cnccc3C(=O)NN)CCO2)C1 1837456982 RPHNJCYONHIKET-QHCPKHFHSA-N 468.514 0.026 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc(Cl)c3)C2)C1 1837459253 AFVUISZDMSJFOD-QFIPXVFZSA-N 473.917 0.722 50 20 JCGD O=C(c1nc[nH]c1[N+](=O)[O-])N1CCOC[C@]2(C1)CN(C(=O)[C@H](F)Br)CCO2 1839200746 MBQFKKUPEGAPPO-HZMBPMFUSA-N 450.221 0.078 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3[nH]cnc3-c3cccnc3)C2)C1 1840154446 XCSBPEWWKCAPAF-IERDGZPVSA-N 463.922 0.796 50 20 JCGD Cc1ccn2c(=O)c(C(=O)N3CCOC[C@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)cnc2c1 1840188695 XJTONQLQVJPNJH-FQEVSTJZSA-N 469.325 0.877 50 20 JCGD NC(=O)c1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](F)Br)C3)C2)cc1 1840647992 ZGFCCMXUTLMULG-KBXCAEBGSA-N 458.284 0.546 50 20 JCGD COc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)ccc1[N+](=O)[O-] 1840757158 QNAAGQPAFYHYLQ-HNAYVOBHSA-N 457.867 0.273 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H]2COC[C@@]2(C(=O)N2CCCC23CN(C(=O)[C@H](O)CCl)C3)C1 1841081431 ZEMLRLKCITUGCW-ZSDSOXJFSA-N 457.955 0.673 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@H]2CC(=O)N(Cc3cccs3)C2)C1 1841980474 SVJNQNHDFOUMIT-INIZCTEOSA-N 461.588 0.673 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@@H]1CC[C@@H]3CCC(=O)N3C1)C2)NC(=O)NCc1ccccc1 1845039180 NQHACGADHVFBOB-NHCUHLMSSA-N 496.612 0.937 50 20 JCGD O=C(NNC(=O)N1CCN(S(=O)(=O)c2ccc(F)cc2)CC1)c1csc(N2CCOCC2)n1 9755805 WWLUPDOSPBUTOH-UHFFFAOYSA-N 498.562 0.480 50 20 JCGD CCCCOc1ccc(C(=O)NNC(=O)Cn2cc(Br)c(=O)[nH]c2=O)cc1OC 24288584 UENYDFTYDBNJMM-UHFFFAOYSA-N 469.292 0.948 50 20 JCGD Cc1cc(C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c2c(C)nn(C)c2n1 28028443 LJPXIQBVDYPNLR-UHFFFAOYSA-N 472.527 0.681 50 20 JCGD O=C(COC(=O)[C@H]1C[C@H](O)CN1C(=O)c1ccc2c(c1)CCC2)NNC(=O)c1ccccc1 726000771 NIPOHFAMQIOMRW-VQTJNVASSA-N 451.479 0.755 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CNC(=O)c3ccc(F)cc3F)cc2)CC1 728214410 OOFVZHXTWDZBKL-UHFFFAOYSA-N 467.498 0.774 50 20 JCGD CNC(=O)c1ccc(C(=O)NNC(=O)c2cccc(S(=O)(=O)NCc3ccccc3)c2)cn1 728511151 AMLALRASVMCIJC-UHFFFAOYSA-N 467.507 0.995 50 20 JCGD Cc1ccc(F)c(NC(=S)NNC(=O)c2cccc(S(=O)(=O)N3CCNC(=O)C3)c2)c1 745195865 RVELKRAHOUETFL-UHFFFAOYSA-N 465.532 0.886 50 20 JCGD COc1ccc(S(=O)(=O)NCC(=O)NNC(=O)c2cc(OC)c(OC)c(OC)c2)cc1OC 767923256 UZFMQZIDYRBMDT-UHFFFAOYSA-N 483.499 0.469 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(N2CCC(C(=O)N3CC[C@@H](B(O)O)C3)CC2)c([N+](=O)[O-])c1 864232910 DDVYGJXHDRQOSV-MRXNPFEDSA-N 482.368 0.917 50 20 JCGD COCCN1C[C@H](C(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCCCC3)c2)CC1=O 914457224 UBGHBDNTZHGWAU-MRXNPFEDSA-N 452.533 0.117 50 20 JCGD COc1cc2c(cc1OC)[C@@H](CC(=O)NNC(=O)N[C@@H](C)Cn1ccnc1)N(S(C)(=O)=O)CC2 916623408 RKMNVRKHYYIZJA-WMLDXEAASA-N 494.574 0.568 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1 917721466 UYVWDCCKIOOVJF-UHFFFAOYSA-N 456.502 0.842 50 20 JCGD CS(=O)(=O)Nc1ccc(S(=O)(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c(F)c1 919958444 FZGMFBZTBLRHDD-UHFFFAOYSA-N 465.506 0.224 50 20 JCGD COc1ccc(OC)c(CC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)c1 921188920 WOKINUHGYNPTNG-UHFFFAOYSA-N 463.512 0.728 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(CCN(C(=O)c3nc4ncccn4n3)C2)C1 1777825895 ULLICZBBLARVRE-QKKBWIMNSA-N 493.952 0.700 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3ccc(OC(F)F)cn3)CCO2)C1 1779028214 HHCMZBSHGPGPHP-NRFANRHFSA-N 476.440 0.439 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(CN(C(=O)c3ccnc(C(F)(F)F)c3)CCO2)C1 1779029342 VYWFTQGRPSPOGO-HXUWFJFHSA-N 478.431 0.856 50 20 JCGD COc1ccc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)cc1N(C)C 1780660301 YTLVNQQKVNWSOG-ZEQKJWHPSA-N 495.385 0.882 50 20 JCGD O=C(CN1C(=O)C2(CCOCC2)c2ccccc21)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1780932975 PJCPKZQFQXAWIE-WMZHIEFXSA-N 491.972 0.511 50 20 JCGD CN(CC(=O)N1CC[C@@]2(C1)CN(C(=O)c1ccncc1O)CCO2)NC(=O)NCc1ccccc1 1780968553 NREXQTBOPZWUAB-XMMPIXPASA-N 482.541 0.577 50 20 JCGD C[C@H](C(=O)N1CCO[C@]2(CCN(C(=O)[C@@H](F)Br)C2)C1)[C@H]1SC(=N)NC1=O 1781331751 VNCXBZZXHKCTRK-FHTCGPRVSA-N 451.318 0.309 50 20 JCGD CCOC(=O)O[C@@H](C)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)C2 1781516935 XDDUGXJGBWDVQA-GCKMJXCFSA-N 456.540 0.435 50 20 JCGD CC(=O)N1CCN(CC(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)[C@H](C)Br)C2)CC1 1781999336 WELVQYHVSJIVHY-XAUMDUMWSA-N 473.412 0.448 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(S(C)(=O)=O)ccc3F)C2)C1 1782151757 WJTIOIGPERHWTP-OAQYLSRUSA-N 484.550 0.046 50 20 JCGD O=C(CCc1cccc(O)c1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2 1782318963 QDULANQZXWBFNE-RCZVLFRGSA-N 466.343 0.832 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@@]2(CN(C(=O)CN3CCN(C(C)=O)CC3)CCO2)C1 1783349839 SSFOXFIXTBGOEE-VQIMIIECSA-N 459.385 0.154 50 20 JCGD O=C(CCc1cnc2[nH]ccc2c1)N1CC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1783680775 WJBXKOATUNEZDR-DEOSSOPVSA-N 462.315 0.319 50 20 JCGD C[C@@H](CBr)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3nc4ncccn4n3)C[C@@H]21 1783966899 MEJFOOXZAKTLMW-XUXIUFHCSA-N 451.325 0.749 50 20 JCGD O=C(CCCC(=O)Nc1ccccc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21 1784050412 CVQAAPAHRNBLOY-VJBMBRPKSA-N 493.369 0.769 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H]3CCCCN3C)[C@H]2C1 1784117552 RHLWHHBDBBWZFU-NUFLIATCSA-N 458.563 0.584 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](O)CCl)C[C@@H]21 1785075317 GNBJNBXIDWZQDJ-YTFOTSKYSA-N 468.378 0.698 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cc2sccn2c1 1787273732 WLQRUYXCTFJWFJ-SNRMKQJTSA-N 453.329 0.588 50 20 JCGD O=C(Nc1ccc(C2(NC(=O)c3cc(C(=O)O)ncn3)CCC2)cc1)c1ccc(B(O)O)cc1 1788140100 GSLGSZUMRFJNCL-UHFFFAOYSA-N 460.255 0.916 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H]3CCCCO3)C[C@@H]21)NC(=O)NCc1ccccc1 1789724674 JSHXHNVNBJCHCY-KJJMTIBFSA-N 487.601 0.881 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN3CC(=O)NC3=O)C[C@@H]21 1790693846 PQYJJUXIFUPSBD-JLBONTIYSA-N 487.463 0.403 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@@H](C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)[C@H](O)C1 1792453916 XPMDFIKUJWXTCT-XLWJZTARSA-N 480.389 0.998 50 20 JCGD COc1ccc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2ccc(B(O)O)cc2)C3)c(Cl)c1OC 1792683623 VEDNFNVOSJJMDB-YVWYUNDQSA-N 488.733 0.554 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@H](C)CBr)n1 1792870753 KOMFBIRJVKDQHL-JJAZEVLHSA-N 469.380 0.907 50 20 JCGD CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@H](C(=O)N1C[C@@H]3COC[C@H](C1)[C@@H]3NC(=O)[C@@H](O)CCl)C2 1792984104 YMIAIMZPKGQMMY-FUZWODELSA-N 471.982 0.964 50 20 JCGD COc1cc(CC(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)c2ccc(B(O)O)cc2)C3)cc(OC)c1OC 1793902177 FVZFTDQGUFJCTQ-ACDBMABISA-N 482.342 0.887 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)cncc1F)C2 1796441508 MBLJKFNLZSKSOZ-CGKUBJGISA-N 460.441 0.697 50 20 JCGD CN(C)c1ncc(C(=O)NC[C@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)o1 1805344048 QCIJKXNQTSQHFC-XLIONFOSSA-N 463.303 0.449 50 20 JCGD COc1ccc([C@H](O)C(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)cc1 1807362160 ZTUUMUMLCWJLBG-QDSKXPNFSA-N 489.337 0.823 50 20 JCGD CN1CCCC[C@H]1C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807365849 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COc1cc(C)c(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c(C)c1 1839407545 UVUCYCCWYVATPI-VWLOTQADSA-N 482.342 0.376 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc3c(c1)C(=O)CC3)CCO2 1839530530 UUCMWXWOKCPZJT-DEOSSOPVSA-N 472.542 0.259 50 20 JCGD COC(OC)C(=O)N1CCOC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1839742167 QNPOFDUNIAQMNF-KYIYGJGQSA-N 465.453 0.947 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)NC(=O)c3cnccn3)C2)C1 1839965393 XHDVFGIKMKAITG-AUSJPIAWSA-N 498.378 0.225 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)C(C)(C)c1ccccn1)CCO2 1840330159 NKQPMZCZAGTQDQ-HSZRJFAPSA-N 461.563 0.189 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)CCc2noc(-c3ccccc3)n2)C1 1844997952 GGNMGWUYIYVOKU-UHFFFAOYSA-N 460.299 0.866 50 20 JCGD CN(CC(=O)N1CCCC12CN(C(=O)[C@H](N)c1ccccn1)C2)NC(=O)NCc1ccccc1 1845038840 ZZXSUGNQBLOCCN-OAQYLSRUSA-N 465.558 0.631 50 20 JCGD NC(=O)[C@H](N)CCC(=O)N1CC2(CCCN2C(=O)[C@@H](Br)Cc2ccccc2)C1 1845941173 IVSNTDKRMDTTFA-JKSUJKDBSA-N 451.365 0.789 50 20 JCGD CC(C)(C)OC(=O)N1CCC2(CC1)C(=O)NC[C@H]2C(=O)N1CCCC12CN(C(=O)[C@@H](O)CCl)C2 1846118820 FSZCADLTJUVFOW-HOTGVXAUSA-N 499.008 0.553 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)c1cc(N(C)C(=O)OC(C)(C)C)nn1C)C2 1846384749 DBXRGKBSOBAZLN-UHFFFAOYSA-N 491.593 0.981 50 20 JCGD COc1ccc(C(=O)NNC(=O)C(=O)NC2CC2)cc1S(=O)(=O)NCc1ccc(Cl)cc1 10215901 XTXIEUOFOQSEIP-UHFFFAOYSA-N 480.930 0.867 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(=O)n(CC(=O)NNC(=O)c2cc(Br)c[nH]2)c1 28717575 UYTZDFLMUIMMMQ-UHFFFAOYSA-N 474.337 0.431 50 20 JCGD CC(=O)N1CCN(S(=O)(=O)c2ccc(C(=O)NNC(=O)CNc3ccc(C)cc3)cc2)CC1 104856850 YXNBKYFMBLERSE-UHFFFAOYSA-N 473.555 0.721 50 20 JCGD C[C@@H]1CN(C(=O)c2ccc(CNC(=O)NNC(=O)CNC(=O)c3ccco3)cc2)C[C@@H](C)O1 725870216 DEGPRNSWNJUVJL-HUUCEWRRSA-N 457.487 0.789 50 20 JCGD COc1cccc(CC(=O)N2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)c1 725873976 VSTWBYZPNOTDFA-UHFFFAOYSA-N 459.528 0.614 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)CCn3c(=O)nc(O)c4ccccc43)cc2)CC1 728213412 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O=C(NCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1)c1ccc[nH]1 1832877935 ORCKSYSZWGPTMT-MAUKXSAKSA-N 475.315 0.282 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)CCc3ccccn3)CCO2)C1 1833186133 WIFORXWZEHZFLM-JZZXMACJSA-N 482.541 0.605 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1ccc(F)cn1 1834296479 DKKMQPGOEYKRMS-UHFFFAOYSA-N 454.311 0.400 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCC(N2CCC(NC(=O)c3cc(=O)n4[nH]cnc4n3)CC2)CC1 1834797161 CKNIWVZMCMVQAV-FQEVSTJZSA-N 484.388 0.839 50 20 JCGD Cc1ccc(CCC(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)nc1 1834797390 IBOFKGLGBPENJY-UHFFFAOYSA-N 478.402 0.888 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)Cc3ncccn3)CC2)CC1 1835118305 MSSSFIGRFTWQRO-STBIYBPSSA-N 480.573 0.725 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)[C@@H](O)CCl)CC2)CC1)[C@H]1ON=C(c2ccccc2)O1 1835673811 IZABCCJATQHCBJ-PGRDOPGGSA-N 464.950 0.892 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cc(F)c[nH]3)CC2)CC1 1835738070 BHFLNMFQQYXOST-UHFFFAOYSA-N 457.510 0.651 50 20 JCGD CCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc1 1835931679 WZEUVRLLDVMNLD-XMMPIXPASA-N 452.316 0.313 50 20 JCGD COc1cccc(C(=O)N2CCOC[C@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)c1C 1835939600 BNKLTIKEFXBGAT-DEOSSOPVSA-N 468.315 0.067 50 20 JCGD Cc1cc(C)n2ccc(C(=O)N3CCOC[C@@]4(CN(C(=O)c5cccc(B(O)O)c5)CCO4)C3)c2n1 1835939699 YEXPVPJZQGJIOF-RUZDIDTESA-N 492.341 0.015 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc4ncccn4n3)CCO2)C1 1836873926 GSFGTLYVNIBUBO-LIRRHRJNSA-N 466.336 0.973 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C[C@H]1CNc3ccccc3O1)CCO2 1837355987 IQISZRQSOPZAPA-UUOWRZLLSA-N 489.573 0.079 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(Cl)nc3)C2)C1 1837455744 FTRDALQAYNTFEG-OAQYLSRUSA-N 474.905 0.117 50 20 JCGD CC(C)(C)c1cnc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)cn1 1837458811 DUYGCYGHUAUVQZ-DEOSSOPVSA-N 497.556 0.156 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3cc4n(n3)CCC4)CC2)CC1 1837921297 WHDLXEFJTXUDLY-UHFFFAOYSA-N 466.347 0.435 50 20 JCGD O=C(c1csc(C(F)(F)F)n1)N1CCO[C@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1 1838185761 DKPHJAGJSKKLPQ-IAQYHMDHSA-N 457.858 0.832 50 20 JCGD CCOc1cccc(C(=O)N2CCO[C@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1839018328 MHTLUFPMLCNJLK-DEOSSOPVSA-N 468.315 0.149 50 20 JCGD C[C@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1)N(C)C(=O)OC(C)(C)C 1839075838 PBBYGXOGXSARTR-UZUQRXQVSA-N 499.609 0.071 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3cccc(-n4cncn4)c3)CCO2)C1 1839437295 PPHKRBGPKPDGDB-NQIIRXRSSA-N 463.922 0.591 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cnn3c1OCCC3)CCO2 1839518419 WJZQUJGAEPUTHM-HXUWFJFHSA-N 452.584 0.587 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@H](F)Br)C2)C1 1839685104 GHCHBNSWMBVFSN-BFQNTYOBSA-N 455.277 0.695 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cnc4ncccn34)C2)C1 1839964949 JTXKKISTMCAUPK-AUUYWEPGSA-N 466.336 0.973 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cc(Cl)ccn3)C2)C1 1840153685 XRYUULNHNXGNTE-BEFAXECRSA-N 462.330 0.824 50 20 JCGD CC(C)(C)OC(=O)NCCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1840905571 MLILSCZINLXFAM-YWZLYKJASA-N 463.959 0.347 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)C1CCSCC1)CCO2 1840924511 RHMDADOQMGGRAP-ZHNJOBQTSA-N 477.587 0.720 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2n[nH]cc2[N+](=O)[O-])C1)NC(=O)NCc1ccccc1 1844412281 JVYOHOJSNBPBLS-UHFFFAOYSA-N 470.490 0.481 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)c1cc(C(C)=O)c[nH]1)c(=O)n2Cc1ccccc1 10161483 BWJBXFIGVWPZRU-UHFFFAOYSA-N 477.481 0.420 50 20 JCGD CC(C)n1nc(C(=O)NNC(=O)CN2C(=O)NC3(CCCCC3)C2=O)c2ccccc2c1=O 17196476 XBLHFHJTMXAHOG-UHFFFAOYSA-N 454.487 0.993 50 20 JCGD COc1cc(C(=O)NNC(=O)c2ccc(C)c(S(=O)(=O)NCC#N)c2)cc(OC)c1OC 726879929 CPEPYLCLNIRGLQ-UHFFFAOYSA-N 462.484 0.898 50 20 JCGD O=S1(=O)CC[C@@H](S(=O)(=O)N2CCN(S(=O)(=O)c3ccc(CCCCl)cc3)CC2)C1 726974657 NPBGCHXTQYTIGF-QGZVFWFLSA-N 485.049 0.681 50 20 JCGD CN1CCN(S(=O)(=O)c2ccc(NNC(=O)Cn3c(=O)nc(O)c4ccccc43)cc2)CC1 728214127 LUIOFGBPDIGZOH-UHFFFAOYSA-N 472.527 0.182 50 20 JCGD CCOC(=O)c1ccc(Br)c(S(=O)(=O)NNC(=O)CNC(=O)c2ccco2)c1 728506891 ITKCSRVCIFKPOC-UHFFFAOYSA-N 474.289 0.958 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)NCC2(N3CCCC3)CCOCC2)c1 729624307 VJSZJDMFXJTNFY-UHFFFAOYSA-N 453.565 0.526 50 20 JCGD O=C(NNC(=O)c1cc(S(=O)(=O)N2CCOCC2)c(Cl)cc1Cl)C(=O)N1CCCC1 748246797 PSLWMTVXLLRGEP-UHFFFAOYSA-N 479.342 0.398 50 20 JCGD CC(C)[C@H](NC(=O)COc1ccccc1)C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 750668141 DGVWGYQKURWVMB-IBGZPJMESA-N 451.483 0.914 50 20 JCGD COc1ccc([C@@H](CNC(=O)NNC(=O)c2nn(C)c(=O)c3ccccc23)N2CCOCC2)cc1 915896602 HQLFSOHCXXSAKR-HXUWFJFHSA-N 480.525 0.960 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)NCC[C@@](O)(c1nccn1C)C(F)(F)F 916378418 NGRXJNPVMQSQAN-QGZVFWFLSA-N 491.496 0.806 50 20 JCGD CCNC(=O)c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cc1 916392254 SNRQHWOIQZGOGA-UHFFFAOYSA-N 475.575 0.594 50 20 JCGD CN1CCN(C(=O)CCNC(=O)NNC(=O)c2ccc(Cn3nnc(-c4ccccc4)n3)cc2)CC1 916433149 CHJVADYKOVIDCH-UHFFFAOYSA-N 491.556 0.497 50 20 JCGD C[C@H]1CCCN([C@@H](C)CNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 916450448 OPNGNJFXGBYUOW-IRXDYDNUSA-N 467.592 0.772 50 20 JCGD O=C(CCCNS(=O)(=O)c1cccc(C(F)(F)F)c1)NNC(=O)N[C@H]1CCS(=O)(=O)C1 919885825 RXGANOJTSINQSU-LBPRGKRZSA-N 486.494 0.281 50 20 JCGD CSC[C@H](C(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12)N1C(=O)[C@@H]2CCCC[C@H]2C1=O 933651690 JLTCWBPJQLWMQY-BZUAXINKSA-N 471.539 0.601 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1nnsc1C1CC1)C2 1779373452 SNWPUDQUHSQUGS-OPAMFIHVSA-N 485.570 0.855 50 20 JCGD CCOC(CC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cnccc2C(=O)NN)C1)OCC 1779375360 LNFRIJOVIDOVAT-WZONZLPQSA-N 477.562 0.602 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C(F)(F)F)nn3C)C2)C1 1779656558 CRVJYKGBBTXPHH-GOSISDBHSA-N 460.457 0.255 50 20 JCGD Cc1c(C(=O)N2CC[C@@]3(C2)CN(C(=O)[C@H](F)Br)CCO3)cn2[nH]cnc(=O)c12 1780019567 FRZLJVDEYYCIJE-SUMWQHHRSA-N 456.272 0.465 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)/C=C\C(=O)NC3CC3)CCO2)C1 1780098001 WXMKROPZQRKUHK-KSEXMQBYSA-N 486.481 0.798 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CC[C@@]2(CN(C(=O)CN3CCCCC3=O)CCO2)C1 1780098435 MCNRRUKKYVAZDF-HSZRJFAPSA-N 488.497 0.976 50 20 JCGD Cc1nccc(C(=O)N2CCO[C@]3(CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C3)C2)n1 1780967952 FTMCDNTUAQSGRC-DEOSSOPVSA-N 481.557 0.575 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3ccnc4c(O)cccc34)C2)C1 1782503749 KAWYCZXCRGWALF-DEOSSOPVSA-N 461.283 0.378 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(C1)CN(C(=O)Cc1ccc(Cl)cc1[N+](=O)[O-])CCO2 1783933126 QYBNKGAAYAJVBK-OAQYLSRUSA-N 481.937 0.994 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)c1ccc(C(F)(F)F)nc1)CCO2 1783936903 XHNWRWPONTXFAH-IBGZPJMESA-N 457.453 0.917 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(CN(C(=O)CCc3ccc(N(C)C)cc3)CCO2)C1 1783936907 AFOMFDOUGGSUCH-XMMPIXPASA-N 459.591 0.888 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@]2(C1)CN(C(=O)[C@@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)CCO2 1783937156 QBOPDSKHOSDGSU-MBBIILEFSA-N 493.605 0.302 50 20 JCGD CC(C)(C)OC(=O)N1[C@H](C(=O)N2CC[C@@]3(CN(C(=O)[C@H](O)CCl)CCO3)C2)C[C@H]2C[C@H]21 1785589296 IZSUCOHMLREHJS-WCYOCWRHSA-N 457.955 0.814 50 20 JCGD COc1ncc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)cc1F 1785639265 OBYAVIXZKSWGPK-IWEFOYFVSA-N 472.477 0.135 50 20 JCGD CC(C)(C)OC(=O)N1CC=C(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4ccc(B(O)O)cc4)[C@H]3C2)C1 1786978615 DFJRMFOUICHQJW-JBACZVJFSA-N 499.373 0.137 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cnc(C(F)(F)F)cn1 1787247103 JUHRABCZWHGMLI-QRTARXTBSA-N 478.236 0.082 50 20 JCGD C[C@@H](O)[C@H](NC(=O)c1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](F)Cl)[C@H]2C1 1787444666 GCMBSOHDRUSIQA-HDDDPEMOSA-N 455.914 0.680 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cc(C(F)(F)F)c[nH]3)[C@H]2C1 1787592255 SUYIHUFUBNSCJV-KCTSRDHCSA-N 480.447 0.939 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21)c1cccc2ncccc12 1787822823 POVBFYBFXVQXDH-HYVJGQCMSA-N 459.311 0.822 50 20 JCGD COc1ccc2nc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cccc(B(O)O)c5)C[C@@H]43)ccc2c1 1787980920 QCJSCKYCBVWAHN-XZOYJPPVSA-N 489.337 0.830 50 20 JCGD Cn1ncc2cc(C(=O)NC[C@@H]3OC[C@@H]4CCN(C(=O)c5cnccc5C(=O)NN)C[C@@H]43)ccc21 1788062819 LGMXRVBNCJNGJW-ZRCAFCQKSA-N 477.525 0.479 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H]3Cc4ccccc4O3)C[C@@H]21 1788611338 VLNZHSHQPAGTNW-HGWQEYRNSA-N 465.510 0.282 50 20 JCGD COc1cc(OC)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cnccc4C(=O)NN)C[C@@H]32)c1 1789548380 IVNKXNIINZJBPB-WVFSVQOHSA-N 483.525 0.609 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CO)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](F)Br)[C@H]2C1 1789922340 DDAOQRNFJQQCTL-PEDHHIEDSA-N 482.347 0.542 50 20 JCGD CN(C)c1c(F)cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)cc1F 1790297762 XQOOUAJNPOCNLQ-XERREHJYSA-N 487.312 0.618 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@]3(O)CCN(C(=O)OC(C)(C)C)C3)C[C@@H]21 1791257461 IGDYHPQEJMEHDD-FVMGUFKOSA-N 489.997 0.592 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)/C=C/C(=O)c3cccs3)C[C@@H]21 1791290875 CMQHHUMZSZFTFR-VEUWBBGLSA-N 462.572 0.840 50 20 JCGD COc1c(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@H]3C2)ccc(F)c1F 1791293701 BNUHJBBUJQLCFW-QRTARXTBSA-N 468.501 0.940 50 20 JCGD CC(C)(C)OC(=O)N[C@H](C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@H](O)CCl)C[C@@H]21)C(C)(C)O 1792272224 MBXMZMGGTLCBJS-ARKGTOAJSA-N 477.986 0.230 50 20 JCGD COc1cc(N2CCC(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)c3cccc(B(O)O)c3)C4)CC2)ncn1 1793305283 MRQSTKUUURYCAJ-WKCHPHFGSA-N 493.373 0.333 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@H]1NC(=O)NC1=O 1793945580 PWEWJKTYBHLRHT-HCJCQPSYSA-N 473.436 0.059 50 20 JCGD CC[C@@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cncc(S(C)(=O)=O)c1 1794319966 NROHFSCBBQVLOF-OCVGTWLNSA-N 474.377 0.862 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2)c1scnc1C(F)(F)F 1794979689 LAWMWCQYIGMQCZ-DABQJJPHSA-N 469.250 0.359 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)Cc1ccccc1Cl 1795227754 LTROEDHZHLAROT-YVWYUNDQSA-N 457.918 0.784 50 20 JCGD Cn1cc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)c(C(F)(F)F)c1 1795734474 QHQQYPAQEPEGQP-ZSBFGKGUSA-N 465.237 0.241 50 20 JCGD C=C1C[C@@H](C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)N(C(=O)OC(C)(C)C)C1 1795736871 OWFSISSTUKTQKH-YHELAOLJSA-N 499.373 0.135 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cccc(B(O)O)c2)cc1 1796191187 IVJHVMGDTBSOPS-ACDBMABISA-N 470.356 0.264 50 20 JCGD COc1cc(OC)c(F)c(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1798549081 URBXSLRAPLRAAJ-NXCRSVRDSA-N 487.488 0.358 50 20 JCGD O=C(N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1n[nH]c2c1CCc1ncccc1-2)c1cccc(B(O)O)c1 1799166636 BDXFNFSXECDPTB-BCDXTJNWSA-N 471.326 0.816 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2occc2c1O 1800015202 HFABPDTXOYGQEO-YVWYUNDQSA-N 450.256 0.335 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc2nn[nH]c2c1 1800141238 RPXPRGYMLDJYLI-UYNJTKMTSA-N 464.486 0.295 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](Cl)COC 1800975319 MMQALEGHWMCVEI-DGADGQDISA-N 463.959 0.370 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)/C=C/c1ccccc1[N+](=O)[O-] 1802109014 PEWACJQGVXSVBX-CTSHNCOSSA-N 480.481 0.510 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](C)NC(=O)c1ccccc1 1802112992 JEUCRJLPNQTMDI-DMVMMSTBSA-N 494.552 0.529 50 20 JCGD C#CC[C@@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](Cl)COC)C2 1802128095 NBLUQBVXCWIQHQ-NNXHMXCWSA-N 457.955 0.746 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)Cn2nnc3ccccc32)[C@@H]1c1cccnc1 1804019368 UAXWKJVLMVNRJJ-SBUREZEXSA-N 499.535 0.845 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)/C=C/c2cnccn2)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807363636 AXWCYHDKYNTTFO-WMEGFXLRSA-N 457.299 0.584 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1 1808110168 PYSPLWNNTZXOIV-YWZLYKJASA-N 485.508 0.985 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1ccc2ncnn2c1 1810054174 YQHRNCFPIBXKBG-PGRDOPGGSA-N 470.298 0.438 50 20 JCGD CC(=O)NC(C)(C)C(=O)N1CC[C@H](CNC(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1810293486 FGMWGVDPQSSWFM-APWZRJJASA-N 467.530 0.314 50 20 JCGD CN(CC(=O)NC[C@@H]1CCN(C(=O)CO[Si](C)(C)C)[C@@H]1c1cccnc1)C(=O)C(=O)O 1812392947 WERVAIBRNWVZQN-MAUKXSAKSA-N 450.568 0.482 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)C(=O)c2cccn2C)[C@H]1c1cccnc1 1813072445 CDDGNAMPSUYLQB-UWJYYQICSA-N 454.531 0.682 50 20 JCGD CCN1CCC(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)CC1 1814241908 FRKSQCNOCJULNZ-JTHBVZDNSA-N 464.375 0.813 50 20 JCGD O=C(CCN1CCCC1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1814265411 OPOOIHDEALHUIP-NFBKMPQASA-N 450.348 0.567 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2ccc(B(O)O)cc2)n[nH]1 1817470782 GWDZPPGWDNNTCF-QGZVFWFLSA-N 452.280 0.451 50 20 JCGD CC(C)n1cnc(C(=O)N2CCCC[C@H]2c2cc(NC(=O)c3cccc(B(O)O)c3)n[nH]2)n1 1817475620 WGLHSULOUKBQKQ-KRWDZBQOSA-N 451.296 0.882 50 20 JCGD CCC[C@@H](NC(C)=O)C(=O)N1CCCC[C@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817478806 HYVQODXUHPNZBD-MJGOQNOKSA-N 455.324 0.700 50 20 JCGD O=C(/C=N/N1CCCCC1)Nc1cc([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1819392987 BAYRUMRWLLOKFC-WWJLXRQJSA-N 452.324 0.867 50 20 JCGD COc1nn(C)cc1C(=O)N[C@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819794693 BPZMPCDAERIFGI-JTQLQIEISA-N 470.515 0.423 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CNCP(=O)(O)O)[nH]n1)[C@H](F)Br 1820932257 FHTSGZZDXHMXQA-CABZTGNLSA-N 456.209 0.817 50 20 JCGD NC(=O)c1nccnc1C(=O)N[C@@H]1CCc2nc(NC(=O)[C@@H](F)Br)sc2C1 1823006381 DXPIJRXSPBUDQF-KSBSHMNSSA-N 457.285 0.948 50 20 JCGD CN[C@@H](CC(=O)N1CCC([C@H]2CCCCN2C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)CC1)C(=O)O 1827680918 LATQGNPMESKXQB-FRXCEDINSA-N 474.562 0.803 50 20 JCGD O=C(c1nc[nH]n1)N1CC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCN2C(=O)OCc1ccccc1 1828551068 HFESHOWVJPATAA-HRAATJIYSA-N 476.921 0.470 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1C[C@H]1c1ccc(F)cc1)CCO2 1830419586 XEYMBRIFSFCWNM-HWBMXIPRSA-N 482.317 0.379 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1831135993 AZYXJCDYRJCSOB-OXQOHEQNSA-N 481.949 0.909 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncon3)C2)C1 1832549413 NGLXSSMNFSILDV-ORAYPTAESA-N 473.914 0.272 50 20 JCGD CCC(=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)CCO2 1832551120 BVUGQHPNZFDGKY-VBKZILBWSA-N 461.943 0.554 50 20 JCGD CN1N=C(C(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)CCC1=O 1833689319 CTIQTUGDTRKTJP-INIZCTEOSA-N 460.348 0.857 50 20 JCGD COc1ncc(C(=O)NC2CCN(C3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)cc1F 1833966243 SOMCMPHNOQVPLL-UHFFFAOYSA-N 499.547 0.727 50 20 JCGD CN(C)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797360 GGFKQTIUJJCJRC-UHFFFAOYSA-N 479.390 0.326 50 20 JCGD COc1ncccc1C(=O)N1CCC(N2CCC(NC(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834797569 ZYZUHFXDGCJBOS-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3n[nH]c4ccc(F)cc34)CC2)CC1)c1ccc(B(O)O)cc1 1834798564 LIVCKQITVVOKRL-UHFFFAOYSA-N 493.348 0.881 50 20 JCGD Cc1nc(F)ccc1C(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834801103 MCGRZOZINZICIP-UHFFFAOYSA-N 468.338 0.708 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC1CCN(C2CCN(C(=O)c3cnsn3)CC2)CC1 1835737089 MFEDLZOBIQLETR-UHFFFAOYSA-N 458.548 0.036 50 20 JCGD CC[C@H](NC)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1835912982 SBAREXDIALDDIV-PGRDOPGGSA-N 478.502 0.588 50 20 JCGD Cc1c(F)cccc1C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835926545 RAOQVZXESYTDIY-QHCPKHFHSA-N 456.279 0.198 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(CN(C(=O)CCc3cncnc3)CCO2)C1 1836048396 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C[C@H](NC(=O)c1cnccn1)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@](C)(Cl)CCl)C2)C1 1837609603 VUBNXOXFGWUEGO-KPOBHBOGSA-N 488.372 0.288 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccccc1C(F)(F)F)CCO2 1838895639 LSZVDWASXBCSLY-JOCHJYFZSA-N 492.259 0.769 50 20 JCGD Cc1cc(C(=O)N2CCO[C@]3(COCCN(C(=O)CCC(=O)NN(C)C)C3)C2)ccc1F 1839321723 QWSMPQUVCMRMKV-QFIPXVFZSA-N 450.511 0.577 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H](Br)CC)CCO2 1839967267 HEIVIXPFAFKNCW-JTDSTZFVSA-N 462.385 0.921 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCOC[C@]3(CN(C(=O)[C@@H](C)Br)CCO3)C2)n1 1840033309 ADTXTSPNEKMYQJ-QRWLVFNGSA-N 485.379 0.527 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cn(C(C)(C)C)nn3)C2)C1 1840034198 CYIUIWFQMAUGCB-UGSOOPFHSA-N 458.357 0.887 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccnn3-c3ccccc3)C2)C1 1840184631 YLWSKKLDLOXBMJ-DEOSSOPVSA-N 484.557 0.315 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@]3(F)CCCC=C3F)C2)C1 1840186529 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728209509 CYZUQNPXMFCFBE-UHFFFAOYSA-N 469.523 0.642 50 20 JCGD CS(=O)(=O)N1CCN(CCNC(=O)NNC(=O)c2cc(F)ccc2Br)CC1 728747747 NMAYBFCSJHPQQM-UHFFFAOYSA-N 466.333 0.109 50 20 JCGD C[C@@H](Oc1cccc(Br)c1)C(=O)NNC(=O)N1CCCN(S(C)(=O)=O)CC1 728943597 RDFMILCOMXXXOE-GFCCVEGCSA-N 463.354 0.925 50 20 JCGD COc1ccc(NC(=S)NNC(=O)CCNS(=O)(=O)c2ccc3c(c2)OCCCO3)cn1 729693003 CQUCRPBTVKYDLI-UHFFFAOYSA-N 481.556 0.938 50 20 JCGD O=C(CCCCC(=O)NNC(=O)[C@@H]1COc2ccccc2O1)NNC(=O)[C@@H]1COc2ccccc2O1 729822755 FXAAVEIEMXHHKF-PMACEKPBSA-N 498.492 0.522 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNC(=O)[C@@H]1CCN(c2ccc3c(c2)OCCO3)C1=O 730515681 XGTXUJQPIFUAHF-HNNXBMFYSA-N 487.538 0.873 50 20 JCGD Cc1oc2ncnc(O)c2c1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 768229166 DPRZGZCTBWFBHN-UHFFFAOYSA-N 489.510 0.652 50 20 JCGD O=C(Cc1cc(F)cc2c1OCOC2)NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1 783389090 WUPKLEYMYGPJCC-UHFFFAOYSA-N 479.486 0.717 50 20 JCGD O=C(COc1ccc(Br)cc1)NNC(=O)C1=NN([C@@H]2CCS(=O)(=O)C2)C(=O)CC1 871018535 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COc1cc(CCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)ccn1 1788611748 YMRBINYGOAVPSU-VDGAXYAQSA-N 482.541 0.315 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)C[C@@H]21)c1cccc2nscc12 1790451604 UODMYBJAUUKIAS-XERREHJYSA-N 465.340 0.883 50 20 JCGD CC(=O)N[C@@H](C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C[C@@H]21 1790866218 SYKPDBRNQLYIGS-IBBHNLMTSA-N 476.486 0.638 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(N4C(=O)C=CC4=O)cc3)C[C@@H]21 1791256411 QCSJOFYMAYGNOS-KANFNMMFSA-N 475.929 0.963 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cnc4cc(Cl)ccn34)C[C@@H]21 1791289093 JSBZVYNGPBRPGM-ZVZYQTTQSA-N 476.965 0.954 50 20 JCGD COc1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cccc(B(O)O)c2)C3)cc1C 1793652632 LDOQOVCKKRNYAA-BBIADKPPSA-N 452.316 0.129 50 20 JCGD COc1ncccc1CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)/C(C)=N/NC(=O)c1ccc[nH]1)C2 1794092678 FRGJFMPFJHEGJN-DGODORHTSA-N 482.541 0.746 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)C1 1796189637 KGRPEBAEJNYVPI-VBIBTDTNSA-N 471.363 0.922 50 20 JCGD COC1(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](O)CCl)C3)CN(C(=O)OC(C)(C)C)C1 1797153035 LIHNYTPPOSZONW-JYYAWHABSA-N 475.970 0.202 50 20 JCGD Cc1c([N+](=O)[O-])ccc(F)c1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cnccc1C(=O)NN 1797753840 IFQAXIJPYPICGI-DBWKPXFBSA-N 486.460 0.558 50 20 JCGD CS(=O)(=O)Cc1ccc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)[C@@H](F)Br)cn1 1799346435 QOMDJFJPFBZBQN-AYRXBEOTSA-N 478.340 0.520 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1n[nH]c2ccc(C#N)cc12 1799885358 DCGPQWXXSMBAFJ-YVWYUNDQSA-N 453.503 0.011 50 20 JCGD O=C(Cc1cccc(C(F)(F)F)c1)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2 1800408309 LFQCAERWOYSIRU-UPHUGPLXSA-N 476.260 0.831 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CS(=O)(=O)N1CCCC1)C2 1800639671 MAFLSVVFOXCNCZ-FQLMCAECSA-N 466.398 0.175 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cn3[nH]cnc(=O)c3c1C)C2 1800642041 SRMOLXFQEYPFRQ-NEBZKDRISA-N 466.336 0.708 50 20 JCGD COc1cc(Cl)cc(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)c2cnccc2C(=O)NN)C3)c1 1801811771 ZGSVVAPCSLWECL-HBCWATKFSA-N 473.917 0.864 50 20 JCGD CC[C@H](NC(C)=O)C(=O)NC[C@@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1802549223 OLJQKGBMTLZTIB-FFZOFVMBSA-N 467.530 0.314 50 20 JCGD O=C(COc1ccc(O)cc1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1802888163 OTFDXIDVKJMBMS-DVECYGJZSA-N 475.310 0.866 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)[C@H]1COc2ccccc2O1 1804196629 KBUDVSBZIJYIEG-IEXUWNMDSA-N 487.321 0.921 50 20 JCGD COc1cccc(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)n1 1807369329 GQYWDFLDTYHZOH-YADARESESA-N 474.326 0.727 50 20 JCGD C[C@]1(C(=O)NC[C@@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)CCCN1 1808083063 OQDRBQRKNATKEW-XKDCRVNJSA-N 451.531 0.542 50 20 JCGD COC(=O)C12CC(C(=O)N3CC[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3c3cccnc3)(C1)C2 1810305001 IOJJVASFOJGPEQ-KFLOIMRSSA-N 492.536 0.743 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)/C=N/O[C@H]2CCCCO2)[C@@H]1c1cccnc1 1810359836 BXDGUECDZDDWJG-AYQODWRJSA-N 495.540 0.929 50 20 JCGD C[C@H](Nc1ccccn1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1810572874 QVTMFJURFLALDQ-WGGBDISSSA-N 473.342 0.977 50 20 JCGD N#Cc1c[nH]c(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)c1 1811541216 UEMVJLCZZGCVGO-UZLBHIALSA-N 458.482 0.913 50 20 JCGD C[C@H](Br)C(=O)NC[C@@H]1CCN(C(=O)C[C@@H]2NC(=O)NC2=O)[C@H]1c1cccnc1 1812864212 GDJHPOZTLOALTH-NHULGOKLSA-N 452.309 0.469 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(C(=O)O)ncn2)[C@H]1c1cccnc1 1813069842 CRCFWSVFHUOBKM-YWZLYKJASA-N 469.502 0.262 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CCN2CCOC2=O)[C@H]1c1cccnc1 1813070350 IVJXODQKZOYTJD-UWJYYQICSA-N 460.535 0.303 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)c2cc(=O)nc3cccnn23)[C@H]1c1cccnc1 1813072195 BCWCYYUCBMDZNB-SBUREZEXSA-N 492.540 0.177 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@H]1CCN(C(=O)CSCC(=O)O)[C@H]1c1cccnc1 1813072392 BMEIBOYSOAGTFP-YWZLYKJASA-N 451.549 0.278 50 20 JCGD C[C@H](Cn1ccnc1)C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1813413231 WZWVDZTZYWPSNZ-NQSCKRDGSA-N 461.331 0.614 50 20 JCGD O=C(Cn1cc(Cl)cn1)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1815408492 CJKDMKZSUYTVRO-CQSZACIVSA-N 459.724 0.599 50 20 JCGD CC[C@@H](Br)C(=O)N[C@H]1CCc2nc(NC(=O)c3cc(=O)n4[nH]nnc4n3)sc2C1 1816673758 HJBSTMPXWKFOBE-JGVFFNPUSA-N 481.336 0.668 50 20 JCGD COc1nn(C)cc1C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817473245 NKBVOCDQMNMNTC-QGZVFWFLSA-N 452.280 0.451 50 20 JCGD COC(=O)c1ccc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)cn1 1817536553 BYLMZMPLWINBOA-HNNXBMFYSA-N 480.311 0.544 50 20 JCGD Cc1cc(C(=O)NCC(=O)Nc2cc([C@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)[nH]n2)no1 1819467113 UJHXMSAFVSRGNA-QGZVFWFLSA-N 495.500 0.441 50 20 JCGD CCCC(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1819562288 WROJFHFUJURXPW-KSSFIOAISA-N 455.324 0.700 50 20 JCGD Cn1c(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cnccc4C(=O)NN)sc3C2)cccc1=O 1819795810 SCOUMQVWAHKTFO-LLVKDONJSA-N 467.511 0.380 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)Cc1ccc3ncnn3c1)CC2 1819797776 JTIFRSSXAXEKJC-ZDUSSCGKSA-N 491.537 0.653 50 20 JCGD COCCOCCOCCOCCC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)CCl)CC2 1823067982 HRZPAKBRIIMKIL-HOCLYGCPSA-N 494.010 0.741 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ncccc1C)CCO2 1831829418 IQQQEQRJDAXGPN-NWJFTTBMSA-N 468.514 0.594 50 20 JCGD COc1ccc([C@@H](O)C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)cc1 1833181533 BUDZLDYROCQMCV-XMMPIXPASA-N 495.385 0.294 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccn4c(O)nnc34)CC2)CC1)[C@@H](O)CCl 1833310559 NDFMKPXBFIZRSL-INIZCTEOSA-N 450.927 0.220 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)n1ccnc1 1833376328 ZJCIBRDMTQDSHY-QGZVFWFLSA-N 453.352 0.009 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ncc(Cl)cn1)CCO2 1833786237 XLGJKIJPKCWVAK-WMPMWDHYSA-N 489.920 0.334 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1snnc1C1CC1 1835243924 AKXNJBSMAGYPBT-UHFFFAOYSA-N 483.403 0.594 50 20 JCGD O=C(CCc1ccccc1)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929206 HOGAUUCWEUGFKR-XMMPIXPASA-N 452.316 0.069 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3cccc4cc[nH]c34)C2)C1 1835930670 TWLXLBPGFQCNTM-DEOSSOPVSA-N 463.299 0.232 50 20 JCGD O=C(Cc1cc(F)ccc1Cl)N1CCOC[C@]2(C1)CN(C(=O)c1cccc(B(O)O)c1)CCO2 1835934400 YIXZQJKUMKYHLY-QHCPKHFHSA-N 490.724 0.472 50 20 JCGD Cc1ccc([C@H](C)C(=O)N2CCOC[C@@]3(CN(C(=O)c4cccc(B(O)O)c4)CCO3)C2)cc1 1835940147 WLXFQEVOBCXMOD-DFBJGRDBSA-N 466.343 0.549 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)NC1CCN(C2CCN(C(=O)CCC(N)=O)CC2)CC1 1836107333 ABTPFURIVZTPBO-UHFFFAOYSA-N 489.529 0.971 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)CCN3Cc4ccccc4C3=O)CCO2)C1 1836593671 BXKOSNYANJIOIU-AUSIDOKSSA-N 479.961 0.743 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3n(n1)CCC3)CCO2 1837090981 BQTLASMMKVGLGT-DZQSVEARSA-N 483.529 0.033 50 20 JCGD O=C1NCc2cc(C(=O)N3CCO[C@@]4(COCCN(C(=O)[C@H](F)Br)C4)C3)ccc21 1837152531 RSOLGEKRLHJFGE-KXBFYZLASA-N 470.295 0.691 50 20 JCGD O=C(CCBr)N1CCOC[C@]2(C1)CN(C(=O)c1cc3cn[nH]c3cn1)CCO2 1837194530 MCGYYAHRVXPKQH-SFHVURJKSA-N 452.309 0.813 50 20 JCGD CC1(C(=O)N2CCOC[C@@]3(CN(C(=O)c4cnccc4C(=O)NN)CCO3)C2)CCCCC1 1837460310 AULFANHABJMIHR-HSZRJFAPSA-N 459.547 0.726 50 20 JCGD Cc1cc(C)n(CCC(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)n1 1837922117 NAWAFAGZNFNHLA-UHFFFAOYSA-N 482.390 0.882 50 20 JCGD CCOc1ccc(C(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)nn1 1838394749 SUEJWGMDKKVIQS-UHFFFAOYSA-N 497.556 0.800 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(OC2CCN(C(=O)CC3(O)CCC3)CC2)CC1 1838395354 GQRGEQMXUBEMEN-UHFFFAOYSA-N 459.547 0.602 50 20 JCGD O=C(c1cc([N+](=O)[O-])cc2c1OCC2)N1CCO[C@]2(COCCN(C(=O)[C@@H](O)CCl)C2)C1 1838524441 MEPRUWWPFJQLKT-OXJNMPFZSA-N 469.878 0.199 50 20 JCGD CN(CC(=O)N1CCO[C@@]2(COCCN(C(=O)C(C)(F)F)C2)C1)NC(=O)NCc1ccccc1 1839053991 ACXJYIXEASYHPK-QFIPXVFZSA-N 483.516 0.444 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc3ccsc3[nH]1)CCO2 1839521810 HSEAXDSYRJNBAD-OAQYLSRUSA-N 463.560 0.672 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1(c3ccccc3)CCC1)CCO2 1840115461 ZATZRHSCKUEGOH-DEOSSOPVSA-N 472.586 0.938 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CC(=O)N(C4CCCC4)C3)C2)C1 1840150145 GKUUZNVRCGQLEY-TVTNDZMWSA-N 471.982 0.488 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cn4cc(F)ccc4n3)C2)C1 1840153534 RZMVSOSDSWHUFQ-MGPUTAFESA-N 454.886 0.797 50 20 JCGD C[C@@H](C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1)c1cccs1 1840374336 VSXJAYFQYJWNJB-ZHRRBRCNSA-N 458.345 0.302 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)CC1 1840806242 NXPSRQBAIIFEDJ-UTKZUKDTSA-N 492.976 0.530 50 20 JCGD CCOC(=O)c1c(CCC(=O)N2CCCC23CN(C(=O)c2cccc(B(O)O)c2)C3)c[nH]c1C 1841455244 SPKRUOIEWOJBCG-UHFFFAOYSA-N 467.331 0.629 50 20 JCGD CC(C)(C)OC(=O)NCCOCCC(=O)N1CC2(CCCN2C(=O)c2ccc(B(O)O)cc2)C1 1843010384 KIXKYTHLLCOXBZ-UHFFFAOYSA-N 475.351 0.115 50 20 JCGD CN(CC(=O)N1CC2(CCCN2C(=O)c2cnc(O)nc2O)C1)NC(=O)NCc1ccccc1 1843353000 UYNFRQFOCAIKLO-UHFFFAOYSA-N 469.502 0.051 50 20 JCGD C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CN(C)C(=O)NNC(=O)CNC(=O)c1cccs1 725871115 CPLIAIKMITVYBQ-CYBMUJFWSA-N 472.527 0.914 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NNC(=O)NCCS(C)(=O)=O)cc2)cc1 727943144 XOBHRGWOMHZBLG-UHFFFAOYSA-N 482.584 0.804 50 20 JCGD C[C@H]1C[C@H](C)CN(C(=O)CN2CCN(C(=O)NNC(=O)C3CCN(c4ncccn4)CC3)CC2)C1 728958591 AWBGEEUBHRFKFZ-OALUTQOASA-N 486.621 0.556 50 20 JCGD CCCN1CCC[C@@H]1C(=O)NNC(=O)Cn1c(=O)c2c(ncn2CC)n(Cc2ccccc2)c1=O 749566995 BVBVZRSUFOOFLJ-GOSISDBHSA-N 481.557 0.450 50 20 JCGD O=C(CCC/N=C1/NS(=O)(=O)c2ccccc21)NNC(=O)c1nn(-c2ccccc2)cc1O 789852604 JEFMVFVOJYFOBT-UHFFFAOYSA-N 468.495 0.858 50 20 JCGD O=C(CN1CCCC1=O)NNC(=O)C1CCN(S(=O)(=O)c2cccc(OC(F)(F)F)c2)CC1 897475018 HXVKRFSIFBXGCX-UHFFFAOYSA-N 492.476 0.756 50 20 JCGD O=C(NNC(=O)c1cccc(NS(=O)(=O)c2ccc3nnn(O)c3c2)c1)c1ccncc1 912768932 OPGNOVKLLQERMV-UHFFFAOYSA-N 453.440 0.939 50 20 JCGD COC(=O)CCCNC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 915894027 AGLJJTIXCACLBL-HNNXBMFYSA-N 486.547 0.236 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NN=Cc1c(C)nn(C)c1C)c(=O)n2Cc1ccccc1 916331804 KRNWDOQMGXUYBA-UHFFFAOYSA-N 462.514 0.929 50 20 JCGD CCN=c1nc(NCC)n2c(SCC(=O)NNC(=O)c3cc(Br)cn3C)n[nH]c2n1 917392177 PEQWIPPKEZBFHU-UHFFFAOYSA-N 497.383 0.459 50 20 JCGD Cc1nccn1-c1ccc(CNC(=O)NNc2ccc(S(=O)(=O)N3CCN(C)CC3)cn2)cn1 918113376 XGBFQHNWXRANAQ-UHFFFAOYSA-N 485.574 0.733 50 20 JCGD C[C@H]1CN(S(=O)(=O)N2CCN(C(=O)NNC(=O)c3cc(Br)c[nH]3)CC2)C[C@H](C)O1 918778945 VNXBWKZWBSMCBB-RYUDHWBXSA-N 493.384 0.103 50 20 JCGD CCc1ccccc1OCC(=O)NNC(=O)NCCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1 920051610 RQOOLYVBLPRNRS-UHFFFAOYSA-N 465.488 0.845 50 20 JCGD CN(C)c1ccc(CCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)cc1 1115952059 FJHDSJMRUSHABK-UHFFFAOYSA-N 475.571 0.960 50 20 JCGD CN(C)N(C(=O)c1ccc2c(c1)S(=O)(=O)N(C[C@H]1CCCO1)C2=O)[C@H]1CCS(=O)(=O)C1 1251172875 SCXBZENLMONUQY-LSDHHAIUSA-N 471.557 0.116 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)[C@@H](COC(C)=O)OC(C)=O)C1 1779406250 BVRLMFSNJRANRI-WOCWXWTJSA-N 462.927 0.249 50 20 JCGD COc1ccc2[nH]cc(C(=O)N3CC[C@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)c2n1 1780042272 VTIZAHZKXMJWFW-HSZRJFAPSA-N 464.287 0.009 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)c3ccc([N+](=O)[O-])c4c3OCO4)C2)C1 1780237005 PZIKDINEFJWFGS-NRFANRHFSA-N 477.474 0.140 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1cccc(F)c1[N+](=O)[O-] 1781001048 TXCWVLACYKIORL-AUSIDOKSSA-N 485.277 0.855 50 20 JCGD CN(C)NC(=O)CCC(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)[C@@H]1CC(=O)N(C3CCCC3)C1)C2 1782209483 SJECYGJCMZLQHP-RQBNJVACSA-N 491.633 0.664 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC[C@@]2(CN(C(=O)CCCN3C(=O)c4ccccc4C3=O)CCO2)C1 1783933366 IWSLZMVDYQXBRA-VWLOTQADSA-N 499.568 0.266 50 20 JCGD Cn1nncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@H](CCl)NC(=O)OC(C)(C)C)[C@H]2C1 1785075538 OPDUDUQJDWIUJV-YXWQFLTLSA-N 470.958 0.541 50 20 JCGD Cc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CN(C)NC(=O)NCc4ccccc4)C[C@@H]32)no1 1786141805 HOBHEDKGVMULOF-ZJOUEHCJSA-N 484.557 0.923 50 20 JCGD O=C(Cc1ccc(Cl)cc1)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1786540516 UVBBLMFYGCSSDD-YYWHXJBOSA-N 456.735 0.856 50 20 JCGD COc1ccc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cccc(B(O)O)c4)[C@H]3C2)c(Cl)c1 1786986602 PGZXOJAEHLYNMP-ZRCAFCQKSA-N 472.734 0.936 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cccnc3)C[C@@H]21 1787506573 IGYYHFQJFGXYCP-XXBMCBDCSA-N 468.514 0.574 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)C3(c4ccc(O)cc4)CC3)C[C@@H]21 1788607822 LVOVDKGXMULHIY-JHVJFLLYSA-N 479.537 0.716 50 20 JCGD O=C1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)=Cc2ccccc2N1 1789155696 SKRUSWDGWGKRQN-HARLFGEKSA-N 489.337 0.386 50 20 JCGD CC[C@@H](Br)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C[C@@H]21 1790961350 ZYHCEGFBVIMKQR-ZOFXXKQRSA-N 477.352 0.634 50 20 JCGD CC(=O)N[C@H](Cc1cc(F)c(F)c(F)c1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792979153 XUVPZHHEKCPWQY-DDOVSQSKSA-N 491.894 0.340 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H]1CN(Cc3ccccc3)CCO1)C2)[C@@H](O)CCl 1792980987 BTXSJEMFBLKSLE-YHDCXSKOSA-N 451.951 0.077 50 20 JCGD C[C@H](Br)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cccc(N2CCCNC(=O)C2)n1 1794506808 PVWWGLPOGLQBCT-ZTENYAIWSA-N 494.390 0.395 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnc3cc(Cl)ccn13)C2)c1cccc(B(O)O)c1 1795738980 OQTGTKBBCLCCTJ-YVWYUNDQSA-N 468.706 0.185 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H]1Cc3ccccc3CN1C)C2 1796439630 SXLLDRUDVNULDP-KQWVNABRSA-N 492.580 0.767 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CC13CCCN1CCC3)C2 1796444122 XHXWOLNAVYJZME-DVRBRGDMSA-N 470.574 0.729 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3[C@H]4CC[C@@H]3C[C@H](NC(=O)CCC(=O)NN(C)C)C4)cnc2s1 1797606486 ZPSHCBOYYXYFKE-QDMKHBRRSA-N 460.560 0.689 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(C)C)[nH]n1 1798667819 DMLYGJYKRHJXOG-IHHIPJHASA-N 455.519 0.870 50 20 JCGD Cc1cc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)ccc2[nH]1 1800116621 ZEFWIDYMESCMCW-UPHUGPLXSA-N 462.510 0.992 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1nccnc1C(N)=O)C2 1800333279 BJONNXBBKBCEDN-INHOUBOVSA-N 482.447 0.664 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(B(O)O)cc1)C2 1800369599 YOCMKYGXOLYIDT-XCRNZQRYSA-N 454.307 0.588 50 20 JCGD C=CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCC(=O)NN(C)C 1801012492 KIKFWYWGPLUUBO-NYUBLWNDSA-N 495.621 0.809 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CSCC(=O)O 1801020454 KRVFOGHPSMXTDF-ZWUHOBOKSA-N 479.983 0.526 50 20 JCGD CC(C)(C)OC(=O)N1CCN(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)C(Cl)Cl)C3)CC1 1801966626 FDWKFZLAFYJXQR-MIFYACCESA-N 479.405 0.932 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)Cc2cn3c(nc2=O)SCC3)[C@@H]1c1cccnc1)[C@@H](O)CCl 1803140343 CTZPHNRDSPLRII-QILLFSRXSA-N 477.974 0.592 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@H]1c1cccnc1)c1ncc(Cl)cn1 1805232179 LBIOIRDBDDVUOW-LPHOPBHVSA-N 465.706 0.838 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)[C@H]2CC[C@H](O)CC2)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374086 IFOJEFMNTBWDBB-JCXROGDPSA-N 451.332 0.632 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@H]1CCN(C(=O)c2cccc(=O)n2O)[C@@H]1c1cccnc1 1810300121 XDSPPBBGJPUSHV-FOIQADDNSA-N 477.481 0.113 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)NC[C@@H]2CCN(C(=O)[C@H](O)CCl)[C@@H]2c2cccnc2)n1 1810485058 BLFOIFGVGDVHRX-YQVWRLOYSA-N 461.950 0.988 50 20 JCGD C[C@H](CBr)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CN(CCO)CCO)[nH]n1 1814783813 UGAQXWXIPCXLDN-HIFRSBDPSA-N 460.373 0.719 50 20 JCGD Cc1nc(N)sc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2 1815141824 LTLODACVONULAJ-GFCCVEGCSA-N 457.346 0.710 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)Nc1cc([C@@H]2CCCCN2C(=O)CCC(=O)NN(C)C)[nH]n1 1815167835 JWXZYXLQZCIWOD-ZFWWWQNUSA-N 471.584 0.103 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C=C\C(=O)NC1CC1)CC2 1819797347 AMDXZZRSKAUMMP-FOQNGQEVSA-N 469.527 0.202 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)CN2CCS(=O)(=O)CC2)[nH]n1)[C@@H](F)Br 1820932163 YMYBHMXZFRFEIU-SWLSCSKDSA-N 480.360 0.823 50 20 JCGD CC(=O)N(C)CCC(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1824886063 ZCSJWFDGCZCPGH-HXUWFJFHSA-N 458.563 0.787 50 20 JCGD COC[C@H](Cl)C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cc(=O)n3[nH]cnc3n1)CC2 1825998933 KHLIMEMJNWOJBX-BDAKNGLRSA-N 451.896 0.354 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)[C@@H](O)CNC(=O)OC(C)(C)C)CC2 1826082990 HLRITWUKNSTMSY-OCCSQVGLSA-N 498.606 0.314 50 20 JCGD CN(C)NC(=O)CCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)CNC(=O)c1ccco1)CC2 1826085199 JNYCMDDCWXQGLV-GFCCVEGCSA-N 462.532 0.451 50 20 JCGD CCOC(=O)O[C@H](C)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826090203 ZWNHTGTYZIVIJA-VXGBXAGGSA-N 455.537 0.990 50 20 JCGD O=C1C[C@H](C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)CN1Cc1cccs1 1830725803 MEOJGJKGMOYIBR-HZUJVAHNSA-N 485.990 0.153 50 20 JCGD CC(C)(C)OC(=O)N1CC(CC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)C1 1830739065 XXQZAMSGMLWPKG-IIBYNOLFSA-N 475.970 0.300 50 20 JCGD COC[C@@H](C)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1831629521 JVGBECJISKXUHV-QRQCRPRQSA-N 479.486 0.873 50 20 JCGD CN(CC(=O)N1CCOC[C@]2(C1)CN(C(=O)C1=CCCC1)CCO2)NC(=O)NCc1ccccc1 1834683159 NBIRKSVARJWMNN-VWLOTQADSA-N 485.585 0.899 50 20 JCGD Cc1cc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)cn1C 1834798489 BPGWVUYDCXVYKV-UHFFFAOYSA-N 452.364 0.512 50 20 JCGD COc1cccnc1CCC(=O)N1CCC(N2CCC(NC(=O)c3cccc(B(O)O)c3)CC2)CC1 1834799855 IHFPVOPINJJPKZ-UHFFFAOYSA-N 494.401 0.588 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc4nc[nH]c34)CC2)CC1)c1cccc(B(O)O)c1 1834799962 IRLUGCHTNGPIGG-UHFFFAOYSA-N 475.358 0.742 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(S(C)(=O)=O)cc3)CCO2)C1 1835350843 DMCXOAXRDKIVPC-GHTZIAJQSA-N 488.990 0.343 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3n[nH]c4c(Cl)cccc34)C2)C1 1835931907 GIRYTZKWSATHQE-QHCPKHFHSA-N 498.732 0.280 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@@]2(COCCN(C(=O)C3(c4cccc(F)c4)CC3)C2)C1 1835934021 KHDKBLZTNZGQTE-DEOSSOPVSA-N 482.317 0.307 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(COCCN(C(=O)c3ccccc3OC(F)F)C2)C1 1835941520 NBXXTSNNHHVUAI-HSZRJFAPSA-N 490.268 0.352 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc4c(c3)NC(=O)CO4)CCO2)C1 1836994937 VNMRHQGQHRGMFY-VFNWGFHPSA-N 467.906 0.341 50 20 JCGD O=C(c1ccc2nncn2c1)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1837019898 OZYYNPNBXVSAIA-PBHICJAKSA-N 456.272 0.490 50 20 JCGD Cc1cc2nc(C(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)[nH]c2cc1C 1837345154 LCFXRFVAVBKXBO-VWLOTQADSA-N 492.341 0.243 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)c3ccccc3O)CC2)CC1 1837347866 QVZZTECINBLICR-UHFFFAOYSA-N 452.316 0.998 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccc4ncsc34)C2)C1 1837458766 BBHYFJIGFWDKRQ-QHCPKHFHSA-N 496.549 0.679 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@]2(COCCN(C(=O)c3nn[nH]c3C(F)(F)F)C2)C1 1837715116 WMLBCMNJIWGEAA-MRXNPFEDSA-N 465.505 0.745 50 20 JCGD C[C@@H](Nc1nccs1)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920133 CRHLJHBHVMNEAB-MRXNPFEDSA-N 486.403 0.936 50 20 JCGD COc1ccc(C(=O)N2CCO[C@]3(COCCN(C(=O)[C@H](O)CCl)C3)C2)cc1N(C)C 1839114173 IYIFGNGLMWTLEI-DYESRHJHSA-N 455.939 0.431 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3n[nH]c4c3CS(=O)(=O)C4)C2)C1 1839151902 HYNWQQDMOQGZGB-ROUUACIJSA-N 495.385 0.144 50 20 JCGD CC(=O)Nc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](F)Br)CCO3)ccn1 1839200967 PPWAANHBIHOOMI-QAPCUYQASA-N 473.299 0.801 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1ccc(C)c(O)c1)CCO2 1839267679 VAXRIFOAUVJGCJ-OTZYPNAKSA-N 483.525 0.905 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](C)Br)CCO2 1840035074 FPOJKULVFUVGQY-ZZVZOJOMSA-N 484.347 0.996 50 20 JCGD C=C(Oc1ccccc1O)C(=O)N1CCOC[C@]2(CN(C(=O)CCC(=O)NN(C)C)CCO2)C1 1840183901 HGQQEUQZNPAKDX-QHCPKHFHSA-N 476.530 0.114 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3cc(-c4ccccc4)[nH]n3)C2)C1 1840184921 CHQXSJNPMCPATL-XMMPIXPASA-N 484.557 0.520 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCO)C(=O)N1CCOC[C@@]2(CN(C(=O)C(Cl)Cl)CCO2)C1 1840186566 KWRVCSJXPGBILB-YJYMSZOUSA-N 484.377 0.522 50 20 JCGD CC(C)(C)OC(=O)N1CC(F)(C(=O)N2CC3(CCCN3C(=O)c3ccc(B(O)O)cc3)C2)C1 1843012962 VEKREQAWGOFRSZ-UHFFFAOYSA-N 461.299 0.142 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC2(CCCN2C(=O)[C@H]2CC[C@H]3CCC(=O)N3C2)C1 1845071804 MWYSLOAZKSNTER-XSXGCSSOSA-N 454.531 0.725 50 20 JCGD COc1cc(C(=O)N2CC3(CCCN3C(=O)CCC(=O)NN(C)C)C2)cc([N+](=O)[O-])c1OC 1846385738 PNZKSDIOZWXBBP-UHFFFAOYSA-N 463.491 0.802 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1CCCN1C(=O)c1ccc(F)cc1 1847522995 PDOWKLVNUDBVSQ-ACRUOGEOSA-N 494.527 0.944 50 20 JCGD C[C@H]1Cc2cc(C(=O)OCC(=O)NNC(=O)c3ccc([N+](=O)[O-])cc3)ccc2N1S(C)(=O)=O 17161364 CGBDOYMILXFVDH-LBPRGKRZSA-N 476.467 0.923 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NCC(=O)NNC(=O)c2cccc(OC(F)F)c2)c1 728610081 TVUASZBBTBVBIP-UHFFFAOYSA-N 470.454 0.729 50 20 JCGD O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)NNC(=O)C1CCN(c2ncccn2)CC1 728848162 XUWZHYZGWBIMJO-UHFFFAOYSA-N 455.431 0.174 50 20 JCGD O=C(NNC(=O)c1cccc(S(=O)(=O)N2CCOCC2)c1)c1ccc(N2CCOCC2)cc1 746352841 MWWWJSNSVDOSEB-UHFFFAOYSA-N 474.539 0.619 50 20 JCGD O=C(CSc1ncccc1C(=O)NNC(=O)C(=O)N1CCCC1)Nc1ccc2c(c1)OCO2 748246018 DBSIRPNIOOMDAD-UHFFFAOYSA-N 471.495 0.925 50 20 JCGD 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CS(=O)(=O)CC[C@@H](NS(=O)(=O)c1ccccc1)C(=O)NNC(=O)NCCc1cccs1 920860305 RTFQPNLYJSRGAD-MRXNPFEDSA-N 488.613 0.403 50 20 JCGD COCCCNC(=O)NNC(=O)c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCOCC1 920862449 GMTUUFIFMCUDOU-UHFFFAOYSA-N 483.591 0.678 50 20 JCGD CC[S@](=O)CCC(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)C1 1778090868 FIMINVFTCVZDGO-JVBXNSIJSA-N 479.603 0.793 50 20 JCGD CC(C)n1cnc(C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cnccc2C(=O)NN)C3)n1 1778280466 VUQKIXJUPUQXKS-VGOFRKELSA-N 470.534 0.299 50 20 JCGD Cc1ccc(CCC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cn1 1779028850 PEDRTYKGFUAILZ-QHCPKHFHSA-N 452.515 0.465 50 20 JCGD COc1cccc(OC)c1C(=O)N1CCO[C@]2(CCN(C(=O)c3cnccc3C(=O)NN)C2)C1 1779032451 KHAQQIWOVIVKJL-QHCPKHFHSA-N 469.498 0.460 50 20 JCGD COc1ccc(CC(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)cc1F 1779033998 HNAZHJBXFGOBAJ-QHCPKHFHSA-N 471.489 0.519 50 20 JCGD COc1cccc(C(=O)N2CCO[C@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1C 1779034187 OTBNFPPQTPRVDN-QHCPKHFHSA-N 453.499 0.759 50 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CC(C)c1nc(CC(=O)N2CC[C@H](CNC(=O)c3ccc(B(O)O)cc3)[C@@H]2c2cccnc2)no1 1807360601 CPDKNUGVQNWVKK-GCJKJVERSA-N 477.330 0.830 50 20 JCGD Cc1nc2ncccn2c1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807374847 JRFXFOMOCXADHS-DENIHFKCSA-N 484.325 0.746 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2nn[nH]c2C(F)(F)F)[C@@H]1c1cccnc1)c1cccc(B(O)O)c1 1807374886 KTUXJTAGZJMEKU-WMLDXEAASA-N 488.235 0.532 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CC[C@H](CNC(=O)[C@@H](N)CN)[C@H]1c1cccnc1 1808257939 FDMSOQFPRZAEIY-LTIDMASMSA-N 468.986 0.506 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)[C@@H]2[C@H]3COC[C@H]32)[C@H]1c1cccnc1 1810309594 SEQNFKAHFYGDCN-YLLORCDKSA-N 450.499 0.292 50 20 JCGD Cc1c(C(=O)N[C@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)cn2[nH]cnc(=O)c12 1815360791 NUJWHFROCDSTEA-AWEZNQCLSA-N 492.326 0.007 50 20 JCGD CC(=O)Nc1cc(C(=O)Nc2nc3c(s2)C[C@@H](NC(=O)c2cccc(B(O)O)c2)CC3)ccn1 1817906987 ZOWSRJBQGWTHQO-INIZCTEOSA-N 479.327 0.716 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(O)nn2)[nH]n1 1819401922 GAOFFHWULHQYOZ-OAHLLOKOSA-N 451.447 0.524 50 20 JCGD C[C@H](C(=O)Nc1nc2c(s1)C[C@H](NC(=O)c1cccc(B(O)O)c1)CC2)N1C[C@H]2C[C@H]2C1 1819569482 BBAZTUWNACAIKY-JJAZEVLHSA-N 454.361 0.389 50 20 JCGD COCCn1ccc(C(=O)N2CCCC[C@@H]2c2cc(NC(=O)CCC(=O)NN(C)C)n[nH]2)n1 1822414549 WGTJFXUCRALQGK-QGZVFWFLSA-N 460.539 0.932 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)Cc3ccc(OC)c(O)c3)CCO2)C1 1830248218 PFRNABNBWJJGON-IIBYNOLFSA-N 456.923 0.654 50 20 JCGD COc1ccc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](C)CBr)CCO3)nn1 1830543477 SPVFDBVZTVYZIT-SCLBCKFNSA-N 457.325 0.586 50 20 JCGD COC(=O)c1ccc(CC(=O)N2CCOC[C@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)s1 1830733405 LFXXSLXJFJBKFZ-LIRRHRJNSA-N 460.936 0.133 50 20 JCGD CC[C@H](CC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2)NC(=O)OC(C)(C)C 1830733940 XCCVCVJPMPJKLW-XFQAVAEZSA-N 477.986 0.736 50 20 JCGD O=C(OCc1ccccc1)N1CC(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)C1 1830735276 FSFUOTVYZJBUDL-AUSIDOKSSA-N 495.960 0.311 50 20 JCGD COc1ccc(CNC(=O)CCC(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@H](O)CCl)CCO3)cc1 1830735793 NDCFSCXJUNVTOF-AUSIDOKSSA-N 497.976 0.148 50 20 JCGD O=C(Cc1cc(F)ccc1[N+](=O)[O-])N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830738370 OLKYCJYBKOQMSI-LPHOPBHVSA-N 459.858 0.333 50 20 JCGD O=C(Cc1cc(F)ccc1Cl)N1CCO[C@]2(COCCN(C(=O)c3cccc(B(O)O)c3)C2)C1 1832268637 ROVQHQZROFYMOK-HSZRJFAPSA-N 490.724 0.472 50 20 JCGD Cc1ccc2[nH]cc(CC(=O)N3CCO[C@]4(COCCN(C(=O)c5cccc(B(O)O)c5)C4)C3)c2c1 1832742930 RDNTUPYYPYJSEX-AREMUKBSSA-N 491.353 0.469 50 20 JCGD COc1cccc(CC(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Br)C3)C2)n1 1832770420 YKJONSOUHIRORL-SJLPKXTDSA-N 460.300 0.780 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cncc(S(C)(=O)=O)c3)CCO2)C1 1833400431 SQICASGYJYKYJD-RBUKOAKNSA-N 494.397 0.791 50 20 JCGD COc1cnc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)c(F)c1 1834007152 GOAKVLJEPMKRKJ-UHFFFAOYSA-N 484.337 0.408 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cnc4ccccc4n3)CC2)CC1)c1cccc(B(O)O)c1 1834800164 VTCNSLSSGUSAEJ-UHFFFAOYSA-N 487.369 0.809 50 20 JCGD Cn1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)c1 1835737177 SFIOXTSCZMNMER-UHFFFAOYSA-N 453.547 0.523 50 20 JCGD Cc1nc(C)c(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)o1 1835738054 ROWRXKOFPVYJJK-UHFFFAOYSA-N 469.546 0.789 50 20 JCGD COc1ccc([C@@H](C)C(=O)N2CCOC[C@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)cc1 1835926615 VBDCNOSQERPMMH-IQGLISFBSA-N 482.342 0.249 50 20 JCGD CCc1ccc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)cc1 1835939528 RMGRXPBVTMDVNK-XMMPIXPASA-N 452.316 0.313 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCCO1)CCO2 1836221564 FMGFYWZGECJZHY-KNQAVFIVSA-N 477.470 0.769 50 20 JCGD C[C@@H](Cn1cccn1)C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837219407 INIZHPRPZAHPOV-SFHVURJKSA-N 468.363 0.511 50 20 JCGD COCCOCCOCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)CO[Si](C)(C)C)CCO2 1837716072 ZLRCXCMWNHPLMK-OAQYLSRUSA-N 476.643 0.364 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCC(OC2CCN(C(=O)[C@H]3C[C@]3(F)Cl)CC2)CC1 1837922158 RNNWQANWSWXIOU-WIYYLYMNSA-N 452.719 0.903 50 20 JCGD CC(C)(C)OC(=O)NCCOCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Cl)C2)C1 1839139055 NBDFBEZXFQGFTA-BEFAXECRSA-N 467.922 0.519 50 20 JCGD O=C(COCCO)N1CCO[C@]2(COCCN(C(=O)[C@@H](Br)Cc3ccccc3)C2)C1 1839195292 MPNSMDUUPRCZOQ-GHTZIAJQSA-N 485.375 0.458 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H]3CNC(=O)O3)C2)C1 1839742239 TUMGVIOWIKOSSV-HFCGBKAISA-N 476.436 0.437 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)c3cccnc3C(N)=O)C2)C1 1839962612 LQHJBWBSYJNFBX-LIRRHRJNSA-N 469.336 0.424 50 20 JCGD CC[C@@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1839964139 IJDSQDZRODOKGB-KUHUBIRLSA-N 472.336 0.639 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CCN3CCOC3=O)C2)C1 1839964869 HFABWIZXAKFWFZ-KBXCAEBGSA-N 462.341 0.459 50 20 JCGD COCCOCCOCCC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](C)CBr)C2)C1 1840076084 QQLBKFLBUZOHRZ-XLIONFOSSA-N 495.411 0.544 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3ncn(-c4cccc(F)c4)n3)C2)C1 1840149828 AYVVAKOHJSMTMY-LAUBAEHRSA-N 481.912 0.730 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)c3ccc(C(F)(F)F)[nH]3)C2)C1 1840185835 UBADMOJRIWHZJL-LJQANCHMSA-N 475.468 0.477 50 20 JCGD Cn1c(=O)n(C)c2cc(C(=O)N3CCOC[C@@]4(C3)CN(C(=O)C(Cl)Cl)CCO4)ccc21 1840188354 FUNZDUFVELNKQF-HXUWFJFHSA-N 471.341 0.751 50 20 JCGD C[C@H](C#N)c1cccc(C(=O)N2CCO[C@@]3(COCCN(C(=O)c4ccc(B(O)O)cc4)C3)C2)c1 1840714189 OJXLFLOGFJGRRH-IQGLISFBSA-N 477.326 0.377 50 20 JCGD Cc1nn(C)cc1C(=O)N1CCCC12CN(C(=O)CN(C)NC(=O)NCc1ccccc1)C2 1841718652 LSMOJVYGIFMEAL-UHFFFAOYSA-N 453.547 0.892 50 20 JCGD CCn1c(-n2nc(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)cc2C)cccc1=O 1843013536 VUHNRSRFVIGTOA-UHFFFAOYSA-N 489.341 0.173 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@]2(C(=O)N3CC4(CCCN4C(=O)c4cccc(B(O)O)c4)C3)C[C@@H]2C1 1843014837 HIQGMMTUFITCDR-CJAUYULYSA-N 483.374 0.831 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCCC12CN(C(=O)c1ccc3c(c1)NC(=O)CO3)C2 1843416296 UJQZGKUEWYSDQT-VULFUBBASA-N 464.482 0.969 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)C1 1843905458 LULXFVLZMXTNJT-HNNXBMFYSA-N 472.546 0.759 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC12CN(C(=O)[C@H]1CCCN1C(=O)OC(C)(C)C)C2 1846385914 KIGJDVNHLORMLN-MRXNPFEDSA-N 451.568 0.962 50 20 JCGD COc1ccc(Cl)cc1C(=O)NNC(=O)COC(=O)CN1C(=O)NC2(CCCCC2)C1=O 10053548 RHYLDLADTVCYHP-UHFFFAOYSA-N 466.878 0.908 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)CCCN2C(=O)c3ccccc3C2=O)c1 26745665 SPLCIGAWCFIDFA-UHFFFAOYSA-N 458.496 0.774 50 20 JCGD CN1C(=C(C#N)C(=O)COC(=O)C2=CN3CCS(=O)(=O)N=C3C=C2)N(C)c2ccccc21 105457395 NFIOTCSLBXLASL-UHFFFAOYSA-N 453.480 0.918 50 20 JCGD COCCCNC(=S)N(C)NC(=O)CNS(=O)(=O)c1ccc(Br)cc1 726075598 JZKKHDPIYDMOJX-UHFFFAOYSA-N 453.384 0.601 50 20 JCGD CNS(=O)(=O)c1cccc([C@@H](C)NC(=O)NNC(=O)c2cccc(S(C)(=O)=O)c2)c1 727611232 XUUSVGWWONSWIR-GFCCVEGCSA-N 454.530 0.703 50 20 JCGD CN(C)CC(=O)NNC(=O)c1cccc(NC(=O)C[C@H]2SC(N3CCCCC3)=NC2=O)c1 727761489 IYUGZPCABLRBCS-MRXNPFEDSA-N 460.560 0.822 50 20 JCGD CC(C)[C@H](NC(=O)c1ccccn1)C(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1 728342147 GJTQLLJYMIPKSP-MJGOQNOKSA-N 456.455 0.367 50 20 JCGD C[C@@H]1COCCN1CCNC(=O)NNC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1 729613592 FAGIKESFPUXOIU-MRXNPFEDSA-N 453.565 0.526 50 20 JCGD CCN(CC)S(=O)(=O)c1ccc(C(C)=NNC(=O)CSc2nn(C)c(=O)n(C)c2=O)cc1 730568815 CUGKTQPTLDQHGZ-UHFFFAOYSA-N 482.588 0.142 50 20 JCGD C[C@@H]1CCC[C@H](NC(=O)CN2CCN(C(=O)NNC(=O)c3csc(N4CCOCC4)n3)CC2)C1 731218495 BSBYRMURZQPFLP-SJORKVTESA-N 493.634 0.647 50 20 JCGD CC1CCN(CCCNC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)CC1 916194825 DDZQLNHCUFUWKM-UHFFFAOYSA-N 467.592 0.774 50 20 JCGD CCS(=O)(=O)N1CCC[C@@H](C(=O)NNC(=O)c2ccc(CSc3nncn3C)cc2)C1 918552339 QDIXQTBDCZNRQV-MRXNPFEDSA-N 466.589 0.930 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)CNC(=O)CC(C)(C)C)N(S(C)(=O)=O)CC2 919744679 UIXXXXHLHMCZCW-INIZCTEOSA-N 498.602 0.653 50 20 JCGD O=C(CCCN1C(=O)CNC1=O)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 920212864 WZDPMHIDQMQHEV-UHFFFAOYSA-N 473.511 0.258 50 20 JCGD NS(=O)(=O)c1cc(C(=O)NNC(=O)CCN2C(=O)NC3(CCCC3)C2=O)ccc1Cl 920276868 DEPLQNGSHVSJKL-UHFFFAOYSA-N 457.896 0.003 50 20 JCGD CN1CCN(Cc2cccc(CNC(=O)NNC(=O)c3nn(C)c(=O)c4ccccc34)c2)CC1 1318234522 KTFNEFRLJCRHKE-UHFFFAOYSA-N 463.542 0.825 50 20 JCGD CN(CC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(C#N)c[nH]3)C2)C1)NC(=O)NCc1ccccc1 1780334690 ZIYRFCUDZXVPCM-XMMPIXPASA-N 479.541 0.676 50 20 JCGD O=C1CN(c2cccc(C(=O)N3CCO[C@]4(CCN(C(=O)[C@H](F)Br)C4)C3)n2)CCCN1 1781328300 NBUSBQQIGNVGHD-PXNSSMCTSA-N 498.353 0.542 50 20 JCGD C[C@H](Br)C(=O)N1CCO[C@]2(CCN(C(=O)[C@H](C)NC(=O)c3ccccn3)C2)C1 1782671934 GDMKIHXKUAGFMK-NJSLBKSFSA-N 453.337 0.813 50 20 JCGD O=C(CCNC(=O)c1ccccc1)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2 1783099554 WLWAEBCEWRQFQW-ATIYNZHBSA-N 493.369 0.314 50 20 JCGD COC(=O)N[C@@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)[C@@H](O)CCl)[C@H]2C1)c1ccccc1 1784084645 ZGMBCPSKHFCHOK-KFGODFMUSA-N 453.923 0.663 50 20 JCGD Cc1ccc(CCC(=O)N2CC[C@@]3(C2)CN(C(=O)c2cnccc2C(=O)NN)CCO3)c(C)n1 1784295812 MVSMBQHYXGENQW-XMMPIXPASA-N 466.542 0.773 50 20 JCGD CCC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@]2(CN(C(=O)c3cccc(B(O)O)c3)CCO2)C1 1785583417 JBDBCNFOJOSHKJ-CYFREDJKSA-N 489.378 0.503 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(CCN(C(=O)C3(F)CN(C(=O)OC(C)(C)C)C3)C2)C1 1785687667 GYVAJNGUGXBSJT-NRFANRHFSA-N 485.557 0.148 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(N4CCOCC4)cn3)[C@H]2C1 1785724757 MELYGGJZUONROU-BOLBYERCSA-N 466.966 0.765 50 20 JCGD Cc1c[nH]c(C)c1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786978784 VEEXNNHSIBKFSX-NYVOZVTQSA-N 453.348 0.537 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3cc(N4CCCC4)ccn3)C[C@@H]21)c1ccc(B(O)O)cc1 1786979990 XEYTUCNEZNIENL-HARLFGEKSA-N 478.358 0.269 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786986492 GNWBOACUKWRYTB-NWZJSZKRSA-N 450.344 0.839 50 20 JCGD CN(CC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccnnc3O)[C@H]2C1)NC(=O)NCc1ccccc1 1789117070 AJUAQSOWPRWBKR-IHPCNDPISA-N 497.556 0.122 50 20 JCGD CCOc1ccccc1C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)C[C@@H]21 1789475287 GVBHJRHPTBQUOM-XJABCFGWSA-N 452.316 0.672 50 20 JCGD C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)CN(C)NC(=O)NCc3ccccc3)[C@H]2C1)n1ccnc1 1789724653 IJFWCSYBTDTCEY-GBAJDQEWSA-N 497.600 0.770 50 20 JCGD CN(CC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)Cc3cncnc3)C[C@@H]21)NC(=O)NCc1ccccc1 1789725113 XTUIUJKDHWNBET-FKBYEOEOSA-N 495.584 0.345 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CC[C@H]3CO[C@@H](CNC(=O)[C@](C)(Cl)CCl)[C@H]3C2)no1 1789870624 RGDLCKJYMBREMK-VODUFIJXSA-N 461.346 0.929 50 20 JCGD COCCOCCOCCOCC(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCBr)C[C@@H]21 1791142370 DOWHTFFZKQZFGF-BZSNNMDCSA-N 495.411 0.447 50 20 JCGD COC[C@@H](Cl)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CCOCCNC(=O)OC(C)(C)C 1793220966 PSSKWWOJJMULKE-KYHPRHEASA-N 477.986 0.761 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)COc1ccc(F)cc1 1795197208 WJGVGXRZIOSVSG-GYGSIYFNSA-N 471.489 0.928 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1c(F)ccc(Cl)c1F)C2)c1ccc(B(O)O)cc1 1795736919 OEQLVPNTCNBPSB-DBWKPXFBSA-N 464.661 0.815 50 20 JCGD Cc1nc2cccc(C(=O)N3C[C@@H]4COC[C@H](C3)[C@@H]4NC(=O)c3cccc(B(O)O)c3)c2s1 1795739250 WROUXMMKMSHJIC-CWPLJXCYSA-N 465.340 0.802 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1cc(C(F)F)no1 1795915078 CNYPUEQWWZCVRU-TWMUSIFYSA-N 464.429 0.949 50 20 JCGD CC(C)(C)OC(=O)N1CC[C@H](C(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2ccc(B(O)O)cc2)C1 1796188677 HHANBSFRBLDDHQ-FFGOWVMKSA-N 471.363 0.875 50 20 JCGD CC(=O)N[C@H](Cc1cccc(F)c1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc(B(O)O)cc1 1796190677 XKEASRMWAZETBC-KAOXLYBCSA-N 481.333 0.505 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)c1ccc2c(n1)NC(=O)CC2 1796569620 WZILLJIARVZRDX-QDMKHBRRSA-N 463.498 0.530 50 20 JCGD O=C(NC1(C(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@@H](O)CCl)C3)CC1)OCc1ccccc1 1797248863 LEDZDYRVFPRIPO-MHORFTMASA-N 465.934 0.635 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N[C@@H]2C[C@@H]3CC[C@H](C2)N3C(=O)c2cnccc2C(=O)NN)cc1 1798439219 PJPPNGLCSAGLRB-BJWYYQGGSA-N 485.566 0.583 50 20 JCGD CC(=O)NCC(C)(C)C(=O)NC[C@@H]1CCN(C(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1803720315 OCMMRMCFBCQUDI-GHTZIAJQSA-N 460.579 0.623 50 20 JCGD COc1cc(C(=O)NC[C@@H]2CCN(C(=O)c3ccc(B(O)O)cc3)[C@H]2c2cccnc2)n(C)n1 1804924954 PEIGEUOEYHOWSB-UWJYYQICSA-N 463.303 0.137 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361034 GFUPLYZUIFOJAK-LAUBAEHRSA-N 470.298 0.666 50 20 JCGD O=C(CCc1cncnc1)NC[C@@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807499412 GJDULIBMUKFICK-NZQKXSOJSA-N 459.315 0.504 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)C(=O)Nc1cccnc1 1810463447 SFBBYFJQLHRRBA-GHTZIAJQSA-N 473.298 0.115 50 20 JCGD CC(C)(C)OC(=O)NCC(=O)NC[C@H]1CCN(C(=O)c2cnccc2C(=O)NN)[C@@H]1c1cccnc1 1812812371 TUTPZQDWKPCVRB-OXQOHEQNSA-N 497.556 0.924 50 20 JCGD CN1CCN(CCC(=O)Nc2nc3c(s2)C[C@H](NC(=O)c2cnccc2C(=O)NN)CC3)CC1 1814581286 QPDZSDGKFFXURY-CQSZACIVSA-N 486.602 0.005 50 20 JCGD CC[C@@H](Cl)C(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cnc3c2c(=O)n(C)c(=O)n3C)n[nH]1 1815799986 VNQRXLBIUWGXQX-OCCSQVGLSA-N 490.952 0.867 50 20 JCGD O=C(Nc1cc([C@@H]2CCCCN2C(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1)c1ccc(B(O)O)cc1 1817472832 ZXXLKDBHMFMEET-INIZCTEOSA-N 452.236 0.946 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cc4cccnn4n3)sc2C1)c1cccc(B(O)O)c1 1821163752 NHUFEKHYWVQSKP-AWEZNQCLSA-N 462.300 0.405 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CC(N)=O)C(=O)Nc1cc([C@H]2CCCCN2C(=O)[C@H](O)CCl)[nH]n1 1823530564 OPNAFGWAZLAXNT-BFHYXJOUSA-N 486.957 0.770 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)C3CCC4(CC3)OCCO4)sc2C1)c1cccc(B(O)O)c1 1824899557 KYRDBWAZTKZZOJ-KRWDZBQOSA-N 485.371 0.982 50 20 JCGD CC[C@H](Br)C(=O)Nc1nc2c(s1)C[C@@H](NC(=O)[C@@H](O)N1CCOCC1)CC2 1825445705 GHOZUGDNTZBICF-XMZIXOGTSA-N 461.382 0.879 50 20 JCGD C[C@](O)(CC(=O)O)CC(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1 1827055086 PMDYVUJNWIQPRE-WMZHIEFXSA-N 460.336 0.216 50 20 JCGD C[C@@](O)(C(=O)N1CCC([C@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)CC1)C(F)(F)F 1827055593 DZISWDGJXCYNAH-YLJYHZDGSA-N 456.270 0.913 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@H]1CCc2nc(NC(=O)CN3C(=O)CSC3=S)sc2C1 1828250152 PNZNEXDMKLJJQB-JTQLQIEISA-N 484.629 0.288 50 20 JCGD Cc1cc(C(=O)NCC(=O)N2CCCC[C@H]2C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)no1 1828990270 YEDADMPCYUAGJE-FQEVSTJZSA-N 497.556 0.645 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(COCCN(C(=O)CNC(=O)c3ccco3)C2)C1 1830539043 ZSKDPIIOKSVENB-AUUYWEPGSA-N 472.336 0.497 50 20 JCGD O=C(Cc1[nH]nc2c(Cl)cccc12)N1CCOC[C@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830732852 BWKUZLQEKYDTCL-JXFKEZNVSA-N 471.341 0.815 50 20 JCGD COc1ccc(Cl)cc1CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](O)CCl)CCO2 1830736884 XJYXONAFQGOENP-OXJNMPFZSA-N 461.342 0.947 50 20 JCGD COc1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)cn1 1833598843 QUTBTOGIQGTHJU-UHFFFAOYSA-N 466.347 0.269 50 20 JCGD CCn1ccc(C(=O)NC2CCN(C3CCN(C(=O)c4ccc(B(O)O)cc4)CC3)CC2)n1 1834273366 CZIGVMZSIDPVEM-UHFFFAOYSA-N 453.352 0.082 50 20 JCGD CC(C)c1nc(C(=O)N2CCC(N3CCC(NC(=O)c4ccc(B(O)O)cc4)CC3)CC2)co1 1834797513 RRHJQHWZELHZTG-UHFFFAOYSA-N 468.363 0.977 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCOC3)CC2)CC1 1835117997 GGHFSDKIIATLAM-GNYKCMPYSA-N 458.563 0.729 50 20 JCGD CN(C)c1ccc(C(=O)N2CCC(N3CCC(NC(=O)c4cnccc4C(=O)NN)CC3)CC2)nc1 1835737231 YQDJKPREIAHQRB-UHFFFAOYSA-N 494.600 0.645 50 20 JCGD COC(=O)C12CC(C(=O)N3CCC(N4CCC(NC(=O)c5cnccc5C(=O)NN)CC4)CC3)(C1)C2 1835738183 LRUZWAKLSHKVJO-UHFFFAOYSA-N 498.584 0.214 50 20 JCGD Cn1cc(C(=O)N2CCOC[C@@]3(CN(C(=O)c4ccc(B(O)O)cc4)CCO3)C2)c(C(F)(F)F)c1 1835928394 NSTIQEACYBWQIT-OAQYLSRUSA-N 495.263 0.108 50 20 JCGD Cc1cc2[nH]c(C(=O)N3CCOC[C@@]4(CN(C(=O)c5ccc(B(O)O)cc5)CCO4)C3)cc2s1 1835932042 LGHGWRNOJRLQJT-HSZRJFAPSA-N 483.355 0.601 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCOC[C@@]2(CN(C(=O)CNC(=O)c3ccco3)CCO2)C1 1836128268 HPPDUILXQDADSX-RBUKOAKNSA-N 462.330 0.702 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@]1(F)CCCCC1(F)F)CCO2 1836629639 LSEWZGPZCFMNRJ-VQTJNVASSA-N 478.512 0.733 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3onc4ccccc34)C2)C1 1837460194 XEIWFWXAACCDML-QHCPKHFHSA-N 480.481 0.210 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cc(C)on3)CCO2)C1 1837553427 BXKRKORVTDAHCD-OPLUHCSASA-N 484.513 0.587 50 20 JCGD C[C@H](CBr)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](C)Cn1cncn1)CCO2 1837641102 YBPVCOARMRGHAM-IIDMSEBBSA-N 458.357 0.402 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1 1837710185 MRSPLGXJWNAQCI-NRFANRHFSA-N 451.596 0.941 50 20 JCGD Cc1nnsc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837919475 WAPQWJFUMYGASO-UHFFFAOYSA-N 458.349 0.452 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837922184 UHZRPAZDKNZXJE-QFIPXVFZSA-N 473.379 0.283 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCC(OC2CCN(C(=O)[C@H](C)NC=O)CC2)CC1 1838103279 WYWSSZAKODSQKA-BDKXHVGHSA-N 460.535 0.254 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1nc3ccccc3o1)CCO2 1839503252 NCEMCOPFRJYCHJ-JOCHJYFZSA-N 459.503 0.271 50 20 JCGD O=C1CSc2ncc(C(=O)N3CCO[C@]4(COCCN(C(=O)[C@@H](F)Cl)C4)C3)cc2N1 1839578148 SNFLUPMXUPNLLM-RDTXWAMCSA-N 458.899 0.730 50 20 JCGD O=C([C@H](O)CCl)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3[nH]nc(C(F)(F)F)c3C1)CCO2 1839737647 VDIKQTCNLHULKX-FVMIAERFSA-N 480.871 0.199 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)CS(=O)(=O)N3CCCC3)C2)C1 1839964426 RBTYKAQWVIUHBD-MAUKXSAKSA-N 496.424 0.042 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccc4ncccc4c3)C2)C1 1840184329 GZCQAVIMANDZIP-DEOSSOPVSA-N 469.542 0.678 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CC2(CCCN2C(=O)[C@@]23C[C@@H]2CN(C(=O)OC(C)(C)C)C3)C1 1846127666 XGIJWHSKWRZUCO-WAIKUNEKSA-N 463.579 0.820 50 20 JCGD C[C@H]1C[C@@H](C)CN(S(=O)(=O)c2cccc(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)c2)C1 15639702 IJKCMSAUSMDDOU-IJEWVQPXSA-N 457.574 0.549 50 20 JCGD Cc1sc2nc(CS[C@H](C)C(=O)NNC(=O)[C@H]3CCS(=O)(=O)C3)[nH]c(=O)c2c1C 17642330 YZOMOIFVODKOCO-MNOVXSKESA-N 458.587 0.805 50 20 JCGD O=C(CCN1CCN(c2ccccc2)CC1)NNC(=O)CN1C(=O)N[C@]2(CCc3ccccc32)C1=O 23157291 MERJMCKZEYPFTD-SANMLTNESA-N 490.564 0.740 50 20 JCGD CN(C)S(=O)(=O)c1ccc(N2CCOCC2)c(C(=O)NNC(=O)[C@H]2COc3ccccc3O2)c1 27601560 BTEPTPSOZDVFAI-HXUWFJFHSA-N 490.538 0.375 50 20 JCGD C[C@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C(=O)N([C@@H]1CCS(=O)(=O)C1)N(C)C 728178709 BYOWHTWFDMDSKF-WCQYABFASA-N 457.496 0.865 50 20 JCGD O=C(COC(=O)c1ccc(F)c(S(=O)(=O)NC2CC2)c1)NNC(=O)[C@H]1COc2ccccc2O1 728323135 VIESSGKIOSMJGM-QGZVFWFLSA-N 493.469 0.411 50 20 JCGD CN(CC(=O)OCC(=O)NNC(=O)[C@H]1COc2ccccc2O1)C(=O)c1ccc(Br)o1 728330383 JIANQHCORILFGB-CQSZACIVSA-N 496.270 0.645 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNC(=O)c1ccc(S(=O)(=O)N(C)c2ccccc2)cc1 729275122 LONNRQSYQKZWEO-CYBMUJFWSA-N 454.530 0.210 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)c2ccc(C(=O)NNC(=O)[C@H](C)NS(C)(=O)=O)cc2)cc1 729275729 QZEQHVITMKEFFS-AWEZNQCLSA-N 468.557 0.519 50 20 JCGD CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)/C=C\c1cncc(F)c1)c(=O)n2Cc1ccccc1 729310524 MPYFLWARYGHANB-HJWRWDBZSA-N 491.483 0.823 50 20 JCGD C[C@H]1CCC[C@@H](NC(=O)CN2CCN(C(=O)NNC(=O)CNC(=O)c3cccs3)CC2)C1 731220325 CESSUQDYHRUMIU-JKSUJKDBSA-N 464.592 0.531 50 20 JCGD O=C1COc2ccc(S(=O)(=O)N3CCN(C(=O)NNC(=O)c4ccccc4)CC3)cc2N1 731359502 UTUCNBUPHMRASU-UHFFFAOYSA-N 459.484 0.378 50 20 JCGD CCCCCn1nc(C(=O)NNC(=O)NCCS(=O)(=O)NC(C)C)c2ccccc2c1=O 746972948 OTHKLEOOJYTFRA-UHFFFAOYSA-N 466.564 0.859 50 20 JCGD N#Cc1ccc(C(=O)NNC(=O)N2CCN(S(=O)(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1 747102320 OOXGSPOZFDTUHP-UHFFFAOYSA-N 458.456 0.827 50 20 JCGD O=C(CCOc1ccccc1)NNC(=O)NCCS(=O)(=O)N1CCN(c2ccccn2)CC1 747104843 MUYJYWJXSPQDGJ-UHFFFAOYSA-N 476.559 0.333 50 20 JCGD O=C(CSc1nnc(O)nc1O)NN=C1C(=O)Nc2c(I)cccc21 750933080 WXMRVBYUTHLGBG-UHFFFAOYSA-N 472.224 0.452 50 20 JCGD O=C(COC(=O)CCCn1c(=O)oc2ccccc21)NNC(=O)[C@H]1COc2ccccc2O1 777229282 JVVMYTGTHADNMU-GOSISDBHSA-N 455.423 0.905 50 20 JCGD CCOc1ccc(S(=O)(=O)Nc2ccc(C(=O)NNC(=O)c3cn(C)c(=O)nc3O)cc2)cc1 915057829 IPUOBWZYOCVXFP-UHFFFAOYSA-N 487.494 0.760 50 20 JCGD CC(C)NS(=O)(=O)c1ccc(NNC(=O)NCc2ccc(C(=O)N3CCNC(=O)C3)cc2)nc1 916391578 DSHOZPVDNBQAOC-UHFFFAOYSA-N 489.558 0.167 50 20 JCGD CCCC(=O)NCC(=O)NNC(=O)C[C@H]1c2cc(OC)c(OC)cc2CCN1S(C)(=O)=O 917393289 JGYJRRSYXSMFJP-HNNXBMFYSA-N 470.548 0.016 50 20 JCGD Cc1ccc(S(=O)(=O)N2CCC[C@@H](C(=O)NNC(=O)c3ccc(-n4cnnn4)cc3)C2)cc1 920251289 IKMXVXQFANWTLX-QGZVFWFLSA-N 469.527 0.833 50 20 JCGD CC(=O)N1CCN(c2ccc(C(=O)N([C@@H]3CCS(=O)(=O)C3)N(C)C)cc2[N+](=O)[O-])CC1 1317798579 LKHJWAYEKFMXDQ-MRXNPFEDSA-N 453.521 0.369 50 20 JCGD COc1cc(OC)cc(C(=O)N2CCC(C(=O)NNC(=O)[C@@H]3CCS(=O)(=O)C3)CC2)c1 1318234626 QCPXBKLXSFHIJH-CQSZACIVSA-N 453.517 0.138 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cc(Cl)nc2n[nH]cc12 1777784476 JPAFPKAVWABGRG-WZONZLPQSA-N 497.748 0.732 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc(B(O)O)cc1)C2)c1cnc2ccoc2c1 1777919395 JACQXDCBCOPKPN-ZJSXRUAMSA-N 463.299 0.949 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@]2(C1)CN(C(=O)C1CCC(F)(F)CC1)CCO2 1779028276 BKMSFJFOHNPLEM-FQEVSTJZSA-N 451.474 0.954 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)C[C@@H]3COc4ccccc4O3)CCO2)C1 1779028321 CTHDEHSPSRAKFK-VOIUYBSRSA-N 481.509 0.359 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@]2(CN(C(=O)c3cc(-n4ccnc4)ccn3)CCO2)C1 1779032601 NYBBZGXNBYLRBJ-QHCPKHFHSA-N 476.497 0.023 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(CCN(C(=O)[C@@H](COC(C)=O)OC(C)=O)C2)C1 1779076508 NEYONWZWCPLPSZ-HDMKZQKVSA-N 463.325 0.485 50 20 JCGD COC[C@H](NC(C)=O)C(=O)N1CC[C@@]2(CN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)CCO2)C1 1779321157 YQAFJEYZVADADR-NHTFKITNSA-N 476.480 0.853 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@]2(CCN(C(=O)Cc3cn4c(nc3=O)SCC4)C2)C1 1780936151 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C[C@H](C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1)[S@@](=O)c1ccccc1 1786983747 RKGBIBOGCQWZGP-OJZOHFENSA-N 484.383 0.156 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)Cc3nc(C)no3)[C@H]2C1 1787053263 RXHOFIKWFQOMLI-OTTMNBPASA-N 457.491 0.034 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3c[nH]c4nccc-4c3)[C@H]2C1 1787333174 KPOZUBYPTIUZFH-JVPBZIDWSA-N 463.498 0.420 50 20 JCGD COc1cc(OC)c(F)c(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1789236300 FGEDKYVQYFQASI-ZRCAFCQKSA-N 486.305 0.430 50 20 JCGD Cc1cc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)CN(C)NC(=O)NCc4ccccc4)[C@H]3C2)no1 1789725171 ZYIUFVJUVBAJFA-ZJOUEHCJSA-N 484.557 0.923 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)C3(N4CCN(C)CC4)CC3)[C@H]2C1 1789807892 QEUMWROLIJRWFO-XSLAGTTESA-N 471.440 0.920 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccc4c(c3)NC(=O)CO4)C[C@@H]21 1791254788 TZEPBKMESGBEHI-XSWJXKHESA-N 451.907 0.865 50 20 JCGD CN(C)NC(=O)CCC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)C[C@@H]1CCCN1C(=O)OC(C)(C)C 1793649725 KRRLDCJTGIJBPI-SUWCGCSTSA-N 495.621 0.739 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCCNC(=N)N)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](F)Cl)C2 1795518742 CLFYBTVXLLVTKU-KHMAMNHCSA-N 492.980 0.267 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@H](CO)NC(=O)OC(C)(C)C 1796740149 NFMLYNIWXSLEPQ-PZBKIMLWSA-N 490.561 0.644 50 20 JCGD Cc1ccc2[nH]c(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3cnccc3C(=O)NN)C4)cc2c1 1796897127 HRDHLNFKVHZIII-VPTLXERWSA-N 462.510 0.992 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1ON=C(c2ccccc2)O1 1798327502 NXUNWDDOBGDKKP-KATBDVFWSA-N 464.482 0.672 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc(N2CCCOC2=O)cc1 1799816354 RCBUWIBEZDVAIT-HATOLVCRSA-N 493.325 0.230 50 20 JCGD CC(=O)N[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2)c1ccc(F)cc1 1799823232 PDXCJNINVZYGDQ-BMQTXXJKSA-N 482.516 0.953 50 20 JCGD CC[C@H](Br)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@H](COC(C)=O)OC(C)=O)C2 1800642064 UKRCHEYMJCXUQR-QRJUGERDSA-N 463.325 0.244 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(-c3cc[nH]n3)cc1)C2 1801012613 RUFLJOKIIIRAJV-OPMZPASUSA-N 454.531 0.653 50 20 JCGD C[C@H](NC(=O)c1ccccn1)C(=O)N1CC[C@H](CNC(=O)[C@H](O)CCl)[C@H]1c1cccnc1 1803148606 VFZSQKPCMPUSSP-RGIVZKHGSA-N 459.934 0.901 50 20 JCGD O=C(CCNC(=O)c1ccc[nH]1)NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1804462409 ZQRTXSLVIACTRR-AUSIDOKSSA-N 489.341 0.229 50 20 JCGD C[C@H](NC(=O)OC(C)(C)C)C(=O)N1CC[C@@H](CNC(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1 1807366895 VRQBXUNAIGCEKS-NBHGPNQESA-N 496.373 0.994 50 20 JCGD O=C(Cn1cc(Cl)cn1)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807410677 SIHSBMOADMTSRP-DYESRHJHSA-N 467.722 0.631 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)CCc2nc(N)n[nH]2)[C@@H]1c1cccnc1 1808416544 BEPDDBIPHGQLCW-IVIIRQTASA-N 492.544 0.555 50 20 JCGD CCNC(=S)NCC(=O)N1CC[C@H](CNC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1808416608 OVFQXDXNRRURQK-SSZMOEMMSA-N 498.613 0.705 50 20 JCGD Cc1cnc2c(C(=O)N3CCC4(CCCN(C(=O)c5cccc(B(O)O)c5)C4)CC3)cnn2c1 1809978822 USXZLETXZJWZNQ-UHFFFAOYSA-N 461.331 0.876 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)c2cccnc2C(N)=O)[C@H]1c1cccnc1 1810300487 ZEEKHASWVCEGOR-YWZLYKJASA-N 488.508 0.207 50 20 JCGD CNC(=S)NCCC(=O)NC[C@@H]1CCN(C(=O)/C(C)=N/NC(=O)c2ccc[nH]2)[C@@H]1c1cccnc1 1810306709 MZNSAVCPMSDWQZ-CFBFWRNQSA-N 498.613 0.705 50 20 JCGD COC[C@H](Cl)C(=O)N1CC[C@H](CNC(=O)[C@@H](Cc2cnc[nH]2)NC(C)=O)[C@@H]1c1cccnc1 1813338075 ONLIXDDRAGFWEH-MDNKFWRPSA-N 476.965 0.812 50 20 JCGD Cn1cc(CC(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)cn1 1813456577 DZZUMURNMRKLKE-UTKZUKDTSA-N 462.514 0.376 50 20 JCGD CC(C)n1cnc(C(=O)N[C@@H]2CCc3nc(NC(=O)c4cccc(B(O)O)c4)sc3C2)n1 1815354514 GEVOPXNHFFQBRE-CQSZACIVSA-N 454.321 0.535 50 20 JCGD O=C(CCC(=O)N1CCCC1)Nc1cc([C@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)[nH]n1 1815638799 UCBIZLCADKPGLQ-LJQANCHMSA-N 467.335 0.798 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@H]1CCc2nc(NC(=O)c3nc[nH]c3[N+](=O)[O-])sc2C1 1817198759 KNIRICVHWODOSA-QMMMGPOBSA-N 471.459 0.313 50 20 JCGD O=C(CNCP(=O)(O)O)Nc1cc([C@@H]2CCCCN2C(=O)CCBr)[nH]n1 1817233482 ZJVKTBMCGSRKGM-NSHDSACASA-N 452.246 0.912 50 20 JCGD C=C(CC(=O)OCC)C(=O)N[C@@H]1CCc2nc(NC(=O)c3cnccc3C(=O)NN)sc2C1 1819800980 WLOHSNVOGWKZFU-GFCCVEGCSA-N 472.527 0.877 50 20 JCGD CN(CC(=O)Nc1nc2c(s1)C[C@@H](NC(=O)c1nc[nH]n1)CC2)NC(=O)NCc1ccccc1 1822517954 FPETZSFNOTXIFA-AWEZNQCLSA-N 483.558 0.833 50 20 JCGD CCS(=O)(=O)CC(=O)N1CCCC[C@H]1C1CCN(C(=O)c2cccc(B(O)O)c2)CC1 1824467238 TZQPMYPMVDLCNZ-IBGZPJMESA-N 450.366 0.034 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N[C@@H]1CCc2nc(NC(=O)CCC(=O)NN(C)C)sc2C1 1826092337 ZRQYXFXEEJPHHW-HIFRSBDPSA-N 452.581 0.733 50 20 JCGD N[C@H](C(=O)N1CCC([C@@H]2CCCCN2C(=O)c2ccc(B(O)O)cc2)CC1)c1ccccn1 1827051272 QXERFMPXDGAUMT-VXKWHMMOSA-N 450.348 0.695 50 20 JCGD Cn1c(C(=O)N2CCC([C@@H]3CCCCN3C(=O)c3cnccc3C(=O)NN)CC2)cccc1=O 1828926058 ZHMQXXCUMZFYTE-IBGZPJMESA-N 466.542 0.931 50 20 JCGD COc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)[C@@H](O)CCl)CCO3)cc(OC)c1C 1830738952 WEDYFYSTBTZOQD-HRAATJIYSA-N 456.923 0.682 50 20 JCGD CC(C)(C)OC(=O)N1CCO[C@H](C(=O)N2CCO[C@]3(COCCN(C(=O)[C@@H](F)Cl)C3)C2)C1 1830881759 JRUSGKQLYYUIKI-BXTJHSDWSA-N 479.933 0.613 50 20 JCGD O=C(Cc1ccc2ncccc2c1)N1CCO[C@@]2(COCCN(C(=O)c3ccc(B(O)O)cc3)C2)C1 1832030950 GJJYJCYAERQPIZ-SANMLTNESA-N 489.337 0.227 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H]1Cc3ccccc3CN1C)CCO2 1832472885 UPPXKOMEZZLTNN-SXWKCWPCSA-N 465.978 0.753 50 20 JCGD Cc1cn2c(=O)c(C(=O)N3CCC(N4CCC(NC(=O)[C@@H](O)CCl)CC4)CC3)cnc2s1 1833310690 YMMTZDKMDNBSHG-KRWDZBQOSA-N 482.006 0.849 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)Cc1ccc(Cl)cc1)CCO2 1835062343 ILNWWGURLAZUHB-JOCHJYFZSA-N 466.966 0.712 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)[C@H]3CCCCC3(F)F)C2)C1 1835927840 YQRVYENCZHBDRN-NQIIRXRSSA-N 466.290 0.262 50 20 JCGD O=C(Cc1ccc2ccccc2c1)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(B(O)O)cc1)CCO2 1835929164 CXTPGIHCNXPYHD-MHZLTWQESA-N 488.349 0.832 50 20 JCGD C[C@@H](Cc1ccc(F)cc1)C(=O)N1CCOC[C@]2(CN(C(=O)c3ccc(B(O)O)cc3)CCO2)C1 1835932202 TWIJCMGMRSPYHJ-AVRWGWEMSA-N 484.333 0.454 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@@]3(C2)CN(C(=O)c2cccc(B(O)O)c2)CCO3)ccc1F 1835939097 FKBWPYAQLYGWHZ-HSZRJFAPSA-N 456.279 0.198 50 20 JCGD COC[C@@H](NC(C)=O)C(=O)N1CCC(N2CCC(NC(=O)[C@@](C)(Cl)CCl)CC2)CC1 1836400095 VCLQXIDAPAOKOV-XLIONFOSSA-N 465.422 0.945 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCOC[C@]2(C1)CN(C(=O)c1cc3c(s1)CCCC3)CCO2 1836877974 FCIVEHFKMRKRGY-DEOSSOPVSA-N 484.383 0.691 50 20 JCGD Cc1cc(C(=O)N2CCC(OC3CCN(C(=O)c4cccc(B(O)O)c4)CC3)CC2)nn1C 1837451531 QPGFEAGNMWPEQU-UHFFFAOYSA-N 454.336 0.334 50 20 JCGD Cn1cncc1C(=O)N1CCC(OC2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1837514023 NZGLSSUJZBTONW-UHFFFAOYSA-N 455.519 0.345 50 20 JCGD Cc1ccc(=O)n(C(C)(C)C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](C)Br)C3)C2)n1 1837659181 SWHQBECMZLUICX-FOIQADDNSA-N 485.379 0.527 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccccc3C(=O)OCCO)C2)C1 1837715488 SSIMSMPTVSSMNZ-QHCPKHFHSA-N 494.617 0.757 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3cc(-c4cccnc4)[nH]n3)CCO2)C1 1838030787 BMHXASFHOMDJEQ-IERDGZPVSA-N 463.922 0.796 50 20 JCGD CNCCCC(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc([N+](=O)[O-])ccc1OC(C)=O)CCO2 1838528256 MXYFBPVISYQKDP-JOCHJYFZSA-N 478.502 0.590 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](NC(=O)c3ccccc3)[C@@H](C)O)C2)C1 1839141816 UPGOAMHCGNMOIH-LDQAXMLRSA-N 481.977 0.640 50 20 JCGD CC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839147185 ILPMDKIYHXWHHK-CVDCTZTESA-N 496.008 0.806 50 20 JCGD O=C(c1cc2cn[nH]c2cn1)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200193 HMEUCMMQXBPLLM-RHSMWYFYSA-N 456.272 0.718 50 20 JCGD O=C(c1n[nH]cc1[N+](=O)[O-])N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839200622 MSDGHGBQUQQQQG-BXUZGUMPSA-N 450.221 0.078 50 20 JCGD CCOC(CC(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@H](F)Br)CCO2)OCC 1839202589 KNAAORIFWHMFGV-DOTOQJQBSA-N 455.321 0.923 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(C1)CN(C(=O)c1ccc(O)c(F)c1)CCO2 1839303865 YSGYQBAPOFADTH-XQQQEEOESA-N 487.488 0.735 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCOC[C@]2(CN(C(=O)/C=C/c3cccc(O)c3)CCO2)C1 1839925234 HBRMOTNIUPMHHG-JVPDDCAZSA-N 481.509 0.174 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@]2(COCCN(C(=O)Cc3ccc(O)cn3)C2)C1 1839967637 SQLIZFFIOXUGSM-LPHOPBHVSA-N 456.337 0.960 50 20 JCGD COc1cccc(/C=C/C(=O)N2CCO[C@]3(COCCN(C(=O)c4cnccc4C(=O)NN)C3)C2)c1 1839996013 LZVWPVGGCMRLPB-GJCNFQEQSA-N 495.536 0.477 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cc(C)c([N+](=O)[O-])cn3)C2)C1 1840152261 CUDCTDUVDQQERI-KUHUBIRLSA-N 456.883 0.622 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](Cc3cccc(F)c3)NC(C)=O)C2)C1 1840156892 XKQQOUPBWWVKKY-MZKRTTBSSA-N 499.967 0.583 50 20 JCGD Cc1cc(CCC(=O)N2CCOC[C@]3(C2)CN(C(=O)CCC(=O)NN(C)C)CCO3)ccn1 1840182417 IXLIUBRDXPJWMJ-QHCPKHFHSA-N 461.563 0.152 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)C3CCC(F)(F)CC3)C2)C1 1840182503 KCWUBMNFNBRQCY-HXUWFJFHSA-N 460.522 0.641 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCOC[C@]2(C1)CN(C(=O)CCc1c[nH]c3ncccc13)CCO2 1840871493 KUSLDDQETZQORM-DEOSSOPVSA-N 486.573 0.325 50 20 JCGD C[C@H](NC(=O)c1cnccn1)C(=O)N1CC2(CCCN2C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C1 1841924649 LJFVYSOBNZLNQU-GJZGRUSLSA-N 494.980 0.930 50 20 JCGD CC(C)n1nc(C(=O)N2CCCC23CN(C(=O)c2cnccc2C(=O)NN)C3)cc1C(=O)O 1842260674 VNTKLZHAXIKRKP-UHFFFAOYSA-N 455.475 0.292 50 20 JCGD COc1ccc(/C=C/C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2cccc(B(O)O)c2)c(OC)c1OC 1847646822 OCEKGLXNGBJMSX-ILUDYIOVSA-N 480.326 0.921 50 20 JCGD CC(C)(C)OC(=O)N1CCC[C@@H]1CC(=O)N1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc(B(O)O)c1 1847966920 FQETVXZMZLZVJX-AABGKKOBSA-N 471.363 0.971 50 20 JCGD CCCC[C@H](/N=C1/NS(=O)(=O)c2ccccc21)C(=O)NNC(=O)CNC(=O)c1ccco1 725741396 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CCn1cnc2c1c(=O)n(CC(=O)NNC(=O)[C@H](C)NC(=O)C(C)(C)C)c(=O)n2Cc1ccccc1 875675067 PULGAPKYJORBPN-HNNXBMFYSA-N 497.556 0.126 50 20 JCGD O=C(NCCNC(=O)c1cccnc1)NNC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 916443537 KFZJCABKDQKBIP-UHFFFAOYSA-N 460.516 0.240 50 20 JCGD Cc1nc(N2CCOCC2)sc1C(=O)NNS(=O)(=O)c1cccc(C(=O)NC2CC2)c1 917723832 NZRMLOZCKINDJI-UHFFFAOYSA-N 465.557 0.804 50 20 JCGD Cn1c(C=NNC(=O)Cc2nn3c(C4CCCCC4)nnc3s2)nc2c1c(O)nc(=O)n2C 920367429 CXSJUIGLOCHRIO-UHFFFAOYSA-N 470.519 0.612 50 20 JCGD CN(CC(=O)NNC(=O)c1ccc([N+](=O)[O-])cc1)CC(=O)N1CCN(C(=O)OC(C)(C)C)CC1 921192653 ODLHQCBBNWPFKV-UHFFFAOYSA-N 478.506 0.367 50 20 JCGD CN1CCN(c2ncccc2CNC(=O)NNC(=O)c2csc(N3CCOCC3)n2)CC1 921198982 FEDQRZHXTRPMSK-UHFFFAOYSA-N 460.564 0.271 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1[nH]nc3ncccc13)C2 1779373183 LIDAPGPJHYIADU-UZUQRXQVSA-N 478.513 0.398 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CCO[C@]2(CCN(C(=O)c3csc(C(F)(F)F)n3)C2)C1 1779755314 JSRUGYCWEXORBF-SFHVURJKSA-N 469.250 0.599 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(CCN(C(=O)c3cc(Cl)cc4nn[nH]c34)C2)C1 1780224661 SPCVZFLWWPSKHS-HXUWFJFHSA-N 463.926 0.428 50 20 JCGD CN1CC(C(=O)N2CC[C@H]3OCCC[C@@]3(CNC(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1780559629 XAVCPTSPDGFHTL-PXDATVDWSA-N 486.617 0.408 50 20 JCGD C[C@@](Cl)(CCl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cc(=O)n3[nH]cnc3n1)C2 1780713208 NERABVKUPNBNPA-UPRAQXHNSA-N 471.345 0.781 50 20 JCGD COC(=O)[C@H]1CCC[C@H](C(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)c2cccc(B(O)O)c2)C3)C1 1782169684 RPKBRGHDTNVEAC-BVLNQHGRSA-N 486.374 0.473 50 20 JCGD COC[C@@H](Cl)C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)C1(N3CCN(C)CC3)CC1)C2 1782179314 QAONCSCFAGBFRS-DBXWQHBBSA-N 457.015 0.534 50 20 JCGD COC[C@@H](Cl)C(=O)N1CC[C@]2(CN(C(=O)c3cc(S(C)(=O)=O)ccc3F)CCO2)C1 1783880802 GWRBKHIVRSHNIU-DNVCBOLYSA-N 462.927 0.927 50 20 JCGD COC(=O)c1ccc(C(=O)N2CCO[C@]3(CCN(C(=O)CCC(=O)NN(C)C)C3)C2)c([N+](=O)[O-])c1 1783934828 NVMYPRMWLXNXNQ-QFIPXVFZSA-N 491.501 0.198 50 20 JCGD Cn1nc(C(F)(F)F)cc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@H]2C1 1786983958 HPEWHGHRSGBMQO-QRTARXTBSA-N 480.252 0.026 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)c3ccnc4c(O)cccc34)C[C@@H]21)c1ccc(B(O)O)cc1 1786984002 YNEDHXIADDQIDN-BUKVSMQUSA-N 475.310 0.527 50 20 JCGD O=C1CC(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]32)=Cc2ccccc2N1 1789155449 CWUNXDDQDPDGTI-HARLFGEKSA-N 489.337 0.386 50 20 JCGD N#C/C(=C\c1ccc(F)cc1F)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CN(CCO)CCO)C[C@@H]21 1790695061 AQTKKCKLRCBCMG-LBJJKJRNSA-N 492.523 0.138 50 20 JCGD COc1cccc(/C=C/C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)c4cccc(B(O)O)c4)C[C@@H]32)c1 1790999613 UISMQNVIGUDJFX-HCLDPKQZSA-N 464.327 0.682 50 20 JCGD COc1cc(C(=O)NC[C@@H]2OC[C@@H]3CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]32)cc(OC)c1C 1792047527 BMYVXIICLAKIQD-MDKPJZGXSA-N 476.574 0.979 50 20 JCGD COC(=O)N[C@@H](C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1ccc(B(O)O)cc1)C2)c1ccccc1 1792903518 CFUGTJQITUVUBK-PLACYPQZSA-N 465.315 0.716 50 20 JCGD CC(C)(C)OC(=O)N1C(=O)CC[C@H]1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)[C@H](O)CCl 1792982986 XPGXHCQWMKIREV-QKDZRIPBSA-N 459.927 0.102 50 20 JCGD CC(C)(C)OC(=O)N1CC2(CC(C(=O)N[C@@H]3C[C@@H]4CC[C@H](C3)N4C(=O)[C@@H](O)CCl)=NO2)C1 1793116199 IBYLURTUORUFKD-FQLMCAECSA-N 470.954 0.990 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)CN1CCCC1=O)C2 1793881227 XDHCTRSMRXZJFG-KRXQYRFLSA-N 472.970 0.331 50 20 JCGD Cc1nc(C(=O)N2[C@H]3CC[C@@H]2C[C@H](NC(=O)CN(C)NC(=O)NCc2ccccc2)C3)c(=O)[nH]c1C 1794612719 IKEMELLMLKGVCP-ACDBMABISA-N 495.584 0.985 50 20 JCGD CC(C)(C)OC(=O)N[C@H](CCN)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C(Cl)Cl)C2 1795584896 XXCHIDINYLWQNW-YVECIDJPSA-N 453.367 0.622 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(Cl)nc1Cl)C2)c1ccc(B(O)O)cc1 1795734081 BIRDWLPZPGAUJU-FVCICTRLSA-N 464.114 0.585 50 20 JCGD O=C(N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cc(-c3ccccc3Cl)[nH]n1)C2)c1cccc(B(O)O)c1 1795740205 DTNBNAHDKTXKDE-MFKICJERSA-N 494.744 0.927 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1n[nH]c3c1CCCC3)C2 1796440322 LFOYUVJAUPGWLA-DHMDNZFNSA-N 467.530 0.626 50 20 JCGD CCc1[nH]nc(C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)/C(C)=N/NC(=O)c2ccc[nH]2)c1Cl 1796440589 SSWTZYGRORAUKV-GPVAFHQSSA-N 475.937 0.963 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)Cc1cc(F)cc(F)c1)C2 1797750692 OVUQYXOHRLLGGN-VTEUUUEMSA-N 459.453 0.409 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(N2CCCC2)c(F)c1 1798557959 CEVQAYLNNHCFKC-FAQVEIGNSA-N 496.543 0.941 50 20 JCGD COCCOCCOCCOCCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)[C@@H](F)Cl)C2 1799382961 SHLAFJRTFVGTCU-CYGHRXIMSA-N 454.923 0.197 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)C[C@@H](NC(=O)OC(C)(C)C)C1CC1)C2 1801010658 ONFBJXNKCWERJJ-WYADAEROSA-N 495.621 0.642 50 20 JCGD CN(C)NC(=O)CCC(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc3c(c1)SCC(=O)N3)C2 1801011508 RHYFSJRUDAAEFX-USGNIVHTSA-N 475.571 0.307 50 20 JCGD C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1cnccc1C(=O)NN)C2 1801173775 GQSKUJWDGAYEBV-JWVYWZTKSA-N 451.527 0.767 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CC[C@@H](CNC(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1 1807366027 RKFFGBJIGFPCQE-BVSLBCMMSA-N 466.347 0.386 50 20 JCGD CC(C)c1nc(CC(=O)N2CC[C@@H](CNC(=O)c3cccc(B(O)O)c3)[C@@H]2c2cccnc2)no1 1807369274 DRZDILNTWKWUFB-AVRDEDQJSA-N 477.330 0.830 50 20 JCGD COC(=O)[C@@H]1CC=CC[C@@H]1C(=O)N1CC[C@H](CNC(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1 1807373702 DOMIHPPOOHGQFW-PNJWGLBASA-N 491.353 0.836 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2ccc(B(O)O)cc2)[C@@H]1c1cccnc1)c1n[nH]c2c1CCCC2 1808043022 RQPYYYQXRHIGPG-WZONZLPQSA-N 473.342 0.997 50 20 JCGD O=C1Cc2cc(C(=O)NC[C@H]3CCN(C(=O)c4cccc(B(O)O)c4)[C@@H]3c3cccnc3)ccc2N1 1809683852 JDPYEDHHXFVYPG-NTKDMRAZSA-N 484.321 0.889 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@H]1CCN(C(=O)CCN2CCOCC2)[C@H]1c1cccnc1 1810302143 GWHPLRGBUAZQDT-AVRDEDQJSA-N 481.557 0.122 50 20 JCGD Cc1cc(CC(=O)N2CC[C@@H](CNC(=O)c3cnccc3C(=O)NN)[C@H]2c2cccnc2)no1 1810304288 BYCUMXPJTKHOIW-HRAATJIYSA-N 463.498 0.939 50 20 JCGD O=C(NC[C@@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@@H]1c1cccnc1)c1cnc2snnc2c1 1811338299 BPIXHZHMVRLYOE-OXJNMPFZSA-N 488.338 0.795 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@@H](CNC(=O)[C@@H]2C[C@H]3CC[C@@H]2O3)[C@@H]1c1cccnc1 1812889747 SDKDKGBTVYJZSC-ZRWHEIHHSA-N 464.526 0.967 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CC[C@@H](CNC(=O)CCC(=O)NN(C)C)[C@@H]1c1cccnc1 1813068659 PLISRZMLIMZONP-RXVVDRJESA-N 460.579 0.623 50 20 JCGD CN(CC(=O)N[C@@H]1CCc2nc(NC(=O)[C@H]3CCC(=O)N3)sc2C1)NC(=O)NCc1ccccc1 1814407996 AREGTOYATLQGRB-NVXWUHKLSA-N 499.597 0.680 50 20 JCGD O=C(Cc1ccccc1O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1 1815348094 DEYYTKFOMYXEOS-INIZCTEOSA-N 451.313 0.997 50 20 JCGD CN(CC(=O)N[C@H]1CCc2nc(NC(=O)[C@H](F)Br)sc2C1)C(=O)C(=O)O 1823009354 NWQYHJHQLVZHOV-WKEGUHRASA-N 451.274 0.289 50 20 JCGD C[C@@H](CBr)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)CN(CCO)CCO)CC1 1824095611 HPWOLYMRZYDZJC-FUHWJXTLSA-N 462.429 0.924 50 20 JCGD CC[C@@H](NC(N)=O)C(=O)N1CCCC[C@@H]1C1CCN(C(=O)c2cnccc2C(=O)NN)CC1 1827561181 BVRJZBALPPIBAR-QZTJIDSGSA-N 459.551 0.365 50 20 JCGD C[C@H](CBr)C(=O)N1CCN(C(=O)OCc2ccccc2)[C@@]2(CCN(C(=O)C(O)O)C2)C1 1828539801 QJOJVBYKJBPMOX-QVKFZJNVSA-N 498.374 0.780 50 20 JCGD Cc1cccc(CCC(=O)N2CCO[C@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)c1 1832238588 JEPXXLVJCDQLFH-RUZDIDTESA-N 466.343 0.378 50 20 JCGD CC(C)(C)OC(=O)N[C@@H](CCl)C(=O)N1CCO[C@@]2(COCCN(C(=O)c3cocn3)C2)C1 1832549698 YFLSIXGBJKJVPF-VBKZILBWSA-N 472.926 0.877 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)c1cnc(Cl)nc1 1833014008 BCMWIGCGQWJXJK-UHFFFAOYSA-N 471.754 0.309 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCOC[C@]2(C1)CN(C(=O)[C@H]1CCc3nc(O)nc(O)c3C1)CCO2 1833025325 CEZYQRZGZSRACM-NYHFZMIOSA-N 494.621 0.301 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@]2(CN(C(=O)Cc3ccc(C)nc3)CCO2)C1 1833128850 KLJHHNAADUTRDY-JZZXMACJSA-N 482.541 0.523 50 20 JCGD C[Si](C)(C)OCC(=O)N1CCC(N2CCC(NC(=O)c3cc4n(n3)CCNC4=O)CC2)CC1 1834326309 TZZKQIIZVONWPW-UHFFFAOYSA-N 476.654 0.663 50 20 JCGD Cc1nc(N)sc1C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1834754396 SMLRZCHCUJKEOR-UHFFFAOYSA-N 471.392 0.213 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)CN3C(=O)CSC3=S)CC2)CC1)[C@@H](F)Cl 1835082931 HROYSLDYBVJTQF-OAHLLOKOSA-N 450.989 0.953 50 20 JCGD CC(=O)OC[C@@H](OC(C)=O)C(=O)NC1CCN(C2CCN(C(=O)[C@H](C)Br)CC2)CC1 1835755298 ZSUYLISGPMIMIM-SCLBCKFNSA-N 490.395 0.836 50 20 JCGD Cc1cc(C(=O)N2CCOC[C@]3(C2)CN(C(=O)c2ccc(B(O)O)cc2)CCO3)cc(C)c1O 1835934215 PWKJOANACGMROH-DEOSSOPVSA-N 468.315 0.073 50 20 JCGD Cc1cnn(CC(=O)N2CCO[C@@]3(COCCN(C(=O)[C@H](CCl)NC(=O)OC(C)(C)C)C3)C2)c1 1836194639 ABNODZHPTMGTQS-JTSKRJEESA-N 499.996 0.780 50 20 JCGD O=C(NC1CCN(C2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)c1ccc(O)c([N+](=O)[O-])c1 1836432057 OSMOKJFOXWILFJ-UHFFFAOYSA-N 496.329 0.479 50 20 JCGD O=C(NC1(C(=O)N2CCO[C@@]3(COCCN(C(=O)[C@@H](O)CCl)C3)C2)CC1)OCc1ccccc1 1836688957 HIRXDEIVQAFYIN-PGRDOPGGSA-N 495.960 0.502 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(OC2CCN(C(=O)c3cccc(=O)n3O)CC2)CC1 1837288774 LJLIKHZMWAKYMG-UHFFFAOYSA-N 463.535 0.071 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(COCCN(C(=O)c3c(F)ccc(O)c3F)C2)C1 1837459529 HYOMFPUAHAYMQT-JOCHJYFZSA-N 491.451 0.053 50 20 JCGD O=C(CCc1ccc[nH]1)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1 1837920863 KDNTXLSIZLPNEF-UHFFFAOYSA-N 453.348 0.940 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CCC(OC2CCN(C(=O)CCC(=O)NN(C)C)CC2)CC1)C(C)C 1838360864 BHZKEOIMRQCEFD-JOCHJYFZSA-N 468.595 0.946 50 20 JCGD COC[C@H](Cl)C(=O)N1CCC(OC2CCN(C(=O)[C@H](COC(C)=O)OC(C)=O)CC2)CC1 1838401101 YRMKEEJDQPNRCU-OALUTQOASA-N 476.954 0.734 50 20 JCGD CC(=O)Oc1ccc([N+](=O)[O-])cc1C(=O)N1CCO[C@@]2(COCCN(C(=O)c3ccncn3)C2)C1 1838528339 ROIBNWKKTFQSMK-QFIPXVFZSA-N 485.453 0.694 50 20 JCGD C[C@@H](C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@](C)(Cl)CCl)C2)C1)N1CCN(C)CC1 1839105717 LUDGOGOVHBDGKQ-FFZOFVMBSA-N 465.422 0.315 50 20 JCGD C[C@@H](S)C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1840163152 NDNKGHNRAPBFBZ-VGOFRKELSA-N 479.603 0.107 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCO[C@]2(COCCN(C(=O)CSc3ccccc3)C2)C1 1840183772 ZCAVGMSNZDJKIO-JOCHJYFZSA-N 464.588 0.608 50 20 JCGD Cc1ccn2c(C(=O)N3CCOC[C@]4(CN(C(=O)CCC(=O)NN(C)C)CCO4)C3)cnc2c1 1840184807 CHVNRBGOQFSLOO-QHCPKHFHSA-N 472.546 0.086 50 20 JCGD CSc1ccc(CC(=O)N2CCO[C@@]3(COCCN(C(=O)c4cccc(B(O)O)c4)C3)C2)cc1 1840302756 JHIXNVHWJSIFGB-DEOSSOPVSA-N 484.383 0.401 50 20 JCGD COC(=O)NCC(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C#N)=C/c3ccc(F)cc3F)C2)C1 1840321839 PEFYXIYCQCMUBC-AGBQBWRISA-N 478.452 0.684 50 20 JCGD O=C(Cn1ccc2sccc2c1=O)N1CC2(CCCN2C(=O)c2cccc(B(O)O)c2)C1 1843013046 BKYUVSXPYBATCP-UHFFFAOYSA-N 451.313 0.260 50 20 JCGD CC(C)(C)OC(=O)N1C[C@@H]2CC[C@@]2(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)C1 1846129323 KKYAYASVVANANQ-AVRWGWEMSA-N 483.374 0.831 50 20 JCGD CC(C)(C)OC(=O)N[C@H]1C=C[C@@H](C(=O)N2CC[C@H]3[C@@H]2CCN3C(=O)c2ccc(B(O)O)cc2)C1 1848092779 BQHPNGDTGPLBOC-GTAWCEEGSA-N 469.347 0.651 50 20 JCGD CCS(=O)(=O)N1CCC(C(=O)NNC(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)CC1 14847373 PKWNZLUOUQLKHG-UHFFFAOYSA-N 472.589 0.294 50 20 JCGD CSCC[C@@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)NNC(=O)CNC(=O)c1ccco1 725740044 QPRKTSOUYFUVMP-OAHLLOKOSA-N 468.557 0.565 50 20 JCGD O=C(CCc1ccc(S(=O)(=O)N2CCOCC2)cc1)NNC(=O)NCc1nccn1C(F)F 726708822 IATZGHCXPPAJCW-UHFFFAOYSA-N 486.501 0.762 50 20 JCGD C[C@@H](NS(C)(=O)=O)C(=O)NNS(=O)(=O)c1c(Br)cc(F)cc1Br 728510895 XQHYXKRHSMCIIQ-RXMQYKEDSA-N 497.162 0.598 50 20 JCGD COc1cc2c(cc1OC)[C@H](CC(=O)NNC(=O)NC[C@@H](C)N(C)C1CC1)N(S(C)(=O)=O)CC2 729617240 JTYXFXCDAQGWNS-KDOFPFPSSA-N 497.618 0.766 50 20 JCGD O=C(NNC(=O)[C@H]1CC(=O)N(CCN2CCOCC2)C1)c1ccc(F)cc1Br 746392359 BQSWCJXGQLSIJO-LBPRGKRZSA-N 457.300 0.530 50 20 JCGD CC(=O)[C@@H]1CC(C(=O)NNC(=O)CN(C)S(=O)(=O)c2ccc(C)cc2)=NN1c1ccccc1 751290484 KYYRZTJJCLNLHS-FQEVSTJZSA-N 471.539 0.987 50 20 JCGD Cc1csc(CC(=O)NNC(=O)COC(=O)c2cc(S(=O)(=O)NC3CC3)ccc2C)n1 811846717 KHNVVFZNWBNZFY-UHFFFAOYSA-N 466.541 0.748 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CCN2C(=O)[C@H]3CCCC[C@H]3C2=O)cc1 913500040 FHWIXRLJGIMECT-CALCHBBNSA-N 464.544 0.328 50 20 JCGD CC(C)Cn1cnc2c1c(=O)n(CC(=O)NNC(=O)NC(C)C)c(=O)n2Cc1ccccc1 915879041 ZQSHBDQESQURKP-UHFFFAOYSA-N 455.519 0.803 50 20 JCGD C#CCNC(=O)NNC(=O)Cn1c(=O)c2c(ncn2Cc2ccccc2)n(Cc2ccccc2)c1=O 915908405 ZATQDIRQCCELTB-UHFFFAOYSA-N 485.504 0.420 50 20 JCGD Cc1ccc(S(=O)(=O)N(C)CC(=O)NNC(=O)CNC(=O)Cc2cccc(F)c2)cc1 916112421 LETQGBNEXAPNLH-UHFFFAOYSA-N 450.492 0.261 50 20 JCGD CN(C)S(=O)(=O)c1cccc(C(=O)NNC(=O)N[C@H](CN2CCOCC2)c2ccccc2)c1 916216285 CICGJJAZYLMYLW-HXUWFJFHSA-N 475.571 0.954 50 20 JCGD CC(C)NS(=O)(=O)Cc1ccccc1CNC(=O)NNC(=O)c1nn(C)c(=O)c2ccccc12 916228399 BCIFXINTLTZMTG-UHFFFAOYSA-N 486.554 0.906 50 20 JCGD COCCNS(=O)(=O)c1ccc(CNC(=O)NNC(=O)COc2ccccc2C#N)cc1 916649804 VKHWBKXSVSICJK-UHFFFAOYSA-N 461.500 0.392 50 20 JCGD O=C(Cc1nc2ncccn2n1)NNC(=O)c1cccc(S(=O)(=O)NCc2ccccc2)c1 917906544 DGTFYSXWXVQEIU-UHFFFAOYSA-N 465.495 0.607 50 20 JCGD O=C(CNS(=O)(=O)c1ccc2c(c1)OCCCO2)NNC(=O)c1ccc(Cl)cc1O 918357508 FROPQVGEBQBTIN-UHFFFAOYSA-N 455.876 0.946 50 20 JCGD CCC(=O)N1CCCC[C@@H]1C(=O)NNC(=O)CCc1ccc(S(=O)(=O)N2CCOCC2)cc1 918543742 ONMWPGOGVMRBEW-LJQANCHMSA-N 480.587 0.579 50 20 JCGD C[C@H]1CCCN(C[C@@H](C)NC(=O)NNC(=O)c2cccc(S(=O)(=O)N3CCOCC3)c2)C1 919914207 CXGDTJLINSCHRZ-DLBZAZTESA-N 467.592 0.772 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@]2(CCN(C(=O)c3cn4ccc(Cl)cc4n3)C2)C1 1778060868 UADHYCDNBGKQPV-QFIPXVFZSA-N 483.916 0.744 50 20 JCGD CN1CCc2cc(C(=O)NC[C@@]34CCCO[C@@H]3CCN(C(=O)c3cccc(B(O)O)c3)C4)ccc21 1778644225 FBNCFBVOTNWWGJ-ZEQKJWHPSA-N 477.370 0.800 50 20 JCGD O=C(NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1cccc(B(O)O)c1)C2)c1ccc2nccnc2c1 1778680300 WKFRNTKUXCPEPL-RCZVLFRGSA-N 474.326 0.751 50 20 JCGD CC(=O)N1CCN(CC(=O)NC[C@@]23CCCO[C@@H]2CCN(C(=O)[C@@H](F)Br)C3)CC1 1778912254 XIDVMGYBGFZTEF-SZVBFZGTSA-N 477.375 0.355 50 20 JCGD CC(C)N1CCC(C(=O)N2CCO[C@@]3(CCN(C(=O)c4cnccc4C(=O)NN)C3)C2)CC1 1779028372 KDWYVDPHCXNFNK-HSZRJFAPSA-N 458.563 0.249 50 20 JCGD NNC(=O)c1ccncc1C(=O)NC[C@@]12CCCO[C@@H]1CCN(C(=O)c1ccc3ncnn3c1)C2 1779372639 QUUWFPNIQULAQI-WZONZLPQSA-N 478.513 0.169 50 20 JCGD C[C@H](CBr)C(=O)N1CCO[C@@]2(CCN(C(=O)c3cc(=O)nc4cccnn34)C2)C1 1780058206 QNOCCAVQJMIWMQ-BFUOFWGJSA-N 464.320 0.564 50 20 JCGD C=CCNC(=O)/C=C\C(=O)N1CCO[C@]2(CCN(C(=O)c3cc([N+](=O)[O-])ccc3OC(C)=O)C2)C1 1780095609 URFAMIUXHRNICM-KSEXMQBYSA-N 486.481 0.822 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCO[C@@]2(CCN(C(=O)C3CCN(c4ccccn4)CC3)C2)C1 1780957840 WJLLSKHMROGCNU-RUZDIDTESA-N 493.568 0.440 50 20 JCGD CN(CC(=O)N1CC[C@@]2(CN(C(=O)COc3cccnc3)CCO2)C1)NC(=O)NCc1ccccc1 1780968769 JPKPTROJGRVVFL-VWLOTQADSA-N 496.568 0.637 50 20 JCGD CC[C@@H](Br)C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)CN(C)C(=O)C(=O)O)C1 1781542834 XIUMCQQOQYSLCJ-SNUQEOBHSA-N 462.341 0.217 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2OCCC[C@@]2(CNC(=O)c2cncc(O)c2)C1 1782040664 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Cc1cccnc1CCC(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3ccc(B(O)O)cc3)[C@H]2C1 1786980237 YIIVFFJACGNTBY-VCOUNFBDSA-N 451.332 0.296 50 20 JCGD O=C(NC[C@@H]1OC[C@@H]2CCN(C(=O)COc3cc(Cl)ccn3)C[C@@H]21)c1cccc(B(O)O)c1 1786984187 OYGHEPDRXUTDIX-SNRMKQJTSA-N 473.722 0.087 50 20 JCGD Cc1ccc(OC(C)(C)C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)nc1 1788610232 RJDNBUIIKYEONI-VDGAXYAQSA-N 496.568 0.839 50 20 JCGD Cc1nc(C(=O)N2CC[C@H]3CO[C@@H](CNC(=O)c4cnccc4C(=O)NN)[C@H]3C2)ccc1F 1788611489 FEXUWHKVDNSOEQ-AXHNFQJDSA-N 456.478 0.435 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H]2CO[C@@H](CNC(=O)c3cccc(F)c3F)[C@H]2C1 1789636343 QPCWMCXUDIGKSM-IWEFOYFVSA-N 459.453 0.870 50 20 JCGD CC(C)NC(=O)OC(C)(C)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)C[C@@H]21 1789752922 KPYVJJBZXYKRFT-ULQDDVLXSA-N 469.583 0.252 50 20 JCGD COc1cccc2c1C[C@H](C(=O)NC[C@@H]1OC[C@@H]3CCN(C(=O)c4ccc(B(O)O)cc4)C[C@@H]31)CC2 1790762601 PNZSAPMAXWSGJN-YGDRIEADSA-N 492.381 0.773 50 20 JCGD COC[C@H](Cl)C(=O)NC[C@@H]1OC[C@@H]2CCN(C(=O)[C@@H](CCO)NC(=O)OC(C)(C)C)C[C@@H]21 1791249098 FENZQHBGCUOVRS-VIQHNZTISA-N 477.986 0.496 50 20 JCGD CS(=O)(=O)c1ccc(CC(=O)N[C@@H]2[C@H]3COC[C@@H]2CN(C(=O)[C@H](F)Br)C3)cc1 1795415753 DCKFFOPCBFLRSD-RMHZUWNSSA-N 477.352 0.913 50 20 JCGD COc1ccc([C@H]2C[C@H]2C(=O)N2C[C@@H]3COC[C@H](C2)[C@@H]3NC(=O)c2ccc(B(O)O)cc2)cc1 1795732950 RTUURBNUUZOORW-NQDIBGKZSA-N 464.327 0.382 50 20 JCGD CC(C)(C)OC(=O)C(C)(C)CC(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)c1ccc(B(O)O)cc1 1795735302 XFHCSCDWXTXDTH-XEMDLRDOSA-N 474.363 0.328 50 20 JCGD COC[C@H](NC(=O)OC(C)(C)C)C(=O)N1[C@H]2CC[C@@H]1C[C@H](NC(=O)c1cnccc1C(=O)NN)C2 1796841970 UJATWCIXBNRDQQ-KRXQYRFLSA-N 490.561 0.477 50 20 JCGD Cc1ccc2cc(C(=O)N[C@@H]3[C@H]4COC[C@@H]3CN(C(=O)c3ccc(B(O)O)cc3)C4)ccc2n1 1797008155 BRPKSMMTIUKRMW-JHDGKUDLSA-N 459.311 0.740 50 20 JCGD NNC(=O)c1ccncc1C(=O)N[C@@H]1[C@H]2COC[C@@H]1CN(C(=O)c1ccc(OC(F)F)cc1F)C2 1797752779 HAISDXNPMDIIOX-KSPBDQMDSA-N 493.442 0.943 50 20 JCGD Cc1nccn1[C@@H](C)C(=O)N1C[C@@H]2COC[C@H](C1)[C@@H]2NC(=O)CN(C)NC(=O)NCc1ccccc1 1799099385 VYPGWFZLMXGCTE-JDLLUZBXSA-N 497.600 0.688 50 20 JCGD Cc1c(C(=O)NC[C@H]2CCN(C(=O)c3cnccc3C(=O)NN)[C@@H]2c2cccnc2)cnn1C 1805925289 CBCBSVQXXIRIQF-OXQOHEQNSA-N 462.514 0.755 50 20 JCGD NC[C@H](C(=O)NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)c1ccccc1 1807251084 FUPULCPBEIVCJG-NHTMILBNSA-N 472.354 0.824 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2[nH]nc3ncccc23)[C@H]1c1cccnc1)c1ccc(B(O)O)cc1 1807361037 GFUPLYZUIFOJAK-UTKZUKDTSA-N 470.298 0.666 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)NC[C@H]1CCN(C(=O)COCCO)[C@H]1c1cccnc1 1808416133 FBZWAZNIZONDOX-QOZRKGCKSA-N 456.503 0.230 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CC[C@H](CNC(=O)c2cnc3ncccn23)[C@H]1c1cccnc1 1809329826 LUFYEKDQMIJSKT-OXQOHEQNSA-N 485.508 0.756 50 20 JCGD O=C(NC[C@H]1CCN(C(=O)c2cccc(B(O)O)c2)[C@H]1c1cccnc1)C(=O)Nc1cccnc1 1810463449 SFBBYFJQLHRRBA-NQIIRXRSSA-N 473.298 0.115 50 20 JCGD CN(C)c1ccc(C(=O)NC[C@@H]2CCN(C(=O)c3cccc(B(O)O)c3)[C@H]2c2cccnc2)cn1 1811065767 BAXVBVKXDYRAJY-CVDCTZTESA-N 473.342 0.856 50 20 JCGD COc1ccc(C(=O)NC[C@@H]2CCN(C(=O)CCC(=O)NN(C)C)[C@H]2c2cccnc2)nn1 1811208719 COZKHXJEPRWVFF-KKSFZXQISA-N 455.519 0.573 50 20 JCGD CC[C@H](Br)C(=O)N1CC[C@H](CNC(=O)CN(C)C(=O)C(=O)O)[C@H]1c1cccnc1 1812392607 UAQBZYIOQMLALT-IJEWVQPXSA-N 469.336 0.804 50 20 JCGD CCCNC(=O)CCC(=O)Nc1cc([C@@H]2CCCCN2C(=O)c2cccc(B(O)O)c2)[nH]n1 1815109561 UHKSGUBWUGQKFY-SFHVURJKSA-N 455.324 0.702 50 20 JCGD C[C@](O)(C(=O)N[C@H]1CCc2nc(NC(=O)c3ccc(B(O)O)cc3)sc2C1)C(F)(F)F 1815337109 MXTHBEGHDHOCEO-GTNSWQLSSA-N 457.239 0.362 50 20 JCGD O=C(Nc1nc2c(s1)C[C@@H](NC(=O)c1cccn(C(F)F)c1=O)CC2)c1cccc(B(O)O)c1 1815360207 BPCBFBNKODKLGB-ZDUSSCGKSA-N 488.281 0.919 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCCC[C@H]1c1cc(NC(=O)Cn2cc([N+](=O)[O-])cn2)n[nH]1 1815822816 DSMFJPOHYBHHQP-HNNXBMFYSA-N 461.483 0.580 50 20 JCGD CC(=O)NCC(C)(C)C(=O)N1CCCC[C@@H]1c1cc(NC(=O)c2cccc(B(O)O)c2)n[nH]1 1817473856 CQEDJWRNDSNHGS-GOSISDBHSA-N 455.324 0.558 50 20 JCGD NNC(=O)c1ccncc1C(=O)Nc1nc2c(s1)C[C@H](NC(=O)Cc1ccc(O)cn1)CC2 1819800953 FAXPTUJQCNLMOZ-GFCCVEGCSA-N 467.511 0.711 50 20 JCGD O=C(N[C@H]1CCc2nc(NC(=O)c3cccn(C(F)F)c3=O)sc2C1)c1ccc(B(O)O)cc1 1820254219 XDWXEWQVDIKVEF-ZDUSSCGKSA-N 488.281 0.919 50 20 JCGD C[C@@H](Br)C(=O)Nc1cc([C@H]2CCCCN2C(=O)c2cc(=O)n3[nH]nnc3n2)[nH]n1 1822184514 UKAMGBWFMJLXQS-LDYMZIIASA-N 464.284 0.625 50 20 JCGD CCNC(=S)NCC(=O)N1CCCC[C@H]1c1cc(NC(=O)CCC(=O)NN(C)C)n[nH]1 1822416458 DIJWASGJQMWRJR-AWEZNQCLSA-N 452.585 0.259 50 20 JCGD COC(=O)NCC(=O)Nc1nc2c(s1)C[C@H](NC(=O)/C(C)=N/NC(=O)c1ccc[nH]1)CC2 1826499700 LJMIFNZIVPVHMQ-IVWJEFBKSA-N 461.504 0.545 50 20 JCGD CN1CCN(CCC(=O)N2CCC([C@@H]3CCCCN3C(=O)CCC(=O)NN(C)C)CC2)CC1 1831871926 ZIKPPSLOEFRTIP-NRFANRHFSA-N 464.655 0.617 50 20 JCGD O=C(CCBr)N1CCOC[C@@]2(C1)CN(C(=O)Cn1nnc3ccccc31)CCO2 1832202355 ZVKULJQTOHTXGW-LJQANCHMSA-N 466.336 0.673 50 20 JCGD CCS(=O)(=O)N[C@@H](C)C(=O)N1CCC(N2CCC(NC(=O)[C@@H](C)CBr)CC2)CC1 1833264830 LXBWMMHUEYDPGX-GJZGRUSLSA-N 495.484 0.917 50 20 JCGD CS(=O)(=O)c1cncc(C(=O)N2CCO[C@]3(COCCN(C(=O)C(Cl)Cl)C3)C2)c1 1833401621 VKTCKSFRJQDDPU-QGZVFWFLSA-N 466.343 0.359 50 20 JCGD C[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cnc(OCF)cn3)CCO2)C1 1833574172 ZEMBPBGUUWXLRJ-YVEFUNNKSA-N 461.288 0.636 50 20 JCGD NNC(=O)c1ccncc1C(=O)N1CCC(N2CCC(NC(=O)C3CCOCC3)CC2)CC1 1834546489 ZCZXWBDIPVWGSJ-UHFFFAOYSA-N 458.563 0.297 50 20 JCGD CN1CCN(CCC(=O)NC2CCN(C3CCN(C(=O)[C@H](F)Br)CC3)CC2)CC1 1834625071 XDRRUIKBIDPBJE-IBGZPJMESA-N 476.435 0.886 50 20 JCGD CC(C)(C)NCC(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1834696519 ALLHEVCRHASOAJ-UHFFFAOYSA-N 459.595 0.258 50 20 JCGD COc1cccc(CC(=O)N2CCC(N3CCC(NC(=O)c4cccc(B(O)O)c4)CC3)CC2)c1 1834801061 MJMYMSPCIKSTEN-UHFFFAOYSA-N 479.386 0.803 50 20 JCGD C[C@H](C(=O)NC1CCN(C2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1)n1cccc1C=O 1834806000 FZMHMYFWSWXVOP-GOSISDBHSA-N 480.374 0.427 50 20 JCGD CN(C)NC(=O)CCC(=O)N1CCC(N2CCC(NC(=O)Cc3cscn3)CC2)CC1 1834840928 JGUVMFVKGYLALJ-UHFFFAOYSA-N 450.609 0.630 50 20 JCGD C[Si](C)(C)OCC(=O)NC1CCN(C2CCN(C(=O)[C@H]3CCCS3(=O)=O)CC2)CC1 1835837356 IELUBKZRKZVCIH-GOSISDBHSA-N 459.685 0.987 50 20 JCGD O=C(c1ccc(B(O)O)cc1)N1CCO[C@@]2(COCCN(C(=O)c3ccc4cc(O)ccc4n3)C2)C1 1835928356 MGZCIIFXOHBABD-VWLOTQADSA-N 491.309 0.004 50 20 JCGD Cc1nccnc1C(=O)NC1CCN(C2CCN(C(=O)c3cnccc3C(=O)NN)CC2)CC1 1836013472 GAWPXBDISWZOPS-UHFFFAOYSA-N 466.546 0.283 50 20 JCGD CC[C@H](Br)C(=O)N1CCOC[C@]2(CN(C(=O)c3cn4cccnc4n3)CCO2)C1 1836894594 YFYLPHHUUVILCS-IFXJQAMLSA-N 466.336 0.973 50 20 JCGD Cc1ccn(CC(=O)N2CCC(OC3CCN(C(=O)c4cnccc4C(=O)NN)CC3)CC2)n1 1837191092 JAFZRSBUPGHGKE-UHFFFAOYSA-N 469.546 0.502 50 20 JCGD C[C@@H](CBr)C(=O)N1CCOC[C@]2(CN(C(=O)/C=C\C(=O)NC3CC3)CCO2)C1 1837247019 KYOOMHJJJGONFS-GAHBAMCVSA-N 458.353 0.309 50 20 JCGD CCn1nccc1C(=O)N1CCC(OC2CCN(C(=O)c3ccc(B(O)O)cc3)CC2)CC1 1837540698 QPJLQEZJLBFORP-UHFFFAOYSA-N 454.336 0.509 50 20 JCGD COc1cccc(CC(=O)N2CCOC[C@]3(CN(C(=O)CO[Si](C)(C)C)CCO3)C2)n1 1837710186 MRSPLGXJWNAQCI-OAQYLSRUSA-N 451.596 0.941 50 20 JCGD CC(=O)O[C@@H](C(=O)N1CCC(OC2CCN(C(=O)c3cccc(B(O)O)c3)CC2)CC1)C(C)C 1837921319 ZCZILKVFBQFSCL-JOCHJYFZSA-N 474.363 0.566 50 20 JCGD C/C(=N\NC(=O)c1ccc[nH]1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)c1cc(C(C)(C)C)n[nH]1)CCO2 1837990922 GLYJUOTVKZXWTG-NHVVDLMHSA-N 499.572 0.911 50 20 JCGD C[C@](Cl)(CCl)C(=O)N1CCO[C@]2(COCCN(C(=O)c3nc4ncccn4n3)C2)C1 1839153368 XRDYZCIQQHANDS-ROUUACIJSA-N 457.318 0.431 50 20 JCGD CC(=O)N/C(=C\c1ccco1)C(=O)N1CCOC[C@@]2(C1)CN(C(=O)[C@@H](F)Br)CCO2 1839201843 LANQESHSCTVEIS-NDBSJYDGSA-N 488.310 0.904 50 20 JCGD NC(=O)c1ccccc1C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](F)Br)C2)C1 1839351683 HGZTVAPCOCXDDQ-KDOFPFPSSA-N 458.284 0.546 50 20 JCGD C/C=C/C=C\C(=O)N1CCO[C@@]2(COCCN(C(=O)CN(C)NC(=O)NCc3ccccc3)C2)C1 1839836341 NVTAGJQAWMQGFC-UEISIHFFSA-N 485.585 0.921 50 20 JCGD CC[C@H](Br)C(=O)N1CCO[C@@]2(COCCN(C(=O)/C(C)=N/NC(=O)c3ccc[nH]3)C2)C1 1839964317 NNTJHXMKWMEMRG-BUFPBVFASA-N 498.378 0.750 50 20 JCGD COC(=O)N(CC(=O)N1CCO[C@@]2(COCCN(C(=O)[C@H](O)CCl)C2)C1)Cc1ccccc1 1840083645 QKSAWZQJZDRRMV-GCJKJVERSA-N 483.949 0.311 50 20 JCGD COC[C@@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)COc3cccc(N(C)C)c3)C2)C1 1840151034 VARJILTZHPWIKT-KNQAVFIVSA-N 469.966 0.842 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@]2(COCCN(C(=O)[C@@H](NC(C)=O)c3ccc(F)cc3)C2)C1 1840154273 RHCKMJDFMSMLAN-CNNODRBYSA-N 485.940 0.713 50 20 JCGD COC[C@H](Cl)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)NC(=O)OC(C)(C)C)C2)C1 1840156330 QVKYAAHZZNAXLC-QEEYODRMSA-N 463.959 0.610 50 20 JCGD CC(C)(C)OC(=O)N1C[C@H](O)[C@H](C(=O)N2CCOC[C@]3(CN(C(=O)C(Cl)Cl)CCO3)C2)C1 1840189494 VDTGYTGPSJKIOJ-LAPQFRIASA-N 496.388 0.474 50 20 JCGD COC[C@H](Cl)C(=O)N1CCOC[C@@]2(CN(C(=O)c3ccc([N+](=O)[O-])c(OC)c3)CCO2)C1 1840758984 JNZHLTSDDJVAQD-MGPUTAFESA-N 471.894 0.927 50 20 JCGD CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCO[C@]2(COCCN(C(=O)CCC(=O)NN(C)C)C2)C1 1840806262 OYOZNZCIXBZQHZ-SBUREZEXSA-N 499.609 0.119 50 20 JCGD CCC[C@H](NC(C)=O)C(=O)N1CCO[C@@]2(COCCN(C(=O)[C@@H](C)CBr)C2)C1 1840850893 FYJKETGCLKZJRQ-URLQWDBASA-N 462.385 0.779 50 20 JCGD COc1cccc(N2C[C@H](C(=O)N3CCCC34CN(C(=O)c3cnccc3C(=O)NN)C4)CC2=O)c1 1841008971 SURNHRLFYCRQCZ-MRXNPFEDSA-N 492.536 0.564 50 20 JCGD C=CC[C@H](NC(=O)OC(C)(C)C)C(=O)N1CCCC12CN(C(=O)c1ccc(B(O)O)cc1)C2 1841746656 WZEYDOOIFXYMAH-SFHVURJKSA-N 457.336 0.653 50 20 JCGD COc1ccc(C(=O)N2CCCC23CN(C(=O)c2ccc(B(O)O)cc2)C3)nc1Br 1844613051 JMFLSFMELBFETR-UHFFFAOYSA-N 474.120 0.663 50 20 JCGD O=C(c1cccc(B(O)O)c1)N1CC2(CCCN2C(=O)Cc2[nH]nc3c(Cl)cccc23)C1 1845023885 MJOKAZBJJITGPQ-UHFFFAOYSA-N 452.707 0.956 50 20 JCGD